data_2lpy_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 2lpy _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.743 0 N-CA-C 111.2 -0.76 . . . . 0.0 111.2 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 97.2 mm-40 -60.01 -21.58 61.49 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.911 0.386 . . . . 0.0 110.315 -179.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 82.8 tt0 -56.23 -22.62 30.68 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.468 179.705 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 34.2 tp -41.63 -28.54 0.14 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.373 -179.681 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 78.2 p -57.73 -36.97 72.76 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 120.662 -0.415 . . . . 0.0 110.112 -179.762 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 88.0 mt-30 -64.28 -33.04 74.92 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.573 179.431 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 58.5 t-80 -61.85 -45.62 92.99 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.596 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 98.1 mt-10 -59.84 -44.84 93.88 Favored 'General case' 0 C--O 1.243 0.718 0 CA-C-O 121.243 0.544 . . . . 0.0 110.111 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.408 ' O ' ' N ' ' A' ' 14' ' ' GLN . 77.9 mmt-85 -62.27 -33.47 74.69 Favored 'General case' 0 C--O 1.214 -0.813 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 179.235 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 40.7 t80 -59.96 -37.29 79.14 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 120.548 -0.461 . . . . 0.0 110.353 -179.762 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 3.4 t -61.62 -48.28 89.45 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 C-N-CA 119.75 -0.78 . . . . 0.0 110.888 179.885 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 98.4 mt-10 -82.02 -46.85 13.38 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 120.038 -0.665 . . . . 0.0 111.66 -179.554 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . 0.408 ' N ' ' O ' ' A' ' 10' ' ' ARG . 71.2 tp60 -58.3 -51.38 70.04 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.89 -0.595 . . . . 0.0 111.201 -179.131 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -63.48 -46.12 87.65 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-O 120.991 0.424 . . . . 0.0 109.933 179.875 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 91.8 mttt -58.32 -35.54 72.02 Favored 'General case' 0 C--N 1.329 -0.284 0 O-C-N 121.962 -0.461 . . . . 0.0 110.478 179.359 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 93.2 mt-30 -71.91 -36.25 69.94 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.369 178.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.16 -38.68 80.31 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.087 179.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.5 mt -79.88 -28.01 39.96 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.965 0.412 . . . . 0.0 110.581 179.293 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 65.1 tttm -55.29 -39.81 70.31 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.243 -179.337 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 1.5 t -74.13 -18.18 60.83 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.877 -179.821 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 62.8 mmt-85 -77.22 -0.19 24.28 Favored 'General case' 0 C--N 1.331 -0.2 0 C-N-CA 120.672 -0.411 . . . . 0.0 110.202 179.544 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 106.67 13.57 21.84 Favored Glycine 0 N--CA 1.466 0.7 0 N-CA-C 110.884 -0.886 . . . . 0.0 110.884 -179.554 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 17.9 t -100.86 168.74 1.83 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 N-CA-C 110.441 -0.207 . . . . 0.0 110.441 -179.838 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -125.54 137.9 53.95 Favored 'General case' 0 C--O 1.233 0.209 0 N-CA-C 110.175 -0.306 . . . . 0.0 110.175 179.591 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 3.2 m -135.63 107.12 6.9 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.374 0 CA-C-O 120.761 0.315 . . . . 0.0 110.801 -179.651 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.465 ' O ' ' N ' ' A' ' 30' ' ' ASP . 27.8 pttt -108.55 165.83 11.23 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-O 120.75 0.309 . . . . 0.0 110.527 179.979 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 81.6 t80 -47.97 -38.52 17.02 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-O 121.04 0.447 . . . . 0.0 109.884 179.442 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -56.98 -23.08 43.26 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.021 -0.536 . . . . 0.0 109.984 179.041 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.465 ' N ' ' O ' ' A' ' 27' ' ' LYS . 58.2 t0 -62.26 -44.36 96.72 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.559 -179.594 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.518 ' O ' ' CB ' ' A' ' 35' ' ' PHE . 5.6 mp -67.47 -41.29 84.87 Favored 'General case' 0 C--O 1.213 -0.828 0 CA-C-O 121.164 0.507 . . . . 0.0 109.694 179.184 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 49.4 mt -56.97 -44.57 82.77 Favored 'General case' 0 C--N 1.313 -0.987 0 C-N-CA 119.715 -0.794 . . . . 0.0 111.26 -178.605 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -84.31 -50.86 7.45 Favored 'General case' 0 C--N 1.32 -0.702 0 C-N-CA 120.666 -0.413 . . . . 0.0 111.617 -179.013 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 59.7 t80 -63.48 -48.27 78.35 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.47 -178.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.518 ' CB ' ' O ' ' A' ' 31' ' ' LEU . 17.4 t80 -61.97 -44.47 96.68 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 110.009 -0.367 . . . . 0.0 110.009 -179.442 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 92.4 m-20 -70.39 -37.96 74.6 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 120.717 -0.393 . . . . 0.0 111.683 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.472 ' CE2' ' CE2' ' A' ' 63' ' ' PHE . 2.7 m-85 -62.34 -50.46 71.52 Favored 'General case' 0 N--CA 1.464 0.253 0 N-CA-C 112.116 0.413 . . . . 0.0 112.116 -178.629 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . 0.533 ' O ' ' N ' ' A' ' 42' ' ' CYS . 13.9 m -68.17 -42.58 84.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 C-N-CA 120.541 -0.463 . . . . 0.0 110.493 -179.599 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 43.3 mmtt -64.24 -28.5 69.77 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.069 179.872 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 67.3 t0 -54.2 -49.24 69.84 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 120.725 -0.39 . . . . 0.0 110.542 -179.309 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' THR . . . . . 0.509 ' O ' ' SG ' ' A' ' 42' ' ' CYS . 12.1 p -113.38 -2.77 13.89 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.026 179.766 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . 0.533 ' N ' ' O ' ' A' ' 38' ' ' VAL . 29.8 p 37.72 57.6 4.48 Favored Pre-proline 0 N--CA 1.465 0.3 0 CA-C-N 116.484 -0.325 . . . . 0.0 110.553 -179.223 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 69.7 Cg_endo -76.54 -33.23 3.26 Favored 'Trans proline' 0 C--N 1.31 -1.461 0 C-N-CA 122.538 2.159 . . . . 0.0 112.806 -179.062 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . 0.594 ' HE1' ' H ' ' A' ' 52' ' ' ASP . 0.0 OUTLIER -75.94 2.36 12.78 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.711 -179.775 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 0.514 ' C ' ' H ' ' A' ' 47' ' ' GLN . 16.7 m-85 50.14 51.41 10.64 Favored Pre-proline 0 C--N 1.327 -0.397 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.02 -179.786 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.489 ' CD ' ' N ' ' A' ' 45' ' ' PHE . 10.1 Cg_endo -51.14 -7.24 0.14 Allowed 'Trans proline' 0 C--N 1.308 -1.587 0 C-N-CA 122.805 2.337 . . . . 0.0 111.973 -179.783 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.514 ' H ' ' C ' ' A' ' 45' ' ' PHE . 99.5 mm-40 -62.21 -52.8 62.31 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.627 -179.576 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 55.1 tt0 -88.3 -12.86 42.31 Favored 'General case' 0 N--CA 1.466 0.326 0 C-N-CA 120.569 -0.452 . . . . 0.0 110.387 179.713 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 71.73 69.05 1.46 Allowed Glycine 0 CA--C 1.524 0.651 0 N-CA-C 110.486 -1.045 . . . . 0.0 110.486 -179.504 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 3.0 t -136.39 161.31 36.16 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.712 0.291 . . . . 0.0 110.945 -179.249 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.1 mt -99.92 139.75 20.75 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.248 0 CA-C-O 120.98 0.419 . . . . 0.0 110.29 179.428 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . 0.594 ' H ' ' HE1' ' A' ' 44' ' ' TRP . 4.9 t70 -125.44 120.83 32.08 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.588 -0.733 . . . . 0.0 109.648 179.405 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 20.1 mm -88.04 -44.74 15.87 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.834 -179.26 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 65.4 tttm -66.92 -51.45 55.15 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-O 121.077 0.465 . . . . 0.0 111.618 -179.718 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 79.3 mmt-85 -62.09 -32.52 73.08 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.807 -0.442 . . . . 0.0 109.807 -179.665 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' TRP . . . . . 0.594 ' CE3' ' CH2' ' A' ' 44' ' ' TRP . 29.9 t-105 -57.59 -39.72 77.42 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 120.564 -0.454 . . . . 0.0 110.097 -179.897 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -65.22 -37.81 88.44 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.981 -0.554 . . . . 0.0 109.944 179.544 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . 0.46 ' O ' ' SG ' ' A' ' 62' ' ' CYS . 68.6 ttt180 -61.24 -53.35 58.02 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 120.67 -0.412 . . . . 0.0 111.144 -179.723 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 3.5 p -64.46 -43.87 96.97 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.507 0 CA-C-O 120.721 0.296 . . . . 0.0 110.274 179.695 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -62.65 -40.4 99.12 Favored Glycine 0 CA--C 1.524 0.645 0 N-CA-C 111.047 -0.821 . . . . 0.0 111.047 179.741 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . 0.43 ' O ' ' OD1' ' A' ' 61' ' ' ASP . 67.9 t0 -64.17 -37.8 88.76 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.742 0.306 . . . . 0.0 110.929 -179.688 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' CYS . . . . . 0.46 ' SG ' ' O ' ' A' ' 58' ' ' ARG . 67.5 m -60.55 -53.08 61.77 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.911 -179.367 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . 0.472 ' CE2' ' CE2' ' A' ' 37' ' ' PHE . 44.3 m-85 -68.97 -37.03 78.55 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.725 179.457 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 69.5 tp60 -59.71 -43.34 94.16 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.867 0.365 . . . . 0.0 110.358 -179.805 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 18.4 t0 -60.56 -50.77 72.21 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.568 179.707 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' TYR . . . . . 0.465 ' O ' ' OG1' ' A' ' 69' ' ' THR . 70.9 t80 -66.36 -26.16 67.14 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.113 179.749 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 59.2 t80 -73.36 -42.08 62.65 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.612 179.882 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . 0.473 ' O ' ' N ' ' A' ' 71' ' ' GLY . 94.0 m-20 -63.35 -37.1 85.97 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.025 -179.14 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.465 ' OG1' ' O ' ' A' ' 66' ' ' TYR . 40.5 p -48.35 -17.08 0.12 Allowed 'General case' 0 N--CA 1.464 0.256 0 C-N-CA 120.786 -0.366 . . . . 0.0 110.664 -179.593 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . 0.418 ' N ' ' C ' ' A' ' 68' ' ' ASN . 90.3 m-85 -95.59 15.47 19.77 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 120.806 -0.358 . . . . 0.0 111.047 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . 0.473 ' N ' ' O ' ' A' ' 68' ' ' ASN . . . 38.0 59.18 1.46 Allowed Glycine 0 N--CA 1.471 1.018 0 N-CA-C 110.976 -0.85 . . . . 0.0 110.976 -179.451 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 69.4 Cg_endo -80.62 125.42 5.57 Favored 'Trans proline' 0 C--N 1.309 -1.5 0 C-N-CA 122.431 2.087 . . . . 0.0 112.223 -179.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 77.5 mm-40 -85.73 -39.2 17.43 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.885 179.771 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.641 ' CD ' ' H ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -62.58 -41.29 98.84 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.424 -0.807 . . . . 0.0 111.646 -179.752 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.452 ' C ' ' O ' ' A' ' 74' ' ' LYS . 29.0 t 31.77 93.05 0.05 OUTLIER Pre-proline 0 N--CA 1.463 0.212 0 O-C-N 123.296 0.373 . . . . 0.0 111.194 179.633 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 34.6 Cg_exo -55.63 125.62 19.73 Favored 'Trans proline' 0 C--N 1.311 -1.441 0 C-N-CA 121.442 1.428 . . . . 0.0 111.645 -179.073 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . 0.448 ' O ' ' N ' ' A' ' 80' ' ' PHE . 60.5 t -82.8 -19.61 10.09 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.452 179.576 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 10.3 p -41.56 -28.26 0.12 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.328 -179.187 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . 0.407 ' N ' ' C ' ' A' ' 77' ' ' VAL . . . -59.78 -41.48 91.22 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.371 179.724 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . 0.448 ' N ' ' O ' ' A' ' 77' ' ' VAL . 3.2 m-85 -63.21 -40.27 97.01 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.672 179.701 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 43.5 m -59.1 -42.12 89.75 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.866 -179.77 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 5.6 m-85 -60.05 -51.23 70.55 Favored 'General case' 0 C--N 1.331 -0.22 0 C-N-CA 120.813 -0.355 . . . . 0.0 110.74 -179.736 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' TRP . . . . . . . . . . . . . 32.9 t90 -58.48 -38.52 77.78 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.536 179.565 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 92.8 m-20 -61.51 -44.18 97.52 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 120.652 -0.419 . . . . 0.0 110.529 -179.475 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 23.7 tp -72.98 -56.06 5.68 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 120.328 -0.549 . . . . 0.0 110.242 179.403 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -54.88 -25.56 15.85 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 CA-C-O 120.9 0.381 . . . . 0.0 110.364 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 64.4 tttt -67.19 -50.64 60.21 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.576 179.83 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . 0.442 ' O ' ' OE1' ' A' ' 88' ' ' GLU . 1.0 OUTLIER -80.42 -19.89 45.15 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.917 -179.473 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.31 -44.82 95.63 Favored 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 120.549 -0.461 . . . . 0.0 110.327 -179.346 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 3.4 mt -64.28 -43.27 97.18 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 C-N-CA 120.007 -0.677 . . . . 0.0 109.991 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -47.94 -40.24 21.57 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.405 -0.362 . . . . 0.0 110.445 -179.09 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 43.1 mttm -60.02 136.29 57.97 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.991 0.424 . . . . 0.0 110.841 179.821 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -90.27 -8.96 49.63 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.192 -179.811 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 42.2 tp10 -66.45 -31.62 72.49 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.894 -0.593 . . . . 0.0 110.442 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 21.2 t -41.7 135.48 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.298 -0.41 . . . . 0.0 109.902 -179.66 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' ASN . . . . . 0.491 ' O ' ' N ' ' A' ' 98' ' ' GLN . 0.9 OUTLIER -40.48 157.22 0.17 Allowed Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.07 -178.833 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 40.9 Cg_exo -45.62 -13.0 0.07 OUTLIER 'Trans proline' 0 N--CA 1.492 1.414 0 C-N-CA 122.432 2.088 . . . . 0.0 112.209 179.23 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . 0.491 ' N ' ' O ' ' A' ' 96' ' ' ASN . 1.9 pt20 . . . . . 0 C--N 1.322 -0.601 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.742 -179.436 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 98.7 m . . . . . 0 C--O 1.231 0.095 0 CA-C-O 120.805 0.336 . . . . 0.0 110.577 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 67.3 mm-40 -66.27 -163.38 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.139 -179.908 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' GLU . . . . . 0.524 ' C ' ' H ' ' A' ' 110' ' ' LEU . 97.4 mt-10 -106.73 129.12 54.66 Favored 'General case' 0 CA--C 1.516 -0.346 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.009 179.073 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 38.9 pt -50.42 -11.84 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-N 116.075 -0.511 . . . . 0.0 109.928 179.645 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . 0.524 ' H ' ' C ' ' A' ' 108' ' ' GLU . 26.3 mt -64.41 -40.59 96.07 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.577 179.649 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -94.6 87.18 5.01 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.956 -179.895 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 50.2 m -63.24 -41.63 99.11 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.679 179.441 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 96.3 m-20 -137.18 -166.26 1.89 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.644 -179.565 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 77.8 p -64.02 -17.27 63.17 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.441 -179.832 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 84.4 mt-30 -56.13 -165.98 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.375 -179.915 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 77.0 p -83.34 -171.73 3.74 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.53 179.872 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 117' ' ' ASP . . . . . 0.424 ' OD1' ' N ' ' A' ' 117' ' ' ASP . 33.9 p-10 . . . . . 0 C--N 1.328 -0.327 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.763 -179.894 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.67 0 N-CA-C 110.972 -0.851 . . . . 0.0 110.972 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 99.4 mt-30 -64.97 -38.74 91.95 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.856 0.36 . . . . 0.0 110.601 179.857 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . 0.532 ' OE2' ' ND2' ' A' ' 96' ' ' ASN . 83.7 tt0 -52.88 -22.88 6.03 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.523 179.995 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 40.0 tp -42.12 -31.42 0.37 Allowed 'General case' 0 C--O 1.237 0.426 0 CA-C-O 121.016 0.436 . . . . 0.0 110.349 -179.625 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 70.4 m -56.34 -36.74 69.1 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.112 -0.495 . . . . 0.0 109.954 179.743 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . 0.4 ' N ' ' O ' ' A' ' 4' ' ' GLU . 57.6 tt0 -63.38 -34.82 78.56 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.586 179.537 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 73.6 t60 -60.29 -46.08 91.1 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.813 0.34 . . . . 0.0 110.277 -179.672 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 77.1 tt0 -61.17 -48.77 80.01 Favored 'General case' 0 C--O 1.244 0.804 0 CA-C-O 121.391 0.615 . . . . 0.0 110.288 179.552 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.412 ' O ' ' N ' ' A' ' 14' ' ' GLN . 85.9 mtm180 -62.47 -32.6 73.52 Favored 'General case' 0 C--O 1.213 -0.844 0 N-CA-C 108.624 -0.88 . . . . 0.0 108.624 179.462 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 26.4 t80 -58.68 -37.17 75.46 Favored 'General case' 0 C--N 1.324 -0.51 0 C-N-CA 120.41 -0.516 . . . . 0.0 110.186 -179.839 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 2.3 t -61.26 -50.69 79.41 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 C-N-CA 119.601 -0.84 . . . . 0.0 110.658 179.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 78.1 tt0 -81.66 -46.92 13.66 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 119.989 -0.684 . . . . 0.0 112.108 -179.215 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . 0.412 ' N ' ' O ' ' A' ' 10' ' ' ARG . 66.4 tp60 -57.61 -52.47 65.28 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.428 -179.018 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -63.31 -45.64 90.42 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 109.619 -0.512 . . . . 0.0 109.619 -179.693 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 87.7 mttt -57.25 -35.2 69.43 Favored 'General case' 0 C--N 1.332 -0.182 0 C-N-CA 120.511 -0.475 . . . . 0.0 110.365 179.36 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 81.6 mm-40 -71.07 -41.89 70.11 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.071 0.462 . . . . 0.0 110.616 178.988 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -54.21 -45.64 72.26 Favored 'General case' 0 C--O 1.223 -0.294 0 CA-C-N 116.02 -0.536 . . . . 0.0 109.641 179.931 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.444 ' O ' ' N ' ' A' ' 22' ' ' ARG . 4.7 mt -68.03 -35.23 77.92 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.888 0.375 . . . . 0.0 110.851 178.849 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 56.1 tttm -47.37 -37.57 11.45 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 -179.424 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' THR . . . . . 0.532 ' C ' ' H ' ' A' ' 23' ' ' GLY . 0.7 OUTLIER -64.56 -31.55 72.82 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.947 -0.569 . . . . 0.0 111.149 179.019 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.444 ' N ' ' O ' ' A' ' 19' ' ' LEU . 30.9 mmt-85 -73.16 21.3 0.08 Allowed 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 120.921 0.391 . . . . 0.0 110.761 -179.615 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . 0.532 ' H ' ' C ' ' A' ' 21' ' ' THR . . . 81.58 13.24 80.51 Favored Glycine 0 N--CA 1.466 0.652 0 N-CA-C 110.487 -1.045 . . . . 0.0 110.487 179.972 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 4.3 t -92.12 167.33 1.66 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 N-CA-C 110.082 -0.34 . . . . 0.0 110.082 179.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -129.52 134.49 47.8 Favored 'General case' 0 N--CA 1.455 -0.219 0 N-CA-C 110.149 -0.315 . . . . 0.0 110.149 179.64 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 2.6 m -132.03 105.7 10.04 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.371 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.141 179.927 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.455 ' O ' ' OD1' ' A' ' 30' ' ' ASP . 11.6 ttmt -107.99 162.08 14.35 Favored 'General case' 0 C--O 1.224 -0.276 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 179.822 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . 0.449 ' H ' ' HG2' ' A' ' 27' ' ' LYS . 93.6 m-85 -38.83 -33.33 0.11 Allowed 'General case' 0 C--O 1.235 0.334 0 CA-C-O 121.118 0.485 . . . . 0.0 110.823 179.837 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -52.62 -23.13 5.93 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.196 179.836 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.488 ' CG ' ' N ' ' A' ' 31' ' ' LEU . 21.6 p-10 -59.03 -54.19 49.87 Favored 'General case' 0 C--O 1.217 -0.646 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.763 -179.33 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.488 ' N ' ' CG ' ' A' ' 30' ' ' ASP . 0.5 OUTLIER -63.49 -40.07 96.12 Favored 'General case' 0 C--O 1.217 -0.619 0 C-N-CA 120.439 -0.504 . . . . 0.0 109.814 -179.724 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 45.7 mt -56.74 -50.21 72.93 Favored 'General case' 0 C--N 1.314 -0.959 0 C-N-CA 119.267 -0.973 . . . . 0.0 111.021 -178.76 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.415 ' O ' ' N ' ' A' ' 37' ' ' PHE . 88.1 tttt -85.54 -52.77 5.61 Favored 'General case' 0 C--N 1.32 -0.68 0 C-N-CA 120.317 -0.553 . . . . 0.0 112.031 -179.295 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . 0.462 ' CB ' ' O ' ' A' ' 30' ' ' ASP . 45.1 t80 -55.2 -47.8 74.76 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.027 -178.121 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.47 ' CB ' ' O ' ' A' ' 31' ' ' LEU . 14.7 t80 -61.2 -46.62 89.69 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 120.083 -0.647 . . . . 0.0 109.513 -179.794 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 98.1 m-20 -71.22 -23.65 62.05 Favored 'General case' 0 C--N 1.345 0.401 0 C-N-CA 120.511 -0.476 . . . . 0.0 111.404 179.949 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.415 ' N ' ' O ' ' A' ' 33' ' ' LYS . 7.5 t80 -61.28 -48.06 83.14 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.849 0.357 . . . . 0.0 110.403 -178.934 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . 0.555 ' O ' ' N ' ' A' ' 42' ' ' CYS . 6.6 m -77.85 -30.68 16.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.387 179.343 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -55.96 -30.1 61.21 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.44 -0.504 . . . . 0.0 110.545 -179.41 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 65.0 t0 -55.37 -63.97 0.99 Allowed 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 120.699 -0.4 . . . . 0.0 111.805 -179.208 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' THR . . . . . 0.428 ' C ' ' SG ' ' A' ' 42' ' ' CYS . 17.0 p -116.27 -19.77 10.06 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-O 120.98 0.419 . . . . 0.0 111.481 -179.559 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . 0.555 ' N ' ' O ' ' A' ' 38' ' ' VAL . 1.7 m 65.84 58.48 1.14 Allowed Pre-proline 0 CA--C 1.537 0.443 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.625 -178.461 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . 0.493 ' HD3' ' N ' ' A' ' 42' ' ' CYS . 11.8 Cg_exo -70.23 -37.35 8.17 Favored 'Trans proline' 0 N--CA 1.498 1.783 0 C-N-CA 122.891 2.394 . . . . 0.0 112.889 -179.409 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . 0.746 ' HE1' ' H ' ' A' ' 52' ' ' ASP . 0.0 OUTLIER -75.91 15.29 0.55 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.455 -179.387 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 0.458 ' H ' ' C ' ' A' ' 43' ' ' PRO . 62.1 m-85 41.57 53.65 7.47 Favored Pre-proline 0 C--N 1.332 -0.188 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.027 -179.879 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.439 ' CD ' ' N ' ' A' ' 45' ' ' PHE . 9.8 Cg_endo -52.39 -9.62 0.61 Allowed 'Trans proline' 0 C--N 1.308 -1.569 0 C-N-CA 122.803 2.335 . . . . 0.0 112.077 -179.883 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.443 ' H ' ' C ' ' A' ' 45' ' ' PHE . 98.3 mm-40 -64.99 -52.81 54.11 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.255 179.729 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 46.7 tp10 -87.02 -51.26 6.12 Favored 'General case' 0 N--CA 1.466 0.357 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 178.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 108.25 77.89 1.05 Allowed Glycine 0 CA--C 1.526 0.719 0 N-CA-C 109.619 -1.392 . . . . 0.0 109.619 -178.714 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 13.0 t -134.49 170.87 15.12 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 110.179 -0.304 . . . . 0.0 110.179 -179.106 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.1 mt -101.95 137.63 29.08 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.283 0 CA-C-O 121.027 0.441 . . . . 0.0 109.952 178.977 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . 0.746 ' H ' ' HE1' ' A' ' 44' ' ' TRP . 11.7 m-20 -117.15 121.21 40.64 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.646 -0.706 . . . . 0.0 111.377 179.807 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.404 HD11 HG21 ' A' ' 53' ' ' ILE . 22.9 mm -94.86 -56.14 5.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.756 179.045 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 67.7 mttm -75.86 -48.37 21.73 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-O 121.105 0.479 . . . . 0.0 111.364 -179.856 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 74.6 mtp85 -60.27 -32.46 71.2 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.253 179.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' TRP . . . . . 0.454 ' CE3' ' CZ3' ' A' ' 44' ' ' TRP . 22.8 t-105 -59.8 -38.8 82.94 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.133 178.727 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 85.7 mtp180 -65.22 -36.18 83.35 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 120.51 -0.476 . . . . 0.0 110.406 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 94.5 mtt180 -59.82 -50.15 74.94 Favored 'General case' 0 N--CA 1.466 0.359 0 C-N-CA 120.25 -0.58 . . . . 0.0 111.579 -179.175 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 3.2 p -64.4 -43.74 97.05 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.508 0 CA-C-O 120.809 0.337 . . . . 0.0 110.141 179.717 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -64.0 -35.51 92.09 Favored Glycine 0 CA--C 1.524 0.65 0 N-CA-C 111.072 -0.811 . . . . 0.0 111.072 179.611 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 97.3 m-20 -63.6 -36.53 84.1 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.659 0.266 . . . . 0.0 110.802 -179.694 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 63.4 m -65.58 -56.21 13.5 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 120.845 -0.342 . . . . 0.0 110.945 -179.713 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 59.4 m-85 -65.51 -37.22 86.14 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.721 179.819 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 55.8 tt0 -63.1 -40.14 96.76 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.675 -179.719 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 37.7 t0 -59.75 -51.03 71.53 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.449 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' TYR . . . . . 0.48 ' O ' ' OG1' ' A' ' 69' ' ' THR . 53.8 m-85 -69.08 -33.13 73.06 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.681 179.585 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 56.2 t80 -66.69 -44.09 82.7 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.983 0.42 . . . . 0.0 110.415 -179.641 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 94.1 m-20 -64.2 -39.09 93.26 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.425 -179.237 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.48 ' OG1' ' O ' ' A' ' 66' ' ' TYR . 44.8 p -48.24 -28.53 3.11 Favored 'General case' 0 CA--C 1.516 -0.342 0 C-N-CA 120.766 -0.374 . . . . 0.0 110.676 -179.125 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 67.5 m-85 -69.77 -35.82 75.24 Favored 'General case' 0 C--N 1.32 -0.686 0 C-N-CA 120.283 -0.567 . . . . 0.0 111.31 179.263 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . 0.51 ' N ' ' CD ' ' A' ' 72' ' ' PRO . . . 90.65 46.4 4.0 Favored Glycine 0 CA--C 1.533 1.185 0 N-CA-C 110.64 -0.984 . . . . 0.0 110.64 -178.457 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . 0.51 ' CD ' ' N ' ' A' ' 71' ' ' GLY . 66.8 Cg_endo -75.0 128.26 11.34 Favored 'Trans proline' 0 N--CA 1.49 1.285 0 C-N-CA 122.744 2.296 . . . . 0.0 111.861 -179.671 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 80.4 mm-40 -86.77 -38.63 16.71 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.342 0.591 . . . . 0.0 111.089 -179.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.627 ' CD ' ' H ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -59.12 -39.52 82.55 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 115.261 -0.882 . . . . 0.0 111.559 -179.436 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.516 ' C ' ' O ' ' A' ' 74' ' ' LYS . 41.6 t 20.87 90.0 0.05 OUTLIER Pre-proline 0 N--CA 1.466 0.349 0 O-C-N 124.074 0.859 . . . . 0.0 111.287 -179.972 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_exo -55.53 125.44 19.13 Favored 'Trans proline' 0 C--N 1.313 -1.307 0 C-N-CA 121.131 1.221 . . . . 0.0 111.613 -178.725 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . 0.475 ' O ' ' N ' ' A' ' 79' ' ' ALA . 89.4 t -83.8 -18.98 9.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 115.301 -0.863 . . . . 0.0 110.638 179.663 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' THR . . . . . 0.43 ' O ' ' OG ' ' A' ' 81' ' ' SER . 71.5 p -41.94 -22.55 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.707 -178.901 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . 0.475 ' N ' ' O ' ' A' ' 77' ' ' VAL . . . -61.94 -39.0 90.6 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.251 179.711 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 38.6 t80 -61.41 -40.39 94.22 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.464 179.956 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' SER . . . . . 0.43 ' OG ' ' O ' ' A' ' 78' ' ' THR . 82.8 p -58.36 -40.33 81.94 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.709 0.29 . . . . 0.0 110.727 -179.489 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 7.5 m-85 -60.46 -50.63 72.79 Favored 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 120.745 -0.382 . . . . 0.0 110.716 179.915 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' TRP . . . . . . . . . . . . . 55.6 t90 -58.34 -38.34 76.96 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.604 179.938 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 87.6 m-20 -61.29 -44.86 96.51 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 120.594 -0.442 . . . . 0.0 110.838 -179.364 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 29.1 tp -73.67 -57.15 4.19 Favored 'General case' 0 N--CA 1.449 -0.478 0 C-N-CA 120.262 -0.575 . . . . 0.0 110.194 179.552 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -52.59 -26.8 10.61 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 C-N-CA 120.531 -0.468 . . . . 0.0 110.454 179.667 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 63.7 tttt -66.81 -50.32 63.0 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.976 -0.557 . . . . 0.0 110.78 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . 0.413 ' O ' ' OE1' ' A' ' 88' ' ' GLU . 1.2 pp20? -80.02 -20.24 45.83 Favored 'General case' 0 C--N 1.319 -0.738 0 C-N-CA 120.302 -0.559 . . . . 0.0 110.899 -179.396 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.16 -46.94 86.73 Favored 'General case' 0 N--CA 1.447 -0.613 0 C-N-CA 120.72 -0.392 . . . . 0.0 110.324 -178.865 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 3.3 mt -63.79 -43.43 97.93 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.141 0 C-N-CA 120.121 -0.632 . . . . 0.0 109.695 -179.821 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 96.2 m-20 -48.92 -44.86 40.73 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.56 -178.817 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 95.0 mttt -64.35 147.9 51.56 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.933 0.397 . . . . 0.0 110.759 179.599 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 69.8 mmtt -81.63 8.0 10.89 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.261 -179.83 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 80.5 tt0 -61.11 -33.81 73.97 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.128 179.801 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 2.9 m -67.89 137.39 24.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.284 -0.417 . . . . 0.0 110.184 179.872 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' ASN . . . . . 0.532 ' ND2' ' OE2' ' A' ' 4' ' ' GLU . 0.0 OUTLIER -81.07 176.23 4.04 Favored Pre-proline 0 C--N 1.328 -0.354 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.93 -179.369 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_exo -57.95 -13.32 14.76 Favored 'Trans proline' 0 N--CA 1.495 1.606 0 C-N-CA 122.551 2.168 . . . . 0.0 112.268 179.428 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . 0.47 ' OE1' ' ND2' ' A' ' 96' ' ' ASN . 6.0 pt20 . . . . . 0 C--N 1.322 -0.605 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.785 -179.577 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 89.7 m . . . . . 0 C--O 1.232 0.168 0 CA-C-O 120.807 0.337 . . . . 0.0 110.248 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 86.3 mt-10 -77.98 172.64 13.19 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.244 -179.557 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' GLU . . . . . 0.511 ' C ' ' H ' ' A' ' 110' ' ' LEU . 94.8 mt-10 -106.2 124.42 49.56 Favored 'General case' 0 CA--C 1.513 -0.451 0 N-CA-C 109.85 -0.426 . . . . 0.0 109.85 179.129 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . 0.425 HD11 HG21 ' A' ' 109' ' ' ILE . 45.7 pt -48.66 -13.16 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.971 179.76 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . 0.511 ' H ' ' C ' ' A' ' 108' ' ' GLU . 33.0 mt -65.25 -42.22 93.5 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.596 179.778 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -69.01 -38.64 79.34 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.929 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 60.2 m -58.86 -43.63 90.88 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.835 -179.369 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 24.4 t-20 -66.76 -43.4 84.17 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.473 179.848 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 99.7 p -165.73 156.37 13.34 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.42 179.686 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 87.3 mt-30 -100.96 11.81 38.89 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.767 0.318 . . . . 0.0 110.567 179.81 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 41.0 p -65.58 -35.87 82.11 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.803 -179.797 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 55.2 m-20 . . . . . 0 C--N 1.329 -0.291 0 CA-C-N 116.467 -0.333 . . . . 0.0 110.281 -179.714 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.653 0 N-CA-C 110.912 -0.875 . . . . 0.0 110.912 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 84.5 mt-30 -64.03 -38.73 92.14 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.791 0.329 . . . . 0.0 110.559 -179.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . 0.492 ' O ' ' N ' ' A' ' 7' ' ' GLN . 92.8 mt-10 -55.79 -21.29 18.55 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.567 -179.852 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 46.5 tp -40.63 -37.22 0.7 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.546 179.951 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 82.5 p -55.72 -38.0 69.18 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.578 179.366 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . 0.492 ' N ' ' O ' ' A' ' 4' ' ' GLU . 85.6 mt-30 -65.96 -30.58 71.18 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.523 179.798 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 59.3 t-80 -61.1 -43.69 98.49 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.557 179.695 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -62.11 -43.27 99.21 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.614 179.251 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.542 ' O ' ' N ' ' A' ' 14' ' ' GLN . 89.1 mtt-85 -65.93 -33.89 76.87 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.54 178.889 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.467 ' O ' ' CB ' ' A' ' 15' ' ' LEU . 0.1 OUTLIER -57.69 -43.2 84.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.609 -179.488 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 2.2 t -60.43 -52.31 62.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.546 -178.649 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 80.9 tt0 -78.16 -46.54 20.31 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.545 -178.683 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . 0.542 ' N ' ' O ' ' A' ' 10' ' ' ARG . 65.1 tp60 -59.29 -46.73 87.75 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.594 -178.423 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.531 ' C ' ' CD1' ' A' ' 15' ' ' LEU . 3.4 tm? -62.37 -51.25 68.33 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.562 -179.159 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -61.19 -37.15 81.95 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.558 -179.522 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 76.0 mt-30 -66.51 -40.3 89.13 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.557 177.832 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . 0.445 ' O ' HG22 ' A' ' 21' ' ' THR . . . -63.04 -19.28 64.23 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.591 178.676 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.484 ' CD1' ' CE2' ' A' ' 82' ' ' TYR . 9.1 mt -86.59 -35.66 19.32 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.597 178.229 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 96.6 mttt -55.03 -42.26 72.4 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.543 -179.702 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' THR . . . . . 0.445 HG22 ' O ' ' A' ' 18' ' ' ALA . 0.5 OUTLIER -63.09 -29.2 70.62 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.597 -179.73 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 75.0 mmt-85 -71.91 -7.33 47.86 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.582 179.462 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 105.82 23.96 7.21 Favored Glycine 0 CA--C 1.524 0.641 0 N-CA-C 110.92 -0.872 . . . . 0.0 110.92 179.854 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.444 ' CG1' ' N ' ' A' ' 25' ' ' LYS . 34.7 t -103.4 168.61 2.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 120.809 0.337 . . . . 0.0 110.579 179.839 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.444 ' N ' ' CG1' ' A' ' 24' ' ' VAL . 49.1 tttp -130.46 110.56 11.55 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.541 178.807 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . 0.423 ' CG1' ' OD2' ' A' ' 30' ' ' ASP . 2.1 t -128.3 90.56 1.52 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.603 -179.391 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 19.2 pttt -78.56 166.55 22.43 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.555 179.416 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 87.7 m-85 -47.84 -35.69 10.68 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.588 179.812 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -48.98 -22.16 0.81 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.577 179.057 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.492 ' O ' ' N ' ' A' ' 34' ' ' PHE . 20.3 t0 -66.62 -41.5 88.25 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.511 -179.56 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.541 ' O ' ' CB ' ' A' ' 35' ' ' PHE . 4.0 mp -61.45 -40.82 95.89 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.556 179.217 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 32.5 mt -62.28 -48.01 81.78 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.557 -179.014 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 82.0 tttt -84.82 -53.97 4.99 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.608 -177.469 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . 0.492 ' N ' ' O ' ' A' ' 30' ' ' ASP . 35.4 t80 -56.94 -52.03 66.83 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.597 -177.434 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.541 ' CB ' ' O ' ' A' ' 31' ' ' LEU . 5.5 t80 -61.55 -45.79 92.69 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.534 -177.85 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 91.1 m-20 -65.72 -32.81 74.56 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.585 -179.08 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -65.85 -49.81 66.81 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.533 -178.831 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . 0.605 ' O ' ' N ' ' A' ' 42' ' ' CYS . 26.9 m -72.08 -36.28 56.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.532 -179.037 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -61.97 -29.2 70.09 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.541 -179.354 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 97.5 m-20 -57.99 -47.49 82.85 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.55 -179.148 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' THR . . . . . 0.474 ' O ' ' C ' ' A' ' 42' ' ' CYS . 82.7 p -113.9 0.1 14.32 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.59 -178.91 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . 0.605 ' N ' ' O ' ' A' ' 38' ' ' VAL . 26.0 p 33.78 61.02 1.86 Allowed Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.595 -179.494 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -78.43 -36.61 0.89 Allowed 'Trans proline' 0 C--N 1.305 -1.721 0 C-N-CA 122.816 2.344 . . . . 0.0 112.133 -179.256 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . 0.811 ' HE1' ' H ' ' A' ' 52' ' ' ASP . 0.0 OUTLIER -71.73 -2.01 15.94 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.565 -179.755 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 0.576 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 69.0 m-85 58.1 47.5 2.22 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.58 -179.677 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.576 ' CD ' ' N ' ' A' ' 45' ' ' PHE . 46.9 Cg_exo -38.48 -19.0 0.04 OUTLIER 'Trans proline' 0 C--N 1.305 -1.725 0 C-N-CA 122.837 2.358 . . . . 0.0 112.112 178.248 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.564 ' N ' ' O ' ' A' ' 45' ' ' PHE . 86.5 mt-30 -65.85 -53.64 37.21 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.601 -178.468 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -86.09 -15.77 40.15 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.544 -179.861 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 64.76 84.24 0.08 OUTLIER Glycine 0 CA--C 1.525 0.661 0 N-CA-C 110.97 -0.852 . . . . 0.0 110.97 -179.746 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' THR . . . . . 0.567 ' HG1' ' H ' ' A' ' 51' ' ' ILE . 14.8 t -145.33 171.29 14.8 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.816 0.341 . . . . 0.0 110.537 -179.284 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.567 ' H ' ' HG1' ' A' ' 50' ' ' THR . 1.2 mt -104.85 134.3 46.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.57 179.277 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . 0.811 ' H ' ' HE1' ' A' ' 44' ' ' TRP . 1.7 m-20 -111.93 121.94 46.39 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.536 -179.764 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.462 HG22 HD11 ' A' ' 53' ' ' ILE . 33.4 mm -94.6 -56.17 5.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.591 179.578 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -74.99 -51.56 13.34 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.566 -179.391 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.4 ' HA ' ' HE ' ' A' ' 58' ' ' ARG . 84.5 mtt85 -59.26 -29.75 67.78 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.553 -179.042 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' TRP . . . . . 0.585 ' CE3' ' CH2' ' A' ' 44' ' ' TRP . 24.9 t-105 -63.44 -36.96 85.46 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.529 178.923 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 79.3 mtp85 -64.96 -35.37 80.96 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.565 179.217 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . 0.4 ' HE ' ' HA ' ' A' ' 55' ' ' ARG . 69.8 mtm180 -60.11 -52.59 64.67 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.621 -179.466 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 2.8 p -65.44 -33.35 63.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.612 -179.86 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -71.22 -38.97 62.94 Favored Glycine 0 CA--C 1.525 0.689 0 N-CA-C 110.944 -0.862 . . . . 0.0 110.944 179.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 56.0 t0 -63.36 -48.75 76.65 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.792 0.329 . . . . 0.0 110.554 -179.627 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 99.8 m -64.06 -46.59 83.68 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.553 -179.863 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 6.3 m-85 -63.79 -31.65 72.9 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.6 179.767 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 70.8 tp60 -61.57 -40.22 93.95 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.514 179.647 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 20.6 t0 -63.19 -52.03 63.97 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.561 179.583 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' TYR . . . . . 0.461 ' O ' ' OG1' ' A' ' 69' ' ' THR . 68.8 m-85 -66.81 -32.06 73.1 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.579 179.743 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 63.9 t80 -60.41 -43.37 96.76 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.525 179.388 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 99.0 m-20 -65.65 -38.68 90.03 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.526 -179.863 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.461 ' OG1' ' O ' ' A' ' 66' ' ' TYR . 62.0 p -64.91 -22.59 67.02 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.568 -179.571 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -72.21 -42.58 65.61 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.561 179.938 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . 0.447 ' H ' ' HD3' ' A' ' 72' ' ' PRO . . . 110.24 72.34 0.69 Allowed Glycine 0 CA--C 1.525 0.715 0 N-CA-C 110.925 -0.87 . . . . 0.0 110.925 179.139 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . 0.447 ' HD3' ' H ' ' A' ' 71' ' ' GLY . 16.4 Cg_exo -67.4 147.28 77.33 Favored 'Trans proline' 0 C--N 1.305 -1.728 0 C-N-CA 122.746 2.297 . . . . 0.0 112.124 178.108 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 99.1 mt-10 -76.92 -51.13 11.74 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.546 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.446 ' CD ' ' N ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -140.44 5.59 2.05 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.547 -179.609 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 55.5 t 56.46 91.69 0.07 OUTLIER Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.57 -179.808 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_exo -55.26 122.64 12.08 Favored 'Trans proline' 0 C--N 1.305 -1.732 0 C-N-CA 122.845 2.363 . . . . 0.0 112.146 -179.011 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . 0.401 ' O ' ' N ' ' A' ' 79' ' ' ALA . 98.0 t -86.25 -13.49 10.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.539 -179.536 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 81.0 p -44.01 -23.74 0.11 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.601 -179.587 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . 0.401 ' N ' ' O ' ' A' ' 77' ' ' VAL . . . -55.41 -40.61 71.65 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.61 179.794 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 41.1 t80 -63.02 -38.35 90.83 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.604 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 19.6 m -59.05 -41.86 88.93 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.6 -179.511 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' TYR . . . . . 0.484 ' CE2' ' CD1' ' A' ' 19' ' ' LEU . 13.0 m-85 -59.66 -51.65 68.89 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.533 -179.952 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' TRP . . . . . 0.431 ' O ' ' CB ' ' A' ' 87' ' ' LYS . 80.9 t90 -56.66 -40.25 75.16 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.522 -179.69 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 71.8 m-20 -59.92 -46.37 89.58 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.542 -179.883 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 26.1 tp -71.8 -63.34 1.15 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.57 179.674 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -47.57 -26.77 1.06 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.584 179.11 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . 0.431 ' CB ' ' O ' ' A' ' 83' ' ' TRP . 59.6 tttt -68.03 -49.97 58.22 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.564 -179.536 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . 0.488 ' O ' ' OE1' ' A' ' 88' ' ' GLU . 1.0 OUTLIER -79.74 -19.59 48.39 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.565 -179.924 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.92 -49.15 78.61 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.573 -179.509 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 3.1 mt -63.66 -42.6 96.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.53 179.726 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 65.0 t0 -57.16 -45.87 83.24 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.555 -178.931 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 78.8 mttt -57.12 136.79 56.39 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.568 -179.546 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 58.6 mttp -69.81 -4.34 19.64 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.582 179.857 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -73.4 47.65 0.23 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.573 -179.871 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 21.4 m -121.82 163.98 19.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.581 179.81 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' ASN . . . . . 0.677 ' H ' ' ND2' ' A' ' 96' ' ' ASN . 0.0 OUTLIER -97.31 176.75 1.92 Allowed Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.58 -179.896 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' PRO . . . . . 0.459 ' CD ' ' CB ' ' A' ' 96' ' ' ASN . 37.9 Cg_exo -59.55 -22.49 66.9 Favored 'Trans proline' 0 C--N 1.305 -1.744 0 C-N-CA 122.839 2.359 . . . . 0.0 112.109 179.688 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . 0.485 ' OE1' ' ND2' ' A' ' 96' ' ' ASN . 5.7 pt20 . . . . . 0 C--N 1.329 -0.317 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.579 -179.766 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 98.0 m . . . . . 0 C--O 1.231 0.08 0 CA-C-O 120.828 0.347 . . . . 0.0 110.573 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . 0.436 ' OE2' ' O ' ' A' ' 113' ' ' ASN . 90.2 mt-10 -74.95 -178.27 3.69 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.547 -179.813 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' GLU . . . . . 0.586 ' C ' ' H ' ' A' ' 110' ' ' LEU . 80.7 mm-40 -102.87 128.56 49.6 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.571 179.256 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 40.7 pt -56.37 -0.78 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.613 -179.803 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . 0.586 ' H ' ' C ' ' A' ' 108' ' ' GLU . 94.9 mt -89.33 -2.33 58.4 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.592 179.969 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . 0.406 ' NZ ' ' O ' ' A' ' 116' ' ' THR . 84.6 tttt -141.8 154.44 45.21 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.555 -179.747 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 5.5 p -60.69 173.3 0.76 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.546 -179.791 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 113' ' ' ASN . . . . . 0.436 ' O ' ' OE2' ' A' ' 107' ' ' GLU . 70.6 m-20 -62.45 -38.5 90.01 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.566 -179.628 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 114' ' ' SER . . . . . 0.483 ' O ' ' O ' ' A' ' 115' ' ' GLN . 11.6 m -68.77 138.82 55.14 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.599 -179.705 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 115' ' ' GLN . . . . . 0.483 ' O ' ' O ' ' A' ' 114' ' ' SER . 82.7 mt-30 56.95 148.57 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.556 -179.624 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 116' ' ' THR . . . . . 0.481 ' O ' ' C ' ' A' ' 117' ' ' ASP . 21.5 p -84.17 170.59 13.63 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.581 179.472 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 117' ' ' ASP . . . . . 0.481 ' C ' ' O ' ' A' ' 116' ' ' THR . 58.6 t0 . . . . . 0 C--N 1.329 -0.306 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.588 179.894 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.632 0 N-CA-C 111.104 -0.798 . . . . 0.0 111.104 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 88.6 mt-30 -58.94 -31.39 68.65 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.874 0.368 . . . . 0.0 110.407 -179.723 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 69.7 mm-40 -65.32 -24.53 67.3 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.681 179.545 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 37.4 tp -43.06 -33.08 0.77 Allowed 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.245 0.545 . . . . 0.0 110.307 -179.553 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 68.1 m -53.67 -41.27 66.69 Favored 'General case' 0 C--N 1.324 -0.526 0 C-N-CA 120.486 -0.486 . . . . 0.0 110.123 179.912 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . 0.467 ' OE1' ' CG ' ' A' ' 97' ' ' PRO . 86.6 mt-30 -61.93 -34.16 75.58 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.827 179.703 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 73.9 t60 -57.1 -41.81 79.6 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.974 0.416 . . . . 0.0 109.952 -179.982 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 96.2 mt-10 -62.5 -43.38 98.95 Favored 'General case' 0 C--O 1.238 0.482 0 C-N-CA 120.357 -0.537 . . . . 0.0 110.026 179.566 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.446 ' O ' ' CB ' ' A' ' 14' ' ' GLN . 62.6 mtp180 -65.16 -33.18 75.39 Favored 'General case' 0 C--O 1.208 -1.096 0 CA-C-N 116.038 -0.528 . . . . 0.0 109.58 179.668 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -58.4 -44.6 89.04 Favored 'General case' 0 C--N 1.322 -0.588 0 C-N-CA 120.77 -0.372 . . . . 0.0 110.62 -179.54 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 13.4 t -61.62 -48.83 86.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 C-N-CA 120.433 -0.507 . . . . 0.0 111.892 -179.863 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 70.0 mm-40 -76.02 -41.79 49.89 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.291 0.567 . . . . 0.0 111.428 -179.649 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . 0.446 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 66.6 tp60 -62.07 -50.4 72.11 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.498 -179.189 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -63.97 -49.17 73.58 Favored 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 120.303 -0.559 . . . . 0.0 109.99 179.828 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 94.9 mttt -58.93 -34.44 71.74 Favored 'General case' 0 C--N 1.324 -0.525 0 C-N-CA 120.707 -0.397 . . . . 0.0 110.729 -179.683 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 91.1 mt-30 -78.58 -36.2 44.79 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.864 179.633 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -56.39 -34.63 66.89 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.932 -0.576 . . . . 0.0 109.929 -179.749 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.472 ' O ' ' N ' ' A' ' 22' ' ' ARG . 3.7 mt -85.16 -35.06 21.96 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.156 0.503 . . . . 0.0 110.461 179.231 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 65.1 tttm -45.95 -41.68 11.94 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.478 -178.642 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -75.71 -16.06 60.21 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.747 -179.942 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.472 ' N ' ' O ' ' A' ' 19' ' ' LEU . 86.2 mmt-85 -83.56 13.21 4.74 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 120.828 0.347 . . . . 0.0 110.28 -179.881 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 97.32 4.94 58.24 Favored Glycine 0 CA--C 1.522 0.512 0 N-CA-C 110.915 -0.874 . . . . 0.0 110.915 179.671 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 15.7 t -93.5 169.33 1.38 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 C-N-CA 121.094 -0.242 . . . . 0.0 110.469 -179.798 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -134.41 134.46 41.66 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.24 179.654 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 8.9 m -131.03 129.86 63.53 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.288 0 CA-C-N 116.601 -0.272 . . . . 0.0 110.268 179.812 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 16.0 pttp -110.13 163.59 13.45 Favored 'General case' 0 C--O 1.226 -0.134 0 CA-C-O 120.652 0.263 . . . . 0.0 110.585 179.771 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 98.0 m-85 -56.51 -34.75 67.3 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.021 0.439 . . . . 0.0 110.267 179.858 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -51.93 -23.32 4.8 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.236 179.708 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.487 ' O ' ' CB ' ' A' ' 34' ' ' PHE . 97.3 m-20 -62.2 -49.99 73.59 Favored 'General case' 0 C--O 1.219 -0.531 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.311 -179.547 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.433 ' O ' ' CB ' ' A' ' 35' ' ' PHE . 3.7 mp -63.32 -38.3 90.63 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 121.224 0.535 . . . . 0.0 109.837 179.565 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 42.9 mt -61.1 -51.32 69.63 Favored 'General case' 0 C--N 1.308 -1.199 0 C-N-CA 119.106 -1.038 . . . . 0.0 111.435 -179.068 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.408 ' O ' ' OD1' ' A' ' 36' ' ' ASP . 87.1 tttt -88.07 -54.18 4.35 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 112.864 0.691 . . . . 0.0 112.864 -178.287 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . 0.487 ' CB ' ' O ' ' A' ' 30' ' ' ASP . 9.7 t80 -53.48 -47.75 69.52 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.427 -178.093 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.433 ' CB ' ' O ' ' A' ' 31' ' ' LEU . 1.1 t80 -62.89 -48.88 77.07 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 120.348 -0.541 . . . . 0.0 110.341 179.978 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . 0.408 ' OD1' ' O ' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -62.94 -34.3 77.19 Favored 'General case' 0 C--O 1.234 0.282 0 C-N-CA 119.554 -0.858 . . . . 0.0 111.816 -179.052 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.439 ' O ' ' OG1' ' A' ' 41' ' ' THR . 3.2 t80 -62.15 -47.12 85.94 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.226 -178.734 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . 0.505 ' O ' ' N ' ' A' ' 42' ' ' CYS . 29.8 m -71.17 -26.27 26.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.528 -179.47 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.431 ' O ' ' SG ' ' A' ' 42' ' ' CYS . 24.4 mttt -61.22 -45.55 94.11 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 120.465 -0.494 . . . . 0.0 110.89 -179.584 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 89.3 m-20 -75.88 -50.55 14.74 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 120.549 -0.46 . . . . 0.0 111.41 -179.835 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' THR . . . . . 0.439 ' OG1' ' O ' ' A' ' 37' ' ' PHE . 1.6 p -70.27 -34.74 73.16 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.443 -179.501 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . 0.505 ' N ' ' O ' ' A' ' 38' ' ' VAL . 48.6 m 47.09 53.14 13.36 Favored Pre-proline 0 C--N 1.331 -0.219 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.416 -178.45 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . 0.432 ' HD3' ' N ' ' A' ' 42' ' ' CYS . 68.6 Cg_endo -79.22 -33.21 1.48 Allowed 'Trans proline' 0 N--CA 1.488 1.165 0 C-N-CA 122.507 2.138 . . . . 0.0 112.463 -179.608 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . 0.639 ' HE1' ' H ' ' A' ' 52' ' ' ASP . 0.0 OUTLIER -87.86 20.12 3.21 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.971 -179.27 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 0.468 ' C ' ' H ' ' A' ' 47' ' ' GLN . 59.4 m-85 48.21 59.61 16.58 Favored Pre-proline 0 C--N 1.33 -0.277 0 C-N-CA 120.455 -0.498 . . . . 0.0 109.972 179.917 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo -51.82 -7.76 0.25 Allowed 'Trans proline' 0 C--N 1.312 -1.371 0 C-N-CA 122.893 2.395 . . . . 0.0 112.333 179.867 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.468 ' H ' ' C ' ' A' ' 45' ' ' PHE . 87.8 mt-30 -71.32 -54.37 11.04 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.635 -179.849 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -88.76 -28.59 20.39 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.576 179.254 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 79.12 66.8 1.66 Allowed Glycine 0 CA--C 1.525 0.696 0 N-CA-C 110.661 -0.976 . . . . 0.0 110.661 -179.615 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' THR . . . . . 0.542 ' OG1' ' NE2' ' A' ' 98' ' ' GLN . 15.3 t -127.93 169.13 14.32 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.827 0.346 . . . . 0.0 111.012 -179.361 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.2 mt -98.88 132.08 44.85 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.253 0 CA-C-N 116.094 -0.503 . . . . 0.0 109.901 179.418 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . 0.639 ' H ' ' HE1' ' A' ' 44' ' ' TRP . 5.6 t0 -116.54 119.08 34.46 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.008 179.012 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 17.8 mm -82.98 -25.41 8.13 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.035 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -85.81 -57.18 3.15 Favored 'General case' 0 C--O 1.239 0.523 0 CA-C-O 121.471 0.653 . . . . 0.0 111.442 -179.116 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 95.7 mtt-85 -60.72 -33.27 72.64 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.396 -179.342 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' TRP . . . . . 0.629 ' CE3' ' CH2' ' A' ' 44' ' ' TRP . 34.2 t-105 -57.85 -37.7 74.35 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.114 0.483 . . . . 0.0 110.265 179.96 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 85.0 mtp180 -64.58 -37.94 89.3 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.183 179.79 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 41.2 ttm180 -60.95 -51.62 68.51 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 120.447 -0.501 . . . . 0.0 111.049 -179.551 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 6.9 p -68.85 -38.43 78.69 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.425 0 CA-C-O 120.896 0.379 . . . . 0.0 110.218 179.404 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -64.5 -39.05 96.53 Favored Glycine 0 CA--C 1.525 0.68 0 N-CA-C 111.135 -0.786 . . . . 0.0 111.135 179.689 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . 0.422 ' O ' ' OD1' ' A' ' 61' ' ' ASP . 64.0 t0 -62.64 -38.29 89.69 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.876 0.369 . . . . 0.0 110.326 -179.962 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 75.8 m -61.95 -38.42 88.44 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.447 -179.893 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 5.5 m-85 -62.71 -37.75 87.73 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.358 179.89 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 57.6 tt0 -63.11 -42.1 99.5 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.963 -179.898 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 62.2 t0 -60.22 -52.0 67.17 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.055 0.455 . . . . 0.0 110.456 -179.925 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' TYR . . . . . 0.428 ' O ' ' OG1' ' A' ' 69' ' ' THR . 55.0 m-85 -62.2 -39.52 93.02 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.414 179.811 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 9.8 t80 -62.1 -40.53 96.18 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.291 179.818 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 88.3 m-20 -57.33 -32.72 67.0 Favored 'General case' 0 CA--C 1.518 -0.269 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.046 -179.27 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.428 ' OG1' ' O ' ' A' ' 66' ' ' TYR . 25.0 p -65.64 -20.47 66.31 Favored 'General case' 0 C--N 1.317 -0.816 0 C-N-CA 119.748 -0.781 . . . . 0.0 110.034 179.281 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 69.7 m-85 -107.34 -51.45 2.91 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 116.024 -0.534 . . . . 0.0 112.399 -179.738 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -142.46 78.11 0.28 Allowed Glycine 0 CA--C 1.539 1.54 0 N-CA-C 111.074 -0.811 . . . . 0.0 111.074 -179.292 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -75.98 -16.14 18.26 Favored 'Trans proline' 0 C--N 1.298 -2.093 0 C-N-CA 122.831 2.354 . . . . 0.0 111.735 -179.672 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 77.4 mm-40 -89.47 -38.39 14.09 Favored 'General case' 0 CA--C 1.505 -0.774 0 CA-C-O 121.567 0.699 . . . . 0.0 110.585 179.798 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 51.5 mmtt -65.48 -46.09 81.1 Favored 'General case' 0 C--N 1.308 -1.213 0 CA-C-N 114.82 -1.082 . . . . 0.0 111.123 -178.199 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 54.6 t 38.51 84.06 0.19 Allowed Pre-proline 0 N--CA 1.451 -0.406 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.115 179.492 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_exo -55.41 126.86 23.92 Favored 'Trans proline' 0 C--N 1.311 -1.436 0 C-N-CA 121.925 1.75 . . . . 0.0 111.373 -179.629 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 58.0 t -82.08 -17.17 11.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.513 -179.936 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 22.6 p -48.19 -26.46 1.93 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.176 -179.35 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.27 -41.24 98.3 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.179 0.514 . . . . 0.0 110.583 179.661 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 8.4 m-85 -62.69 -37.31 85.96 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.346 179.829 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 59.9 m -58.58 -40.62 83.68 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.309 179.745 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 5.1 m-85 -59.67 -50.83 72.34 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.722 -179.675 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' TRP . . . . . 0.539 ' CD1' ' N ' ' A' ' 83' ' ' TRP . 6.1 m0 -59.8 -38.26 81.41 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.595 -179.881 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 92.9 m-20 -62.09 -45.28 94.18 Favored 'General case' 0 C--N 1.325 -0.457 0 C-N-CA 120.581 -0.447 . . . . 0.0 110.79 -179.339 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 56.7 tp -71.91 -53.99 11.42 Favored 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 120.341 -0.544 . . . . 0.0 110.5 179.87 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -58.54 -25.16 27.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 C-N-CA 120.766 -0.374 . . . . 0.0 110.483 179.884 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . 0.401 ' CB ' ' O ' ' A' ' 83' ' ' TRP . 67.1 tttt -65.39 -50.24 66.25 Favored 'General case' 0 C--N 1.321 -0.672 0 C-N-CA 120.348 -0.541 . . . . 0.0 110.306 -179.79 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . 0.415 ' O ' ' OE1' ' A' ' 88' ' ' GLU . 1.0 OUTLIER -80.54 -20.84 42.59 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.782 -179.912 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 12.4 tp -62.15 -45.16 94.64 Favored 'General case' 0 N--CA 1.448 -0.57 0 C-N-CA 120.316 -0.554 . . . . 0.0 110.438 -178.686 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . 0.507 ' C ' ' H ' ' A' ' 92' ' ' LYS . 2.9 mt -65.02 -43.63 96.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 C-N-CA 120.334 -0.547 . . . . 0.0 109.955 179.943 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 98.0 m-20 -47.03 -14.06 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.791 -178.199 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . 0.507 ' H ' ' C ' ' A' ' 90' ' ' ILE . 86.4 tttt -68.58 133.9 49.2 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.371 179.92 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -64.46 -41.41 96.53 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.942 -179.939 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 99.1 mt-10 -105.79 55.17 0.68 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.053 -179.664 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.515 ' O ' ' ND2' ' A' ' 96' ' ' ASN . 6.9 t -45.27 -75.48 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.497 -179.476 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' ASN . . . . . 0.515 ' ND2' ' O ' ' A' ' 95' ' ' VAL . 0.9 OUTLIER -153.74 160.54 30.82 Favored Pre-proline 0 C--N 1.326 -0.431 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.738 179.979 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' PRO . . . . . 0.467 ' CG ' ' OE1' ' A' ' 7' ' ' GLN . 16.3 Cg_endo -56.83 -11.89 8.07 Favored 'Trans proline' 0 N--CA 1.495 1.602 0 C-N-CA 122.959 2.439 . . . . 0.0 112.059 178.751 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . 0.542 ' NE2' ' OG1' ' A' ' 50' ' ' THR . 4.6 pt20 . . . . . 0 C--N 1.322 -0.597 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.999 -179.758 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' THR . . . . . 0.415 ' O ' ' O ' ' A' ' 107' ' ' GLU . 4.9 t . . . . . 0 C--O 1.231 0.08 0 CA-C-O 120.874 0.368 . . . . 0.0 110.634 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . 0.415 ' O ' ' O ' ' A' ' 106' ' ' THR . 75.4 mm-40 44.39 -169.37 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.343 179.856 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' GLU . . . . . 0.555 ' C ' ' H ' ' A' ' 110' ' ' LEU . 93.0 mt-10 -109.07 122.16 46.67 Favored 'General case' 0 CA--C 1.515 -0.393 0 N-CA-C 109.697 -0.483 . . . . 0.0 109.697 179.387 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 44.0 pt -47.69 -12.43 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.14 179.573 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . 0.555 ' H ' ' C ' ' A' ' 108' ' ' GLU . 31.5 mt -66.25 -41.95 89.25 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.812 179.615 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -66.12 -36.0 81.98 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.479 -179.899 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 45.9 m -57.7 -45.44 85.68 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.684 -179.289 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 29.6 t30 -65.56 -43.33 90.2 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.637 179.676 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 20.8 m -166.06 150.94 8.28 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.559 179.663 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 87.4 mt-30 -91.09 18.8 6.35 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.487 179.715 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 15.3 p -60.16 -47.42 85.99 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.495 -179.809 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 94.8 m-20 . . . . . 0 C--N 1.33 -0.268 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.539 179.684 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.875 0 N-CA-C 111.142 -0.783 . . . . 0.0 111.142 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 87.1 mt-30 -59.3 -27.05 65.51 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.952 0.406 . . . . 0.0 110.389 -179.925 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 82.2 tt0 -53.9 -21.48 7.9 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.613 179.862 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 34.5 tp -40.19 -29.59 0.08 Allowed 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 120.959 0.409 . . . . 0.0 110.418 -179.321 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 78.3 p -55.38 -38.6 69.07 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 120.586 -0.446 . . . . 0.0 110.078 179.947 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 99.7 mm-40 -62.28 -37.23 84.71 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.585 179.64 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 75.1 t60 -57.24 -42.29 81.21 Favored 'General case' 0 C--N 1.332 -0.169 0 N-CA-C 109.91 -0.404 . . . . 0.0 109.91 -179.854 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 81.2 mm-40 -60.11 -45.63 92.32 Favored 'General case' 0 C--O 1.243 0.726 0 CA-C-O 121.208 0.528 . . . . 0.0 109.873 179.318 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.415 ' O ' ' CB ' ' A' ' 14' ' ' GLN . 70.3 mtp180 -64.87 -33.34 75.78 Favored 'General case' 0 C--O 1.212 -0.912 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 179.327 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 49.0 t80 -59.37 -38.17 79.78 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 120.217 -0.593 . . . . 0.0 110.3 -179.295 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 3.4 t -62.07 -50.01 81.8 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 C-N-CA 119.774 -0.77 . . . . 0.0 111.37 179.974 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 97.3 mt-10 -79.38 -35.86 40.12 Favored 'General case' 0 C--N 1.322 -0.587 0 C-N-CA 120.232 -0.587 . . . . 0.0 112.061 -179.082 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . 0.415 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 66.2 tp60 -68.71 -51.68 39.04 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.527 -179.005 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.35 -46.43 86.62 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.343 -179.518 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -57.76 -31.95 67.0 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 178.838 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 49.2 tt0 -75.24 -39.45 59.92 Favored 'General case' 0 C--O 1.239 0.552 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.198 178.879 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -58.07 -25.06 60.79 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-N 115.933 -0.576 . . . . 0.0 109.725 179.536 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.448 ' O ' ' N ' ' A' ' 22' ' ' ARG . 3.7 mt -85.36 -40.73 16.17 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.199 178.581 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 92.9 mttt -43.24 -45.69 5.86 Favored 'General case' 0 N--CA 1.464 0.273 0 C-N-CA 120.353 -0.539 . . . . 0.0 111.035 -179.2 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' THR . . . . . 0.527 ' C ' ' H ' ' A' ' 23' ' ' GLY . 0.2 OUTLIER -63.62 -31.38 72.53 Favored 'General case' 0 C--N 1.324 -0.535 0 C-N-CA 120.467 -0.493 . . . . 0.0 110.758 -179.812 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.448 ' N ' ' O ' ' A' ' 19' ' ' LEU . 80.1 mmt-85 -69.05 10.24 0.32 Allowed 'General case' 0 C--O 1.232 0.18 0 C-N-CA 120.795 -0.362 . . . . 0.0 110.457 -179.745 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . 0.527 ' H ' ' C ' ' A' ' 21' ' ' THR . . . 91.52 22.49 31.4 Favored Glycine 0 N--CA 1.467 0.736 0 N-CA-C 111.162 -0.775 . . . . 0.0 111.162 179.738 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.453 ' CG1' ' N ' ' A' ' 25' ' ' LYS . 39.8 t -105.27 168.27 2.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-O 120.63 0.253 . . . . 0.0 110.575 -179.882 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.453 ' N ' ' CG1' ' A' ' 24' ' ' VAL . 98.9 mttt -134.96 105.15 6.25 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.171 179.356 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . 0.491 ' CG1' ' OD2' ' A' ' 30' ' ' ASP . 1.7 t -117.92 93.66 2.67 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.443 0 C-N-CA 120.895 -0.322 . . . . 0.0 110.765 -179.656 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 25.5 pttt -81.43 165.22 21.47 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.711 179.619 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 98.0 m-85 -48.21 -31.83 6.33 Favored 'General case' 0 C--O 1.241 0.614 0 CA-C-O 121.254 0.55 . . . . 0.0 110.647 179.895 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -54.43 -23.22 15.05 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.012 179.552 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.491 ' OD2' ' CG1' ' A' ' 26' ' ' VAL . 21.4 t0 -65.11 -42.0 94.4 Favored 'General case' 0 C--O 1.218 -0.567 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.894 -179.54 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.482 ' O ' ' CB ' ' A' ' 35' ' ' PHE . 4.7 mp -65.16 -40.58 94.55 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-O 121.029 0.443 . . . . 0.0 109.856 -179.866 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 40.7 mt -58.91 -46.35 88.11 Favored 'General case' 0 C--N 1.312 -1.064 0 C-N-CA 119.34 -0.944 . . . . 0.0 111.086 -178.216 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.411 ' O ' ' CD1' ' A' ' 37' ' ' PHE . 83.3 tttt -85.67 -49.99 7.54 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.896 -178.889 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . 0.44 ' CB ' ' O ' ' A' ' 30' ' ' ASP . 49.7 t80 -61.51 -50.75 71.44 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.206 -178.742 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.482 ' CB ' ' O ' ' A' ' 31' ' ' LEU . 5.4 t80 -61.6 -46.79 88.33 Favored 'General case' 0 C--N 1.33 -0.264 0 O-C-N 123.325 0.391 . . . . 0.0 110.241 -179.152 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 93.1 m-20 -63.44 -38.31 90.64 Favored 'General case' 0 C--N 1.34 0.167 0 C-N-CA 120.597 -0.441 . . . . 0.0 111.224 -179.431 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.411 ' CD1' ' O ' ' A' ' 33' ' ' LYS . 2.8 m-85 -61.09 -46.49 90.41 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.487 -178.929 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . 0.542 ' O ' ' N ' ' A' ' 42' ' ' CYS . 27.6 m -76.87 -37.29 27.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 C-N-CA 120.307 -0.557 . . . . 0.0 110.425 -179.779 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 61.5 tttm -56.49 -29.25 61.57 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.763 -179.627 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 66.4 t0 -49.73 -62.43 1.56 Allowed 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.748 -0.381 . . . . 0.0 111.138 -179.446 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 17.2 p -115.21 1.1 13.74 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 116.529 -0.305 . . . . 0.0 111.562 -179.84 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . 0.542 ' N ' ' O ' ' A' ' 38' ' ' VAL . 2.2 m 40.49 59.25 7.72 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.434 -178.479 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . 0.47 ' C ' ' H ' ' A' ' 45' ' ' PHE . 9.1 Cg_exo -67.75 -29.65 35.31 Favored 'Trans proline' 0 N--CA 1.496 1.668 0 C-N-CA 122.442 2.094 . . . . 0.0 112.568 -179.415 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . 0.532 ' HE1' ' H ' ' A' ' 52' ' ' ASP . 0.0 OUTLIER -64.75 0.47 1.14 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.827 -179.272 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 0.487 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 45.9 t80 45.25 52.25 10.29 Favored Pre-proline 0 C--N 1.327 -0.395 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.078 -179.789 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.487 ' CD ' ' N ' ' A' ' 45' ' ' PHE . 19.8 Cg_endo -59.23 -7.17 4.64 Favored 'Trans proline' 0 C--N 1.307 -1.627 0 C-N-CA 122.965 2.443 . . . . 0.0 112.176 179.804 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 99.3 mm-40 -51.22 -54.38 26.2 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 120.534 -0.466 . . . . 0.0 110.167 -179.491 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -89.65 -13.36 37.21 Favored 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 120.737 -0.385 . . . . 0.0 110.697 179.028 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 77.32 71.58 1.19 Allowed Glycine 0 CA--C 1.522 0.53 0 N-CA-C 110.474 -1.051 . . . . 0.0 110.474 -179.318 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 1.7 t -137.22 162.99 31.97 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 121.052 -0.259 . . . . 0.0 110.719 -179.383 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.5 mt -91.6 141.97 13.71 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.101 179.445 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . 0.532 ' H ' ' HE1' ' A' ' 44' ' ' TRP . 9.3 m-20 -113.77 119.21 36.56 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.987 -0.552 . . . . 0.0 111.503 179.835 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.435 HG23 HD13 ' A' ' 53' ' ' ILE . 27.8 mm -95.21 -57.01 4.69 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 C-N-CA 120.768 -0.373 . . . . 0.0 110.963 178.694 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 99.7 mttt -75.81 -46.73 28.98 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-O 121.137 0.494 . . . . 0.0 111.52 -179.784 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 79.7 mtp180 -60.56 -32.4 71.47 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 116.031 -0.531 . . . . 0.0 109.897 -179.668 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 26.9 t-105 -59.67 -36.86 77.3 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 116.039 -0.528 . . . . 0.0 109.759 178.691 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 63.3 ttm-85 -66.75 -38.22 86.19 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.498 179.505 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 82.7 mtp180 -57.22 -48.09 79.69 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 120.577 -0.449 . . . . 0.0 111.318 -179.122 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 4.3 p -66.14 -34.25 68.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 C-N-CA 120.602 -0.439 . . . . 0.0 110.059 179.461 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -66.22 -38.85 94.17 Favored Glycine 0 CA--C 1.526 0.772 0 N-CA-C 111.197 -0.761 . . . . 0.0 111.197 179.545 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 99.9 m-20 -62.46 -46.02 90.41 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.758 0.313 . . . . 0.0 111.07 -179.524 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 88.6 m -65.74 -42.48 90.95 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.173 0.511 . . . . 0.0 110.305 179.941 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 6.8 m-85 -67.47 -30.05 69.66 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.289 179.572 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 59.7 tt0 -62.33 -43.75 98.09 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.228 -179.888 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 31.3 t0 -61.28 -50.74 71.81 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.11 0.481 . . . . 0.0 110.422 179.232 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' TYR . . . . . 0.464 ' O ' ' OG1' ' A' ' 69' ' ' THR . 34.0 m-85 -62.88 -34.91 78.37 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.075 -0.512 . . . . 0.0 109.947 179.318 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . 0.548 ' CE2' ' O ' ' A' ' 71' ' ' GLY . 76.2 t80 -62.43 -36.85 83.68 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.005 -0.543 . . . . 0.0 109.96 179.679 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 23.5 m-20 -62.63 -37.77 87.63 Favored 'General case' 0 CA--C 1.519 -0.217 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.334 179.801 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.464 ' OG1' ' O ' ' A' ' 66' ' ' TYR . 66.5 p -61.27 -19.45 61.73 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 119.812 -0.755 . . . . 0.0 109.16 179.957 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 60.0 m-85 -99.27 -49.99 4.28 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 112.752 0.649 . . . . 0.0 112.752 179.731 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . 0.548 ' O ' ' CE2' ' A' ' 67' ' ' TYR . . . 173.02 92.73 0.08 OUTLIER Glycine 0 CA--C 1.537 1.429 0 N-CA-C 111.024 -0.83 . . . . 0.0 111.024 -178.874 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_endo -84.23 16.06 2.02 Favored 'Trans proline' 0 N--CA 1.487 1.103 0 C-N-CA 124.12 3.214 . . . . 0.0 111.182 179.458 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 92.4 mt-10 -88.24 -49.65 6.85 Favored 'General case' 0 CA--C 1.51 -0.583 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.248 -178.896 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.423 ' O ' ' O ' ' A' ' 75' ' ' VAL . 0.5 OUTLIER -62.14 -44.31 96.9 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.015 -0.993 . . . . 0.0 110.614 179.671 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.423 ' O ' ' O ' ' A' ' 74' ' ' LYS . 78.8 t 36.31 94.16 0.04 OUTLIER Pre-proline 0 N--CA 1.467 0.408 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.395 -179.52 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_exo -57.63 126.21 21.14 Favored 'Trans proline' 0 N--CA 1.493 1.473 0 C-N-CA 121.377 1.385 . . . . 0.0 112.283 -179.672 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 60.6 t -83.83 -25.9 7.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.905 179.144 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 22.0 p -44.73 -24.25 0.19 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.499 -179.112 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -59.86 -40.67 89.41 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.348 179.635 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 35.9 t80 -64.61 -39.47 93.78 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.717 179.872 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 11.6 t -58.66 -46.67 86.66 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.028 -179.409 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 14.6 m-85 -62.7 -49.07 76.55 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.731 -0.388 . . . . 0.0 110.942 179.622 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' TRP . . . . . . . . . . . . . 53.1 t90 -53.82 -39.17 65.29 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.579 -179.576 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 92.8 m-20 -61.64 -47.02 87.27 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 120.473 -0.491 . . . . 0.0 111.167 -179.431 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 36.5 tp -72.63 -54.58 8.68 Favored 'General case' 0 C--O 1.221 -0.444 0 C-N-CA 120.186 -0.606 . . . . 0.0 110.496 179.717 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -55.56 -26.09 18.99 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-O 120.765 0.317 . . . . 0.0 110.507 179.575 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 70.8 tttt -65.66 -51.46 59.33 Favored 'General case' 0 C--N 1.322 -0.613 0 C-N-CA 119.966 -0.693 . . . . 0.0 110.224 179.952 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . 0.401 ' O ' ' OE1' ' A' ' 88' ' ' GLU . 1.1 pp20? -80.07 -19.77 46.74 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.009 -179.498 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 14.6 tp -61.68 -44.37 97.08 Favored 'General case' 0 N--CA 1.446 -0.639 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.901 -179.142 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 3.4 mt -64.02 -43.78 97.65 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.109 0 C-N-CA 120.174 -0.611 . . . . 0.0 109.833 -179.406 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 95.8 m-20 -64.14 -14.84 57.76 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.65 -179.345 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 21.1 tttt -79.48 153.54 29.53 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.519 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -92.74 -9.44 40.65 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.777 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -63.2 -18.26 63.3 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.427 179.961 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 10.9 t -69.3 134.17 30.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.144 -179.732 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' ASN . . . . . 0.564 ' O ' ' N ' ' A' ' 98' ' ' GLN . 0.7 OUTLIER -55.42 161.23 3.04 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.889 -179.579 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_exo -42.61 -12.93 0.04 OUTLIER 'Trans proline' 0 N--CA 1.491 1.346 0 C-N-CA 123.006 2.471 . . . . 0.0 112.23 178.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . 0.564 ' N ' ' O ' ' A' ' 96' ' ' ASN . 2.2 pt20 . . . . . 0 C--N 1.321 -0.642 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.425 -179.672 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 58.6 p . . . . . 0 C--O 1.231 0.097 0 CA-C-O 120.766 0.317 . . . . 0.0 110.619 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 85.1 mt-10 -132.71 167.95 19.2 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.044 -179.741 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' GLU . . . . . 0.497 ' N ' ' OE1' ' A' ' 108' ' ' GLU . 57.1 mp0 -101.39 121.38 41.81 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.77 -0.456 . . . . 0.0 109.77 179.096 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 45.0 pt -46.34 -17.06 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.202 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . 0.47 ' H ' ' C ' ' A' ' 108' ' ' GLU . 34.1 mt -63.82 -42.12 97.72 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.297 179.685 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . 0.433 ' O ' ' O ' ' A' ' 114' ' ' SER . 88.6 tttt -63.84 -44.28 93.67 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.527 179.437 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 112' ' ' SER . . . . . 0.423 ' O ' ' O ' ' A' ' 111' ' ' LYS . 1.2 p 38.66 -161.44 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.877 179.921 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 113' ' ' ASN . . . . . 0.42 ' N ' ' OG ' ' A' ' 112' ' ' SER . 94.2 m-20 -63.62 -43.12 97.78 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.745 -179.52 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 114' ' ' SER . . . . . 0.433 ' O ' ' O ' ' A' ' 111' ' ' LYS . 6.4 m -93.9 129.05 40.49 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.277 179.96 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 84.9 mt-30 -86.92 34.58 0.67 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.838 0.351 . . . . 0.0 110.309 -179.776 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 64.1 p -65.75 -31.14 71.96 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.409 -179.858 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 97.0 m-20 . . . . . 0 C--N 1.327 -0.387 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.527 179.777 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.675 0 N-CA-C 110.873 -0.891 . . . . 0.0 110.873 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 86.7 mt-30 -63.72 -34.1 77.13 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.807 0.337 . . . . 0.0 110.709 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -46.96 -24.34 0.59 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.677 179.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 34.6 tp -48.99 -34.19 12.57 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-O 121.103 0.478 . . . . 0.0 110.232 -179.55 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 46.5 m -54.66 -37.78 66.13 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.115 179.871 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 97.5 mm-40 -62.79 -32.06 73.16 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.375 179.804 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 59.8 t-80 -60.63 -43.89 96.99 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.933 0.397 . . . . 0.0 110.376 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 81.2 tt0 -60.59 -51.28 70.1 Favored 'General case' 0 C--O 1.244 0.808 0 CA-C-O 121.335 0.588 . . . . 0.0 110.105 179.729 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.413 ' O ' ' CB ' ' A' ' 14' ' ' GLN . 76.3 mtt-85 -62.56 -31.52 72.33 Favored 'General case' 0 C--O 1.211 -0.938 0 CA-C-N 115.897 -0.592 . . . . 0.0 109.458 179.513 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.461 ' OH ' ' CD2' ' A' ' 89' ' ' LEU . 36.5 t80 -60.23 -37.59 80.81 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 120.936 -0.306 . . . . 0.0 110.326 -179.52 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 2.4 t -62.75 -49.69 82.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 C-N-CA 120.056 -0.657 . . . . 0.0 110.914 -179.803 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 95.6 mt-10 -79.25 -35.9 40.77 Favored 'General case' 0 C--N 1.326 -0.436 0 C-N-CA 120.398 -0.521 . . . . 0.0 111.682 -179.302 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . 0.413 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 70.9 tp60 -69.15 -52.39 28.58 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.199 -178.941 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -61.73 -45.64 93.05 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 -179.406 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 63.9 mttm -55.51 -35.94 66.15 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 120.482 -0.487 . . . . 0.0 110.156 179.486 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 77.3 mt-30 -71.87 -42.0 67.36 Favored 'General case' 0 C--O 1.241 0.641 0 CA-C-O 121.264 0.554 . . . . 0.0 110.552 178.64 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -54.23 -45.18 72.25 Favored 'General case' 0 C--O 1.223 -0.31 0 CA-C-N 115.788 -0.642 . . . . 0.0 109.599 179.93 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.503 ' O ' ' N ' ' A' ' 22' ' ' ARG . 4.4 mt -65.62 -37.9 87.88 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.856 0.36 . . . . 0.0 110.511 178.666 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 77.0 tttt -44.07 -36.74 2.69 Favored 'General case' 0 C--N 1.321 -0.637 0 C-N-CA 120.537 -0.465 . . . . 0.0 109.848 -179.44 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' THR . . . . . 0.534 ' C ' ' H ' ' A' ' 23' ' ' GLY . 1.2 t -63.27 -32.06 73.37 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.215 179.318 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.503 ' N ' ' O ' ' A' ' 19' ' ' LEU . 26.3 mmt-85 -73.46 19.53 0.1 Allowed 'General case' 0 N--CA 1.462 0.162 0 CA-C-O 120.959 0.409 . . . . 0.0 110.546 -179.715 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . 0.534 ' H ' ' C ' ' A' ' 21' ' ' THR . . . 81.45 15.34 76.49 Favored Glycine 0 CA--C 1.524 0.609 0 N-CA-C 110.625 -0.99 . . . . 0.0 110.625 179.974 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 3.4 t -92.61 167.53 1.62 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 N-CA-C 110.097 -0.334 . . . . 0.0 110.097 -179.795 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 55.5 mtmt -128.56 133.21 48.31 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 110.143 -0.317 . . . . 0.0 110.143 179.71 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 2.1 m -133.37 110.54 14.98 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.333 0 CA-C-N 116.62 -0.264 . . . . 0.0 110.512 179.854 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 25.7 pttt -108.92 165.15 11.79 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-O 120.615 0.245 . . . . 0.0 110.459 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 76.3 m-85 -48.52 -39.57 23.78 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.043 0.449 . . . . 0.0 110.318 179.941 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -55.69 -23.17 27.07 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.073 179.516 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.428 ' O ' ' CB ' ' A' ' 34' ' ' PHE . 44.7 t0 -62.14 -44.41 96.69 Favored 'General case' 0 C--O 1.221 -0.395 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.641 -179.719 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.483 ' O ' ' CB ' ' A' ' 35' ' ' PHE . 5.2 mp -68.08 -40.06 82.75 Favored 'General case' 0 C--O 1.218 -0.558 0 CA-C-O 121.099 0.476 . . . . 0.0 110.11 179.24 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 46.0 mt -58.84 -44.61 90.98 Favored 'General case' 0 C--N 1.317 -0.84 0 C-N-CA 119.856 -0.738 . . . . 0.0 110.862 -178.634 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.619 ' NZ ' ' CE2' ' A' ' 67' ' ' TYR . 88.3 tttt -85.61 -49.09 8.29 Favored 'General case' 0 C--N 1.321 -0.631 0 C-N-CA 120.741 -0.384 . . . . 0.0 111.704 -179.325 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . 0.428 ' CB ' ' O ' ' A' ' 30' ' ' ASP . 54.1 t80 -61.34 -50.52 72.6 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.927 -178.682 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.483 ' CB ' ' O ' ' A' ' 31' ' ' LEU . 6.1 t80 -61.83 -46.95 87.26 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.339 -179.685 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 90.8 m-20 -64.37 -36.18 83.31 Favored 'General case' 0 C--N 1.341 0.202 0 CA-C-O 120.747 0.308 . . . . 0.0 111.478 -179.617 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 1.8 m-85 -58.33 -45.47 88.02 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.854 -179.176 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . 0.542 ' O ' ' N ' ' A' ' 42' ' ' CYS . 19.7 m -79.48 -39.05 20.26 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.871 179.97 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 85.9 tttt -55.21 -28.45 53.2 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.775 -179.229 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 96.5 m-20 -50.41 -63.28 1.17 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.389 -0.368 . . . . 0.0 111.134 -179.43 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' THR . . . . . 0.51 ' O ' ' SG ' ' A' ' 42' ' ' CYS . 22.9 p -114.51 4.48 15.23 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.983 -179.87 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . 0.542 ' N ' ' O ' ' A' ' 38' ' ' VAL . 19.5 p 41.29 54.68 7.9 Favored Pre-proline 0 C--N 1.331 -0.214 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.679 -179.109 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . 0.478 ' C ' ' H ' ' A' ' 45' ' ' PHE . 57.8 Cg_endo -72.93 -25.16 16.78 Favored 'Trans proline' 0 N--CA 1.491 1.352 0 C-N-CA 122.469 2.113 . . . . 0.0 112.142 -179.996 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 1.2 t-105 -61.53 -1.41 0.56 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.526 -179.52 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 0.478 ' H ' ' C ' ' A' ' 43' ' ' PRO . 4.8 t80 50.02 54.36 15.61 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-O 121.021 0.438 . . . . 0.0 110.087 -179.856 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.461 ' CD ' ' N ' ' A' ' 45' ' ' PHE . 29.5 Cg_endo -65.21 -10.55 26.24 Favored 'Trans proline' 0 C--N 1.308 -1.584 0 C-N-CA 122.863 2.375 . . . . 0.0 112.117 179.948 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 86.9 mt-30 -58.44 -52.39 65.84 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.248 -179.613 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 50.2 tt0 -88.81 -13.76 38.61 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.172 179.472 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 72.53 65.58 2.29 Favored Glycine 0 CA--C 1.522 0.528 0 N-CA-C 110.494 -1.042 . . . . 0.0 110.494 -179.3 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' THR . . . . . 0.543 ' OG1' ' NE2' ' A' ' 98' ' ' GLN . 2.4 t -136.76 155.88 49.25 Favored 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 120.998 -0.281 . . . . 0.0 110.775 -179.536 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.5 mt -85.24 140.74 15.53 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-O 121.074 0.464 . . . . 0.0 110.537 179.308 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -110.78 121.47 45.43 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.474 -0.785 . . . . 0.0 110.995 179.378 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.417 HD11 HG23 ' A' ' 53' ' ' ILE . 32.6 mm -94.81 -56.53 5.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.203 179.324 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 68.6 mmtt -74.07 -49.04 25.82 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.359 -179.522 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 78.1 mtp85 -61.07 -35.17 76.23 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.212 -179.742 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 22.8 t-105 -61.94 -38.54 88.83 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.791 179.407 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 61.7 ttt85 -62.86 -39.05 93.23 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.276 -179.901 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -59.23 -50.75 72.82 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 120.89 -0.324 . . . . 0.0 111.103 -179.345 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 6.4 p -73.54 -36.85 48.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-O 120.84 0.352 . . . . 0.0 110.825 179.748 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . 0.428 ' O ' ' CB ' ' A' ' 64' ' ' GLN . . . -64.06 -54.85 27.66 Favored Glycine 0 C--O 1.223 -0.59 0 N-CA-C 111.438 -0.665 . . . . 0.0 111.438 -179.104 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 62.5 m-20 -63.35 -35.86 81.8 Favored 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 120.828 -0.349 . . . . 0.0 110.581 -179.536 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 3.8 m -64.01 -62.57 1.55 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.841 0.353 . . . . 0.0 111.355 -179.509 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 21.1 m-85 -63.5 -41.97 98.52 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.972 -179.701 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . 0.511 ' O ' ' ND2' ' A' ' 68' ' ' ASN . 56.7 tt0 -62.92 -42.21 99.72 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.877 -179.582 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 24.5 t0 -54.7 -56.75 15.85 Favored 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 120.476 -0.49 . . . . 0.0 110.944 -179.61 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 65.2 m-85 -64.46 -41.47 96.49 Favored 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 120.678 -0.409 . . . . 0.0 110.787 179.846 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . 0.619 ' CE2' ' NZ ' ' A' ' 33' ' ' LYS . 65.6 t80 -57.61 -41.0 80.4 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.618 -179.403 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . 0.511 ' ND2' ' O ' ' A' ' 64' ' ' GLN . 3.1 m120 -62.15 -43.82 97.99 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.122 -179.075 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 81.1 p -77.69 -18.64 56.42 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.238 -179.812 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 34.9 m-85 -109.73 16.09 22.32 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.381 179.933 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -160.41 -108.32 0.23 Allowed Glycine 0 CA--C 1.532 1.147 0 C-N-CA 120.539 -0.838 . . . . 0.0 111.213 -179.947 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 65.3 Cg_endo -73.71 141.49 30.84 Favored 'Trans proline' 0 N--CA 1.497 1.715 0 C-N-CA 121.98 1.787 . . . . 0.0 113.211 -179.487 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 81.5 tt0 -86.44 -43.38 12.84 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.548 179.343 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.572 ' CD ' ' H ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -82.75 -26.67 31.67 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 115.892 -0.595 . . . . 0.0 111.326 -179.46 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.54 ' H ' ' HD3' ' A' ' 74' ' ' LYS . 87.5 t 57.38 115.57 0.02 OUTLIER Pre-proline 0 N--CA 1.45 -0.436 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.683 -179.554 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_exo -53.73 127.84 27.1 Favored 'Trans proline' 0 N--CA 1.495 1.576 0 C-N-CA 121.473 1.449 . . . . 0.0 111.697 179.74 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 61.1 t -82.65 -7.42 10.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.98 179.827 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 68.2 p -48.95 -22.02 0.77 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.549 -179.455 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.06 -27.06 68.63 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.532 179.722 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 34.6 t80 -60.95 -40.44 93.34 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.147 -179.815 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 20.9 m -57.98 -42.08 84.35 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.527 -179.687 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 13.5 m-85 -57.35 -53.8 54.03 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.772 -0.371 . . . . 0.0 110.621 -179.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' TRP . . . . . 0.484 ' C ' ' CD1' ' A' ' 83' ' ' TRP . 9.0 t-105 -56.39 -40.55 74.81 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.499 -179.983 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 83.8 m-20 -61.27 -45.41 94.61 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 120.484 -0.486 . . . . 0.0 111.111 -179.01 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 42.4 tp -72.83 -57.62 3.94 Favored 'General case' 0 C--O 1.218 -0.567 0 C-N-CA 120.337 -0.545 . . . . 0.0 110.574 179.84 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -53.75 -26.41 13.68 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 C-N-CA 120.733 -0.387 . . . . 0.0 110.379 179.452 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . 0.415 ' CB ' ' O ' ' A' ' 83' ' ' TRP . 64.2 tttt -65.44 -50.93 63.56 Favored 'General case' 0 C--N 1.322 -0.608 0 C-N-CA 120.404 -0.519 . . . . 0.0 110.393 179.938 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . 0.434 ' O ' ' OD1' ' A' ' 91' ' ' ASP . 1.1 pp20? -80.75 -19.71 44.33 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.774 179.954 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.461 ' CD2' ' OH ' ' A' ' 11' ' ' TYR . 12.6 tp -62.17 -43.76 98.12 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.322 -178.746 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 3.1 mt -63.69 -45.47 97.33 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 C-N-CA 120.271 -0.572 . . . . 0.0 110.847 -178.783 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . 0.434 ' OD1' ' O ' ' A' ' 88' ' ' GLU . 4.4 p30 -81.64 -4.92 57.45 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.433 -0.348 . . . . 0.0 111.075 -178.757 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . 0.471 ' O ' ' CB ' ' A' ' 93' ' ' LYS . 86.4 tttt -57.24 -15.71 6.59 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.633 -179.904 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . 0.471 ' CB ' ' O ' ' A' ' 92' ' ' LYS . 59.4 tttt 79.63 -68.11 0.13 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.731 179.805 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 70.3 tt0 -73.94 54.7 0.52 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.057 0.456 . . . . 0.0 110.005 -179.741 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.441 ' O ' ' O ' ' A' ' 96' ' ' ASN . 1.9 t -87.46 164.76 2.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.4 -179.636 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' ASN . . . . . 0.601 ' O ' ' N ' ' A' ' 98' ' ' GLN . 0.0 OUTLIER -42.19 167.04 0.07 OUTLIER Pre-proline 0 C--N 1.327 -0.395 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.353 179.731 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 77.0 Cg_exo -40.38 -14.01 0.03 OUTLIER 'Trans proline' 0 C--N 1.312 -1.386 0 C-N-CA 122.844 2.363 . . . . 0.0 112.485 179.174 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . 0.601 ' N ' ' O ' ' A' ' 96' ' ' ASN . 12.1 tt0 . . . . . 0 C--N 1.322 -0.629 0 C-N-CA 120.799 -0.361 . . . . 0.0 110.174 179.17 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 45.3 p . . . . . 0 N--CA 1.458 -0.072 0 CA-C-O 120.865 0.364 . . . . 0.0 110.698 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 46.4 mm-40 -74.93 155.02 37.88 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.605 -179.836 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' GLU . . . . . 0.592 ' C ' ' H ' ' A' ' 110' ' ' LEU . 99.3 mt-10 -89.85 135.11 33.83 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.177 179.536 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 47.3 pt -59.14 0.77 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 115.965 -0.562 . . . . 0.0 110.201 179.564 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . 0.592 ' H ' ' C ' ' A' ' 108' ' ' GLU . 96.6 mt -100.73 -9.43 21.8 Favored 'General case' 0 C--N 1.334 -0.097 0 C-N-CA 120.592 -0.443 . . . . 0.0 110.507 -179.857 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . 0.454 ' O ' ' O ' ' A' ' 114' ' ' SER . 86.3 tttt -71.3 -13.38 61.87 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.676 179.927 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 11.7 t -58.93 -45.38 90.53 Favored 'General case' 0 C--N 1.326 -0.45 0 C-N-CA 120.724 -0.391 . . . . 0.0 110.613 -179.895 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 13.4 m120 -64.54 -41.89 96.07 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.867 -179.785 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 114' ' ' SER . . . . . 0.454 ' O ' ' O ' ' A' ' 111' ' ' LYS . 35.5 t -158.5 177.99 10.63 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.468 -179.815 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 95.5 mt-30 -53.5 -41.52 66.37 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.945 0.402 . . . . 0.0 110.467 -179.812 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 62.8 p -146.75 162.88 37.63 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.571 179.749 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 . . . . . 0 C--N 1.33 -0.268 0 C-N-CA 120.92 -0.312 . . . . 0.0 110.517 179.452 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.695 0 N-CA-C 111.134 -0.787 . . . . 0.0 111.134 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 99.3 mm-40 -56.92 -28.43 62.01 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.819 0.342 . . . . 0.0 110.34 -179.799 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . 0.499 ' O ' ' N ' ' A' ' 7' ' ' GLN . 91.0 mt-10 -57.67 -21.54 40.74 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.563 179.853 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 49.9 tp -40.46 -30.3 0.11 Allowed 'General case' 0 C--O 1.234 0.279 0 CA-C-O 121.004 0.431 . . . . 0.0 110.358 -179.31 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 16.3 t -59.88 -42.43 93.74 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 120.693 -0.403 . . . . 0.0 109.924 179.42 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . 0.499 ' N ' ' O ' ' A' ' 4' ' ' GLU . 87.0 mt-30 -61.39 -35.42 77.43 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.666 179.689 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 63.3 t60 -57.33 -44.1 83.95 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.059 -179.822 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 81.0 mm-40 -61.33 -45.22 95.35 Favored 'General case' 0 C--O 1.241 0.651 0 CA-C-O 121.061 0.457 . . . . 0.0 110.007 179.648 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.427 ' O ' ' CB ' ' A' ' 14' ' ' GLN . 64.5 mtp85 -64.41 -33.25 75.43 Favored 'General case' 0 C--O 1.212 -0.871 0 N-CA-C 109.22 -0.659 . . . . 0.0 109.22 179.636 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 53.4 t80 -60.09 -37.77 80.93 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 120.554 -0.458 . . . . 0.0 110.365 -179.52 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 4.5 t -61.62 -49.44 84.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 C-N-CA 120.056 -0.658 . . . . 0.0 111.048 179.935 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 80.9 mm-40 -80.72 -43.05 20.89 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 120.33 -0.548 . . . . 0.0 111.659 -179.33 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . 0.427 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 69.1 tp60 -61.36 -52.75 63.34 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.881 -0.6 . . . . 0.0 111.325 -178.977 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.21 -45.27 92.45 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 120.649 -0.42 . . . . 0.0 110.086 -179.613 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 92.0 mttt -58.16 -33.57 69.36 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 120.674 -0.411 . . . . 0.0 110.527 179.236 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 76.8 mt-30 -71.95 -41.68 67.48 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.178 0.513 . . . . 0.0 110.446 178.664 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -55.12 -42.98 73.68 Favored 'General case' 0 C--O 1.222 -0.368 0 CA-C-N 116.074 -0.512 . . . . 0.0 109.69 179.843 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.454 ' O ' ' N ' ' A' ' 22' ' ' ARG . 5.0 mt -66.62 -37.96 85.94 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.995 0.426 . . . . 0.0 110.703 178.579 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 61.6 tttm -45.61 -37.36 5.52 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 -179.62 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' THR . . . . . 0.523 ' C ' ' H ' ' A' ' 23' ' ' GLY . 1.0 OUTLIER -61.14 -33.18 73.0 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.01 179.392 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.454 ' N ' ' O ' ' A' ' 19' ' ' LEU . 10.3 mmm180 -72.93 15.63 0.19 Allowed 'General case' 0 N--CA 1.464 0.266 0 CA-C-O 120.868 0.366 . . . . 0.0 110.41 -179.633 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . 0.523 ' H ' ' C ' ' A' ' 21' ' ' THR . . . 84.41 13.67 72.94 Favored Glycine 0 CA--C 1.525 0.696 0 N-CA-C 110.561 -1.016 . . . . 0.0 110.561 -179.872 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 11.7 t -88.01 167.65 1.69 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 N-CA-C 110.314 -0.254 . . . . 0.0 110.314 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -130.0 129.85 44.25 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.214 179.616 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 3.6 m -128.15 108.56 17.99 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.307 0 CA-C-N 116.503 -0.317 . . . . 0.0 110.543 -179.884 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.511 ' HD3' ' H ' ' A' ' 29' ' ' ALA . 12.5 tmtt? -109.49 165.22 11.82 Favored 'General case' 0 CA--C 1.527 0.074 0 N-CA-C 109.959 -0.385 . . . . 0.0 109.959 -179.824 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 89.8 m-85 -47.06 -35.94 7.5 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.923 0.392 . . . . 0.0 110.246 -179.973 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . 0.511 ' H ' ' HD3' ' A' ' 27' ' ' LYS . . . -57.95 -24.03 56.25 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 121.185 0.517 . . . . 0.0 110.042 179.452 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.417 ' N ' ' O ' ' A' ' 27' ' ' LYS . 65.9 t0 -60.66 -48.36 82.14 Favored 'General case' 0 C--O 1.222 -0.367 0 CA-C-N 115.606 -0.724 . . . . 0.0 110.594 -179.697 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.504 ' O ' ' CB ' ' A' ' 35' ' ' PHE . 5.4 mp -63.72 -42.09 97.98 Favored 'General case' 0 C--O 1.217 -0.631 0 CA-C-O 121.048 0.452 . . . . 0.0 110.155 179.448 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 30.4 mt -59.29 -44.95 92.45 Favored 'General case' 0 C--N 1.31 -1.119 0 C-N-CA 119.332 -0.947 . . . . 0.0 110.423 -178.892 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.465 ' O ' ' CD1' ' A' ' 37' ' ' PHE . 99.7 mttt -73.96 -41.68 61.62 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.075 -0.511 . . . . 0.0 112.366 -179.189 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 5.1 m-85 -83.07 -61.59 1.82 Allowed 'General case' 0 CA--C 1.511 -0.534 0 C-N-CA 120.738 -0.385 . . . . 0.0 111.214 -178.664 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.504 ' CB ' ' O ' ' A' ' 31' ' ' LEU . 17.1 t80 -41.98 -45.91 3.97 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.198 -179.322 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 80.1 m-20 -72.74 -41.49 65.08 Favored 'General case' 0 CA--C 1.529 0.164 0 C-N-CA 120.291 -0.564 . . . . 0.0 111.809 -179.44 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.465 ' CD1' ' O ' ' A' ' 33' ' ' LYS . 3.5 m-30 -63.34 -51.13 67.26 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 111.975 0.361 . . . . 0.0 111.975 -178.037 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . 0.536 ' O ' ' N ' ' A' ' 42' ' ' CYS . 6.5 m -67.68 -42.65 86.64 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.716 -179.563 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.424 ' H ' HG22 ' A' ' 38' ' ' VAL . 88.4 tttt -65.47 -30.57 71.37 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.137 179.982 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 57.2 t0 -54.21 -49.23 69.88 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 120.84 -0.344 . . . . 0.0 110.544 -179.233 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 9.5 p -109.2 -8.67 15.09 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.037 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . 0.536 ' N ' ' O ' ' A' ' 38' ' ' VAL . 16.9 m 42.43 55.9 10.3 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.498 -179.526 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . 0.566 ' C ' ' H ' ' A' ' 45' ' ' PHE . 74.3 Cg_endo -78.33 -26.63 5.99 Favored 'Trans proline' 0 N--CA 1.491 1.361 0 C-N-CA 122.491 2.127 . . . . 0.0 112.997 -179.358 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . 0.413 ' CH2' ' CE3' ' A' ' 56' ' ' TRP . 0.0 OUTLIER -71.78 22.49 0.05 OUTLIER 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.968 -179.624 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 0.566 ' H ' ' C ' ' A' ' 43' ' ' PRO . 33.6 t80 40.03 61.63 6.16 Favored Pre-proline 0 C--N 1.326 -0.423 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.214 -179.091 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.451 ' HD3' ' N ' ' A' ' 45' ' ' PHE . 32.4 Cg_exo -60.39 -12.1 19.11 Favored 'Trans proline' 0 N--CA 1.496 1.657 0 C-N-CA 122.654 2.236 . . . . 0.0 112.257 -179.68 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 88.6 mt-30 -53.31 -53.96 43.32 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 120.534 -0.466 . . . . 0.0 110.45 -179.01 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 34.0 tp10 -88.93 -29.46 19.55 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.886 -0.413 . . . . 0.0 109.886 178.819 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 83.9 61.77 1.82 Allowed Glycine 0 CA--C 1.528 0.847 0 N-CA-C 110.01 -1.236 . . . . 0.0 110.01 -178.33 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 13.8 t -131.2 169.91 15.29 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-O 120.664 0.269 . . . . 0.0 110.524 -179.115 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.1 mt -87.02 132.14 33.21 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.314 0 C-N-CA 120.709 -0.397 . . . . 0.0 110.228 178.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -118.37 121.0 39.29 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.221 179.54 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 16.8 mm -91.74 -47.07 14.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.195 -179.578 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -64.11 -48.93 74.22 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-O 121.01 0.433 . . . . 0.0 111.152 -179.398 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 78.6 mmt-85 -64.7 -33.58 76.29 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.116 -179.745 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' TRP . . . . . 0.413 ' CE3' ' CH2' ' A' ' 44' ' ' TRP . 37.5 t-105 -59.81 -39.87 86.46 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-O 120.955 0.407 . . . . 0.0 110.269 -179.803 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 87.7 mtm180 -64.67 -38.34 90.67 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.453 -179.922 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 68.4 mmt-85 -60.59 -51.69 68.34 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.824 -0.35 . . . . 0.0 111.218 -179.643 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 3.5 p -66.16 -35.52 75.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.329 179.707 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -66.96 -45.03 87.07 Favored Glycine 0 CA--C 1.526 0.733 0 N-CA-C 111.246 -0.742 . . . . 0.0 111.246 179.867 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 99.8 m-20 -63.34 -43.84 96.57 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.718 0.294 . . . . 0.0 111.28 -179.577 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 74.8 m -64.14 -47.42 80.01 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.012 0.434 . . . . 0.0 110.557 -179.738 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 8.0 m-85 -66.4 -33.85 76.63 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.534 179.55 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 70.4 tp60 -57.69 -43.07 84.84 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.843 0.354 . . . . 0.0 110.295 -179.831 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -62.92 -52.8 61.65 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.922 0.391 . . . . 0.0 110.542 179.612 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' TYR . . . . . 0.442 ' O ' ' OG1' ' A' ' 69' ' ' THR . 38.7 m-85 -65.03 -25.23 67.75 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.476 179.399 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 61.5 t80 -65.5 -45.13 84.78 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.424 -179.912 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 88.6 m-20 -64.4 -39.45 93.87 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.592 -179.523 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.442 ' OG1' ' O ' ' A' ' 66' ' ' TYR . 82.2 p -49.77 -35.62 23.06 Favored 'General case' 0 C--N 1.324 -0.53 0 C-N-CA 120.578 -0.449 . . . . 0.0 111.159 -179.039 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 14.9 m-85 -67.36 -46.56 73.01 Favored 'General case' 0 C--N 1.321 -0.653 0 C-N-CA 119.888 -0.725 . . . . 0.0 111.056 -179.09 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . 0.416 ' H ' ' HD3' ' A' ' 72' ' ' PRO . . . 112.6 71.91 0.6 Allowed Glycine 0 N--CA 1.471 1.003 0 N-CA-C 110.952 -0.859 . . . . 0.0 110.952 -179.933 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . 0.416 ' HD3' ' H ' ' A' ' 71' ' ' GLY . 25.1 Cg_exo -62.02 143.69 95.36 Favored 'Trans proline' 0 N--CA 1.498 1.766 0 C-N-CA 123.247 2.631 . . . . 0.0 111.379 179.809 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 83.5 tt0 -74.93 -49.79 18.99 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-O 120.874 0.368 . . . . 0.0 110.544 -179.728 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.44 ' CD ' ' N ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -138.46 4.42 2.4 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.594 -179.547 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 63.8 t 57.42 92.97 0.06 OUTLIER Pre-proline 0 CA--C 1.534 0.331 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.068 -178.632 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_exo -54.15 125.71 19.71 Favored 'Trans proline' 0 N--CA 1.491 1.348 0 C-N-CA 121.722 1.615 . . . . 0.0 112.303 -178.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . 0.427 ' O ' ' N ' ' A' ' 80' ' ' PHE . 43.6 t -84.67 -20.22 8.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.773 179.313 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' THR . . . . . 0.448 ' O ' ' OG ' ' A' ' 81' ' ' SER . 57.9 p -41.54 -27.49 0.1 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.585 -179.031 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . 0.409 ' N ' ' O ' ' A' ' 77' ' ' VAL . . . -62.39 -39.91 94.78 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.12 0.486 . . . . 0.0 110.64 179.839 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . 0.427 ' N ' ' O ' ' A' ' 77' ' ' VAL . 3.3 m-85 -62.19 -35.89 80.22 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.428 179.907 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' SER . . . . . 0.448 ' OG ' ' O ' ' A' ' 78' ' ' THR . 54.2 p -60.22 -40.04 88.74 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.244 -179.969 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 13.7 m-85 -60.6 -53.4 57.95 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 120.696 -0.402 . . . . 0.0 110.707 179.816 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' TRP . . . . . . . . . . . . . 31.0 t90 -58.25 -38.68 77.4 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.738 179.806 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 82.3 m-20 -62.01 -45.7 92.43 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 120.684 -0.406 . . . . 0.0 110.957 -179.536 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 43.5 tp -71.45 -54.0 12.11 Favored 'General case' 0 C--O 1.218 -0.561 0 C-N-CA 120.439 -0.505 . . . . 0.0 110.466 179.606 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -57.23 -26.36 25.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-O 120.794 0.33 . . . . 0.0 110.61 179.622 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 66.4 tttt -65.59 -50.84 63.59 Favored 'General case' 0 C--N 1.32 -0.692 0 C-N-CA 120.32 -0.552 . . . . 0.0 110.107 -179.839 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . 0.438 ' O ' ' OE1' ' A' ' 88' ' ' GLU . 1.0 OUTLIER -80.38 -20.03 45.0 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.84 -179.815 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 14.1 tp -61.42 -44.42 97.17 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.47 -179.245 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 3.2 mt -63.52 -43.47 98.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 C-N-CA 120.25 -0.58 . . . . 0.0 109.841 -179.66 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 68.0 t0 -53.0 -43.46 66.49 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.751 -178.739 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 68.2 mmtt -62.5 134.91 57.07 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.954 0.406 . . . . 0.0 110.413 -179.779 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . 0.475 ' C ' ' H ' ' A' ' 95' ' ' VAL . 98.6 mttt -72.52 -9.87 59.09 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.539 -179.921 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 80.3 mm-40 -72.34 43.56 0.11 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.561 179.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.475 ' H ' ' C ' ' A' ' 93' ' ' LYS . 5.7 m -120.03 132.43 69.73 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.19 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.42 179.874 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -49.21 158.82 0.68 Allowed Pre-proline 0 C--N 1.327 -0.389 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.493 -179.628 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -60.55 -12.64 21.79 Favored 'Trans proline' 0 N--CA 1.495 1.59 0 C-N-CA 122.829 2.353 . . . . 0.0 112.061 179.543 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 8.6 pt20 . . . . . 0 C--N 1.323 -0.56 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.785 -179.711 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 75.2 p . . . . . 0 N--CA 1.46 0.071 0 CA-C-O 120.905 0.383 . . . . 0.0 110.762 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . 0.525 ' N ' ' OE1' ' A' ' 107' ' ' GLU . 44.3 mp0 -139.71 167.26 22.5 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.349 -179.752 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' GLU . . . . . 0.473 ' C ' ' H ' ' A' ' 110' ' ' LEU . 81.2 mm-40 -94.21 128.86 40.91 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.071 179.49 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 45.4 pt -47.23 -15.85 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.187 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . 0.473 ' H ' ' C ' ' A' ' 108' ' ' GLU . 34.8 mt -64.01 -42.86 97.01 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.367 179.767 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -70.52 -32.33 69.75 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.542 179.692 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 14.2 t -58.91 -45.77 89.51 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.908 -178.973 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 32.0 t30 -66.37 -46.59 76.17 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.871 0.367 . . . . 0.0 110.858 179.801 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 31.2 p -162.28 158.81 24.78 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.61 179.785 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 84.4 mt-30 -99.06 13.04 34.22 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.79 0.329 . . . . 0.0 110.382 179.769 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 14.8 m -59.23 -47.59 84.8 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.147 -179.751 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 99.4 m-20 . . . . . 0 C--N 1.329 -0.285 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.568 179.543 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.682 0 N-CA-C 111.033 -0.827 . . . . 0.0 111.033 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 87.6 mt-30 -61.78 -23.22 66.05 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.902 0.382 . . . . 0.0 110.315 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 34.1 tp10 -51.92 -21.68 3.21 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.519 179.898 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.48 ' O ' ' OE1' ' A' ' 9' ' ' GLU . 33.6 tp -41.07 -39.59 1.27 Allowed 'General case' 0 C--O 1.235 0.312 0 CA-C-O 121.026 0.441 . . . . 0.0 110.284 -179.348 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' SER . . . . . 0.418 ' HG ' ' N ' ' A' ' 7' ' ' GLN . 89.9 p -47.53 -36.76 10.9 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 120.758 -0.377 . . . . 0.0 110.244 179.929 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . 0.418 ' N ' ' HG ' ' A' ' 6' ' ' SER . 72.3 tp60 -63.77 -32.46 73.97 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.467 179.608 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' HIS . . . . . 0.408 ' N ' ' O ' ' A' ' 5' ' ' LEU . 53.9 t60 -59.24 -44.8 92.35 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 120.664 -0.414 . . . . 0.0 110.235 -179.932 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.48 ' OE1' ' O ' ' A' ' 5' ' ' LEU . 56.5 mp0 -61.73 -49.19 77.44 Favored 'General case' 0 C--O 1.244 0.77 0 C-N-CA 120.36 -0.536 . . . . 0.0 110.342 179.707 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.442 ' O ' ' CB ' ' A' ' 14' ' ' GLN . 75.3 mtm-85 -63.8 -31.73 73.0 Favored 'General case' 0 C--O 1.211 -0.968 0 C-N-CA 120.19 -0.604 . . . . 0.0 109.429 179.485 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 31.5 t80 -59.86 -36.69 77.4 Favored 'General case' 0 C--N 1.323 -0.575 0 C-N-CA 120.889 -0.324 . . . . 0.0 110.315 -179.664 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 4.0 t -63.78 -49.34 82.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 C-N-CA 120.077 -0.649 . . . . 0.0 111.196 179.924 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -81.22 -34.28 32.3 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 120.438 -0.505 . . . . 0.0 111.874 -179.265 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . 0.442 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 70.5 tp60 -70.39 -52.98 18.51 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.049 -178.93 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.7 -47.01 85.49 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 109.988 -0.375 . . . . 0.0 109.988 -179.501 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -57.32 -32.73 66.99 Favored 'General case' 0 C--N 1.33 -0.257 0 C-N-CA 120.667 -0.413 . . . . 0.0 110.143 179.355 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 56.1 tt0 -71.05 -37.6 72.53 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.98 0.419 . . . . 0.0 110.467 179.304 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -58.14 -36.97 73.75 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.184 -179.858 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.4 mt -82.16 -27.04 32.91 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.01 0.433 . . . . 0.0 110.48 179.376 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -55.77 -37.73 68.93 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.072 -179.783 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 1.3 t -76.56 -20.82 56.44 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.633 179.817 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 61.0 mmt-85 -73.7 -3.31 27.52 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 120.769 0.318 . . . . 0.0 110.308 179.67 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 107.0 19.67 9.37 Favored Glycine 0 CA--C 1.526 0.747 0 N-CA-C 110.728 -0.949 . . . . 0.0 110.728 -179.601 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.415 ' CG1' ' N ' ' A' ' 25' ' ' LYS . 26.2 t -105.35 167.43 3.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 N-CA-C 110.327 -0.249 . . . . 0.0 110.327 -179.934 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.415 ' N ' ' CG1' ' A' ' 24' ' ' VAL . 99.6 mttt -125.86 131.99 52.28 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.348 179.359 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . 0.499 ' CG1' ' HH ' ' A' ' 82' ' ' TYR . 1.7 m -134.79 108.94 11.09 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.289 0 CA-C-N 116.506 -0.315 . . . . 0.0 110.355 179.838 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.552 ' HD3' ' H ' ' A' ' 29' ' ' ALA . 14.5 tmtt? -109.25 161.72 14.97 Favored 'General case' 0 C--O 1.221 -0.398 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 179.976 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 58.0 t80 -40.58 -29.58 0.09 Allowed 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.095 0.474 . . . . 0.0 110.966 179.588 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . 0.552 ' H ' ' HD3' ' A' ' 27' ' ' LYS . . . -60.65 -24.44 65.56 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.835 -179.797 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.84 -45.77 91.05 Favored 'General case' 0 C--O 1.221 -0.426 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.406 -179.335 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.485 ' O ' ' CB ' ' A' ' 35' ' ' PHE . 5.5 mp -64.77 -41.03 96.17 Favored 'General case' 0 C--O 1.216 -0.693 0 CA-C-O 120.989 0.423 . . . . 0.0 110.156 179.591 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 56.2 mt -55.34 -46.1 76.4 Favored 'General case' 0 C--N 1.316 -0.869 0 C-N-CA 119.453 -0.899 . . . . 0.0 111.118 -178.765 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.422 ' NZ ' ' CZ ' ' A' ' 37' ' ' PHE . 63.9 tttm -84.68 -50.45 7.63 Favored 'General case' 0 C--N 1.32 -0.676 0 C-N-CA 120.496 -0.482 . . . . 0.0 111.771 -179.25 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 74.9 t80 -61.16 -50.42 73.25 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.312 -178.786 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.485 ' CB ' ' O ' ' A' ' 31' ' ' LEU . 17.7 t80 -60.75 -46.12 91.66 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.29 -179.36 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 91.7 m-20 -70.17 -25.27 63.36 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 120.601 -0.44 . . . . 0.0 111.339 -179.541 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.422 ' CZ ' ' NZ ' ' A' ' 33' ' ' LYS . 0.9 OUTLIER -65.03 -53.43 46.05 Favored 'General case' 0 N--CA 1.462 0.143 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.593 -179.074 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . 0.505 ' O ' ' N ' ' A' ' 42' ' ' CYS . 2.6 m -72.86 -39.46 58.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 C-N-CA 120.481 -0.488 . . . . 0.0 111.037 -179.579 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 25.1 mmtt -57.93 -25.82 61.4 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.724 -179.528 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 85.3 m-20 -49.84 -63.6 1.06 Allowed 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 120.684 -0.406 . . . . 0.0 111.004 179.933 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' THR . . . . . 0.4 ' C ' ' SG ' ' A' ' 42' ' ' CYS . 1.6 p -114.59 -11.01 12.45 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.538 -0.301 . . . . 0.0 111.319 -179.939 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . 0.505 ' N ' ' O ' ' A' ' 38' ' ' VAL . 1.5 m 63.72 47.35 0.77 Allowed Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.697 -179.385 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . 0.523 ' C ' ' H ' ' A' ' 45' ' ' PHE . 57.9 Cg_endo -72.23 -30.45 13.03 Favored 'Trans proline' 0 N--CA 1.493 1.458 0 C-N-CA 122.699 2.266 . . . . 0.0 112.432 179.928 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . 0.4 ' HE1' ' HA ' ' A' ' 51' ' ' ILE . 2.0 t-105 -58.32 -3.41 0.27 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.433 -179.643 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 0.523 ' H ' ' C ' ' A' ' 43' ' ' PRO . 2.9 t80 50.45 53.45 14.06 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.168 0.508 . . . . 0.0 110.16 -179.837 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.477 ' CD ' ' N ' ' A' ' 45' ' ' PHE . 38.3 Cg_endo -67.94 -12.35 35.01 Favored 'Trans proline' 0 C--N 1.308 -1.602 0 C-N-CA 122.835 2.357 . . . . 0.0 112.065 179.846 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 52.9 tt0 -59.11 -46.43 88.35 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.194 -179.688 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 44.9 tt0 -89.27 -18.03 27.82 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.029 0.443 . . . . 0.0 110.332 179.584 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 77.11 66.56 1.79 Allowed Glycine 0 CA--C 1.525 0.696 0 N-CA-C 110.247 -1.141 . . . . 0.0 110.247 -178.921 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' THR . . . . . 0.506 ' OG1' ' NE2' ' A' ' 98' ' ' GLN . 2.9 t -138.0 155.67 48.61 Favored 'General case' 0 C--N 1.33 -0.282 0 C-N-CA 121.043 -0.263 . . . . 0.0 110.658 -179.548 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.4 ' HA ' ' HE1' ' A' ' 44' ' ' TRP . 1.5 mt -87.7 140.6 15.54 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.2 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.305 179.3 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . 0.432 ' OD2' ' O ' ' A' ' 43' ' ' PRO . 69.8 m-20 -111.14 120.12 41.25 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.191 179.631 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 24.9 mm -94.78 -56.07 5.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.893 179.215 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -78.0 -49.41 14.12 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.561 -179.464 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.549 ' CG ' HH21 ' A' ' 58' ' ' ARG . 83.8 mtt85 -59.95 -32.59 70.95 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.132 -0.486 . . . . 0.0 109.958 -179.708 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' TRP . . . . . 0.691 ' HE1' ' HE1' ' A' ' 83' ' ' TRP . 18.2 t-105 -62.89 -39.9 95.91 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.52 179.359 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 83.6 mtp180 -63.48 -35.24 79.8 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.444 -179.794 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . 0.549 HH21 ' CG ' ' A' ' 55' ' ' ARG . 43.6 mtm-85 -60.16 -50.92 71.77 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 120.509 -0.476 . . . . 0.0 111.006 -179.96 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 7.4 p -73.96 -39.48 51.39 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.377 0 C-N-CA 120.861 -0.335 . . . . 0.0 110.644 179.581 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . 0.433 ' O ' ' CB ' ' A' ' 64' ' ' GLN . . . -63.07 -49.21 73.67 Favored Glycine 0 C--O 1.222 -0.634 0 N-CA-C 111.353 -0.699 . . . . 0.0 111.353 -179.225 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 66.2 t0 -61.82 -44.87 95.99 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 120.625 0.25 . . . . 0.0 111.156 -179.497 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' CYS . . . . . 0.465 ' SG ' ' O ' ' A' ' 58' ' ' ARG . 73.3 m -62.9 -55.83 22.57 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.207 -179.227 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 12.6 m-85 -64.22 -43.23 95.63 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.1 -179.821 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . 0.433 ' CB ' ' O ' ' A' ' 60' ' ' GLY . 61.3 tt0 -62.37 -39.82 94.43 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.651 -179.45 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -57.01 -54.07 50.93 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 120.765 -0.374 . . . . 0.0 110.849 -179.865 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 66.4 m-85 -67.86 -39.77 83.72 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.706 179.764 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . 0.523 ' O ' ' N ' ' A' ' 71' ' ' GLY . 57.1 t80 -58.75 -41.88 87.52 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.427 -179.501 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . 0.409 ' CG ' ' O ' ' A' ' 64' ' ' GLN . 4.4 m120 -62.79 -45.29 93.35 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.331 -178.964 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 24.6 p -74.98 -20.12 59.8 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 120.608 -0.437 . . . . 0.0 109.985 -179.433 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 47.6 m-85 -114.11 16.28 18.14 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.401 179.945 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . 0.523 ' N ' ' O ' ' A' ' 67' ' ' TYR . . . -154.18 -111.03 0.41 Allowed Glycine 0 CA--C 1.534 1.239 0 N-CA-C 111.06 -0.816 . . . . 0.0 111.06 -179.984 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -73.06 140.1 30.78 Favored 'Trans proline' 0 N--CA 1.494 1.548 0 C-N-CA 121.989 1.793 . . . . 0.0 113.177 -179.34 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 80.7 mm-40 -86.28 -42.84 13.41 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.487 179.326 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.605 ' CD ' ' H ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -80.78 -24.63 38.48 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.027 179.933 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.505 ' H ' ' HD3' ' A' ' 74' ' ' LYS . 75.2 t 53.91 101.04 0.03 OUTLIER Pre-proline 0 N--CA 1.449 -0.481 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.189 -179.719 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 44.5 Cg_exo -55.05 129.28 34.44 Favored 'Trans proline' 0 N--CA 1.492 1.413 0 C-N-CA 121.666 1.578 . . . . 0.0 111.758 179.845 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . 0.407 ' C ' ' N ' ' A' ' 79' ' ' ALA . 48.3 t -82.31 -6.81 10.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.835 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 43.2 p -44.26 -23.23 0.09 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.64 -179.817 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . 0.407 ' N ' ' C ' ' A' ' 77' ' ' VAL . . . -57.62 -28.91 64.09 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.079 0.466 . . . . 0.0 110.431 179.73 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 48.8 t80 -61.19 -39.63 90.9 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.153 179.529 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 66.9 m -56.14 -40.14 73.36 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.391 -179.9 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' TYR . . . . . 0.499 ' HH ' ' CG1' ' A' ' 26' ' ' VAL . 14.2 m-85 -60.99 -48.94 79.49 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 120.737 -0.385 . . . . 0.0 110.792 179.65 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' TRP . . . . . 0.691 ' HE1' ' HE1' ' A' ' 56' ' ' TRP . 40.5 m0 -57.72 -36.11 71.58 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.57 -179.652 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 78.7 m-20 -62.77 -47.47 83.37 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 120.388 -0.525 . . . . 0.0 110.899 -179.863 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 36.7 tp -71.25 -52.47 18.84 Favored 'General case' 0 C--O 1.219 -0.524 0 C-N-CA 120.333 -0.547 . . . . 0.0 110.588 179.611 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -58.42 -26.68 31.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 C-N-CA 120.804 -0.358 . . . . 0.0 110.552 -179.889 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . 0.405 ' CB ' ' O ' ' A' ' 83' ' ' TRP . 63.4 tttt -65.97 -49.65 67.12 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.634 179.884 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.1 pp20? -80.07 -20.72 44.53 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.007 -179.665 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.49 -47.12 87.11 Favored 'General case' 0 N--CA 1.443 -0.793 0 C-N-CA 120.172 -0.611 . . . . 0.0 110.322 -179.111 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 3.4 mt -64.4 -44.4 97.11 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.156 0 C-N-CA 120.174 -0.611 . . . . 0.0 109.775 -179.815 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . 0.458 ' OD1' ' O ' ' A' ' 91' ' ' ASP . 64.6 t0 -62.19 -37.22 84.46 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.063 -179.16 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 26.6 tttm -42.12 145.57 0.36 Allowed 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.929 0.395 . . . . 0.0 110.363 -179.58 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 57.5 mttp -79.43 -17.09 55.01 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.669 -179.637 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 71.1 mm-40 -109.64 53.14 0.7 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.642 -179.777 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.443 ' O ' ' O ' ' A' ' 96' ' ' ASN . 44.9 t -73.09 148.08 9.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-O 120.911 0.386 . . . . 0.0 110.431 179.696 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' ASN . . . . . 0.614 ' O ' ' N ' ' A' ' 98' ' ' GLN . 0.0 OUTLIER -41.91 166.81 0.07 OUTLIER Pre-proline 0 C--N 1.327 -0.402 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.291 179.971 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_exo -39.59 -13.16 0.02 OUTLIER 'Trans proline' 0 N--CA 1.493 1.471 0 C-N-CA 123.079 2.52 . . . . 0.0 112.713 178.868 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . 0.614 ' N ' ' O ' ' A' ' 96' ' ' ASN . 8.8 tt0 . . . . . 0 C--N 1.323 -0.556 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.101 179.197 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 11.0 m . . . . . 0 N--CA 1.457 -0.106 0 CA-C-O 120.721 0.296 . . . . 0.0 110.329 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 94.4 mt-10 -117.54 141.33 48.49 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.498 -179.794 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' GLU . . . . . 0.607 ' C ' ' H ' ' A' ' 110' ' ' LEU . 95.2 mt-10 -66.45 133.12 49.78 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 120.644 -0.423 . . . . 0.0 110.132 179.325 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 42.2 pt -55.39 -2.14 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.19 179.466 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . 0.607 ' H ' ' C ' ' A' ' 108' ' ' GLU . 95.6 mt -96.45 5.96 49.75 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-O 120.806 0.336 . . . . 0.0 110.463 -179.762 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -114.45 129.68 56.67 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.385 179.904 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 30.2 p -136.86 -119.94 0.15 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.273 179.884 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 113' ' ' ASN . . . . . 0.416 ' C ' ' OD1' ' A' ' 113' ' ' ASN . 43.4 t-20 -64.39 -41.39 96.7 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.371 179.8 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 68.6 m -134.27 154.8 51.08 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.61 -179.848 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 87.4 mt-30 -87.08 85.42 7.23 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.391 179.9 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 7.3 m -63.58 -45.26 91.23 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.63 -179.771 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 72.7 m-20 . . . . . 0 C--N 1.331 -0.216 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.763 -179.397 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . 0.526 ' O ' ' N ' ' A' ' 6' ' ' SER . . . . . . . . 0 CA--C 1.523 0.592 0 N-CA-C 110.464 -1.054 . . . . 0.0 110.464 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 20.6 pt20 -43.09 -24.94 0.09 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.847 0.356 . . . . 0.0 110.658 -179.679 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . 0.415 ' N ' ' O ' ' A' ' 2' ' ' GLY . 98.0 mt-10 -73.8 -64.69 0.95 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.69 -179.862 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.45 ' CD1' ' N ' ' A' ' 6' ' ' SER . 4.0 pp -83.83 -41.07 17.9 Favored 'General case' 0 C--O 1.223 -0.32 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.246 -179.944 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' SER . . . . . 0.526 ' N ' ' O ' ' A' ' 2' ' ' GLY . 16.5 m -49.95 -45.91 51.77 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 120.823 -0.351 . . . . 0.0 110.695 -178.7 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . 0.433 ' OE1' ' O ' ' A' ' 46' ' ' PRO . 84.8 mt-30 -62.14 -29.18 70.16 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 120.751 -0.38 . . . . 0.0 110.536 179.483 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 33.3 m170 -80.15 -53.41 6.71 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.807 0.336 . . . . 0.0 111.616 -179.408 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 80.4 mm-40 -65.78 -43.7 87.98 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.282 -179.096 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.536 ' O ' ' N ' ' A' ' 14' ' ' GLN . 96.1 mtt-85 -68.98 -55.24 11.52 Favored 'General case' 0 C--O 1.216 -0.668 0 C-N-CA 120.531 -0.468 . . . . 0.0 110.582 -179.369 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 46.3 t80 -46.68 -38.7 10.18 Favored 'General case' 0 C--N 1.319 -0.759 0 C-N-CA 119.793 -0.763 . . . . 0.0 110.903 -179.215 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 73.9 t -71.41 -60.15 2.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 N-CA-C 112.337 0.495 . . . . 0.0 112.337 -179.389 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.477 ' O ' ' CB ' ' A' ' 17' ' ' GLN . 95.3 mt-10 -80.16 -47.68 14.34 Favored 'General case' 0 C--O 1.213 -0.861 0 C-N-CA 120.804 -0.359 . . . . 0.0 111.431 -178.77 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . 0.536 ' N ' ' O ' ' A' ' 10' ' ' ARG . 51.5 tp60 -50.9 -44.16 59.94 Favored 'General case' 0 C--N 1.317 -0.83 0 C-N-CA 120.794 -0.363 . . . . 0.0 110.577 -179.192 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -78.01 -59.15 2.9 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 120.123 -0.631 . . . . 0.0 111.896 -179.041 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -56.8 -35.49 68.8 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.882 -178.54 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . 0.477 ' CB ' ' O ' ' A' ' 13' ' ' GLU . 60.3 tt0 -71.61 -40.24 69.95 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.499 179.885 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -55.64 -32.8 63.48 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 -179.783 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.4 ' CD1' ' CE2' ' A' ' 82' ' ' TYR . 3.5 mt -86.09 -31.81 21.7 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.151 179.132 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -51.62 -43.97 62.73 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.933 -178.696 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.96 -30.45 71.44 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.577 179.91 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 78.5 mmt-85 -67.7 -7.56 28.01 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.318 -179.772 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 107.17 19.52 9.4 Favored Glycine 0 CA--C 1.525 0.683 0 N-CA-C 111.121 -0.792 . . . . 0.0 111.121 179.696 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.43 ' CG1' ' N ' ' A' ' 25' ' ' LYS . 38.8 t -101.82 167.95 2.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 N-CA-C 110.212 -0.292 . . . . 0.0 110.212 179.897 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.43 ' N ' ' CG1' ' A' ' 24' ' ' VAL . 99.0 mttt -132.74 144.63 50.41 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.399 179.57 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 30.0 m -132.12 130.55 60.93 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.354 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.699 179.91 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 14.3 pttp -109.81 163.78 13.2 Favored 'General case' 0 C--O 1.228 -0.056 0 CA-C-O 120.741 0.305 . . . . 0.0 110.499 179.66 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 93.6 m-85 -49.77 -32.13 13.14 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.959 0.409 . . . . 0.0 110.519 179.999 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -55.12 -24.35 25.6 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.39 179.84 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.46 ' O ' ' CB ' ' A' ' 34' ' ' PHE . 99.0 m-20 -64.44 -46.1 84.62 Favored 'General case' 0 C--O 1.22 -0.492 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.808 -179.987 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.478 ' O ' ' CB ' ' A' ' 35' ' ' PHE . 5.3 mp -63.53 -40.42 96.99 Favored 'General case' 0 C--N 1.315 -0.902 0 C-N-CA 120.23 -0.588 . . . . 0.0 110.407 -179.747 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 30.8 mt -58.8 -49.78 76.39 Favored 'General case' 0 C--N 1.313 -0.98 0 C-N-CA 119.634 -0.826 . . . . 0.0 111.549 -178.179 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -87.75 -51.19 6.0 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 112.591 0.589 . . . . 0.0 112.591 -178.58 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . 0.46 ' CB ' ' O ' ' A' ' 30' ' ' ASP . 9.7 t80 -59.68 -50.25 74.56 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.805 -178.344 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.478 ' CB ' ' O ' ' A' ' 31' ' ' LEU . 10.0 t80 -63.47 -47.91 79.82 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.499 -0.48 . . . . 0.0 110.666 -179.966 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 55.1 t0 -67.69 -29.19 68.39 Favored 'General case' 0 N--CA 1.456 -0.145 0 C-N-CA 120.426 -0.51 . . . . 0.0 111.176 -179.418 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 9.9 t80 -66.34 -51.53 56.25 Favored 'General case' 0 C--N 1.332 -0.173 0 C-N-CA 120.642 -0.423 . . . . 0.0 111.611 -178.255 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . 0.522 ' O ' ' N ' ' A' ' 42' ' ' CYS . 9.1 m -76.47 -39.14 33.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.95 -179.708 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -62.74 -26.78 68.86 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.596 -179.555 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 40.5 t0 -52.97 -52.95 56.43 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.856 -179.299 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 12.0 p -114.07 -6.65 13.1 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.143 179.947 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . 0.522 ' N ' ' O ' ' A' ' 38' ' ' VAL . 3.3 m 43.44 56.52 12.22 Favored Pre-proline 0 CA--C 1.532 0.267 0 CA-C-O 120.885 0.374 . . . . 0.0 110.28 -178.967 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . 0.572 ' C ' ' H ' ' A' ' 45' ' ' PHE . 61.2 Cg_endo -79.34 -15.19 12.76 Favored 'Trans proline' 0 C--N 1.313 -1.304 0 C-N-CA 122.378 2.052 . . . . 0.0 112.428 -179.795 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . 0.503 ' CZ3' ' CE3' ' A' ' 56' ' ' TRP . 0.0 OUTLIER -69.71 22.06 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.474 -179.238 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 0.572 ' H ' ' C ' ' A' ' 43' ' ' PRO . 18.1 t80 36.25 68.86 1.33 Allowed Pre-proline 0 C--O 1.233 0.191 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.343 179.981 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.433 ' O ' ' OE1' ' A' ' 7' ' ' GLN . 48.9 Cg_endo -75.18 -0.45 10.04 Favored 'Trans proline' 0 C--N 1.305 -1.751 0 C-N-CA 122.69 2.26 . . . . 0.0 112.189 -179.252 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 86.9 mt-30 -60.31 -52.83 63.6 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 120.604 -0.438 . . . . 0.0 110.538 -179.797 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 58.9 tt0 -89.23 -14.49 35.83 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.778 0.323 . . . . 0.0 110.448 179.717 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . 0.471 ' O ' ' CB ' ' A' ' 98' ' ' GLN . . . 72.94 58.02 5.0 Favored Glycine 0 CA--C 1.524 0.63 0 N-CA-C 110.336 -1.106 . . . . 0.0 110.336 -178.929 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' THR . . . . . 0.438 ' HG1' ' NE2' ' A' ' 98' ' ' GLN . 2.6 t -132.54 169.2 16.94 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.886 0.374 . . . . 0.0 110.79 -179.331 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.4 mt -85.02 142.17 13.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.434 179.345 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 80.0 m-20 -111.25 121.54 45.53 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.648 -0.705 . . . . 0.0 111.246 179.468 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.415 HG21 HD13 ' A' ' 53' ' ' ILE . 31.1 mm -94.11 -55.0 6.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.28 179.231 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -71.96 -55.23 7.83 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-O 120.873 0.368 . . . . 0.0 111.796 -178.708 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 86.5 mtm-85 -57.51 -30.49 65.18 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.178 -0.465 . . . . 0.0 109.999 -179.607 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' TRP . . . . . 0.503 ' CE3' ' CZ3' ' A' ' 44' ' ' TRP . 12.5 t-105 -62.73 -41.36 99.13 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.727 178.856 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 96.5 mtt-85 -63.24 -33.57 75.77 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.453 -179.835 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . 0.493 ' O ' ' SG ' ' A' ' 62' ' ' CYS . 96.7 mtt180 -63.14 -51.77 65.15 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.552 -0.459 . . . . 0.0 111.285 -179.384 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 3.3 p -66.24 -35.52 75.17 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.333 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.678 179.84 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -73.22 -48.87 17.74 Favored Glycine 0 CA--C 1.528 0.861 0 C-N-CA 120.911 -0.662 . . . . 0.0 111.778 -179.674 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 95.8 m-20 -62.92 -44.51 95.88 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.669 0.271 . . . . 0.0 111.473 -179.074 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' CYS . . . . . 0.493 ' SG ' ' O ' ' A' ' 58' ' ' ARG . 74.6 m -60.73 -58.93 6.36 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.877 0.37 . . . . 0.0 110.877 -179.356 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 24.7 m-85 -61.64 -41.0 96.88 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.81 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 53.9 tt0 -60.59 -39.29 87.56 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.5 -0.318 . . . . 0.0 111.055 -179.873 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.472 ' O ' ' OD1' ' A' ' 68' ' ' ASN . 20.2 t0 -58.25 -52.1 67.01 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 120.943 0.402 . . . . 0.0 110.68 -179.704 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 83.6 m-85 -73.18 -41.14 64.18 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 120.473 -0.491 . . . . 0.0 111.309 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 62.6 t80 -57.55 -47.39 82.16 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.803 -178.78 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . 0.472 ' OD1' ' O ' ' A' ' 65' ' ' ASP . 0.2 OUTLIER -62.8 -41.65 99.37 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.676 -179.853 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.468 ' N ' ' ND2' ' A' ' 68' ' ' ASN . 40.8 p -66.43 -17.97 65.09 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.268 179.972 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 7.9 m-85 -98.8 14.87 27.28 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.547 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 166.22 -87.71 0.1 OUTLIER Glycine 0 CA--C 1.535 1.328 0 C-N-CA 120.764 -0.731 . . . . 0.0 111.734 179.53 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . 0.423 ' O ' ' O ' ' A' ' 68' ' ' ASN . 33.7 Cg_exo -51.13 126.59 19.38 Favored 'Trans proline' 0 N--CA 1.496 1.624 0 C-N-CA 121.866 1.711 . . . . 0.0 112.592 179.938 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.521 ' N ' ' OE1' ' A' ' 73' ' ' GLU . 58.4 mp0 -86.82 -43.93 12.11 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.905 -0.588 . . . . 0.0 110.506 179.286 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.532 ' CD ' ' H ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -104.26 -7.57 19.95 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.108 -179.695 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.422 ' N ' ' HD3' ' A' ' 74' ' ' LYS . 30.2 t 59.41 133.38 0.03 OUTLIER Pre-proline 0 N--CA 1.448 -0.551 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.718 -178.978 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -53.43 129.21 32.58 Favored 'Trans proline' 0 N--CA 1.493 1.459 0 C-N-CA 121.535 1.49 . . . . 0.0 111.238 178.043 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . 0.425 ' O ' ' N ' ' A' ' 80' ' ' PHE . 59.6 t -80.85 -16.54 12.47 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.687 179.891 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' THR . . . . . 0.434 ' O ' ' OG ' ' A' ' 81' ' ' SER . 65.7 p -45.94 -22.82 0.23 Allowed 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.945 0.402 . . . . 0.0 110.072 -179.931 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -67.6 -34.8 77.74 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.68 179.403 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . 0.425 ' N ' ' O ' ' A' ' 77' ' ' VAL . 10.2 m-85 -57.74 -35.38 70.63 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.33 -179.633 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' SER . . . . . 0.434 ' OG ' ' O ' ' A' ' 78' ' ' THR . 94.9 p -60.36 -40.29 90.22 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.355 179.87 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' TYR . . . . . 0.4 ' CE2' ' CD1' ' A' ' 19' ' ' LEU . 13.8 m-85 -60.17 -49.39 77.81 Favored 'General case' 0 C--O 1.223 -0.29 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.797 179.81 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' TRP . . . . . 0.519 ' CD1' ' N ' ' A' ' 83' ' ' TRP . 9.6 m0 -59.12 -40.39 85.24 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.311 179.956 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 78.0 m-20 -62.68 -43.23 99.33 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 120.691 -0.404 . . . . 0.0 110.572 -179.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -70.25 -55.43 9.29 Favored 'General case' 0 C--O 1.221 -0.416 0 N-CA-C 110.215 -0.291 . . . . 0.0 110.215 179.409 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -60.88 -25.52 35.95 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.884 0 C-N-CA 120.959 -0.296 . . . . 0.0 110.717 -179.66 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . 0.426 ' CB ' ' O ' ' A' ' 83' ' ' TRP . 42.2 tttp -65.26 -50.16 66.83 Favored 'General case' 0 C--N 1.317 -0.807 0 C-N-CA 120.467 -0.493 . . . . 0.0 110.555 179.716 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.1 pp20? -80.34 -19.69 45.91 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.679 -179.891 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 14.5 tp -61.5 -45.02 96.0 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.354 -179.015 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 3.6 mt -65.04 -43.86 95.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 C-N-CA 120.293 -0.563 . . . . 0.0 109.956 -179.778 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 94.1 m-20 -65.16 -8.02 15.15 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.841 -178.938 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 84.7 tttt -66.9 146.13 54.73 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.42 179.91 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -61.7 -41.64 97.87 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.661 -179.843 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . 0.46 ' O ' ' C ' ' A' ' 95' ' ' VAL . 97.9 mt-10 -77.66 6.94 6.34 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.828 -179.82 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.46 ' C ' ' O ' ' A' ' 94' ' ' GLU . 2.7 m 30.72 -110.62 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.283 0 O-C-N 123.692 0.62 . . . . 0.0 110.707 -179.806 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' ASN . . . . . 0.531 ' O ' ' N ' ' A' ' 98' ' ' GLN . 1.3 m120 -153.32 160.86 30.43 Favored Pre-proline 0 N--CA 1.45 -0.438 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.568 179.356 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_exo -44.5 -12.23 0.05 OUTLIER 'Trans proline' 0 C--N 1.31 -1.473 0 C-N-CA 122.689 2.259 . . . . 0.0 112.146 178.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . 0.531 ' N ' ' O ' ' A' ' 96' ' ' ASN . 6.0 pt20 . . . . . 0 C--N 1.323 -0.57 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.896 -179.861 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 24.1 p . . . . . 0 C--O 1.231 0.1 0 CA-C-O 120.84 0.352 . . . . 0.0 110.623 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 85.4 mt-10 -56.99 142.52 41.62 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.385 -179.587 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 108' ' ' GLU . . . . . 0.601 ' C ' ' H ' ' A' ' 110' ' ' LEU . 92.2 mt-10 -65.4 136.25 56.26 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.768 -0.373 . . . . 0.0 110.201 179.626 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 45.3 pt -61.14 4.14 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.364 179.622 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . 0.601 ' H ' ' C ' ' A' ' 108' ' ' GLU . 96.4 mt -101.73 -5.98 24.26 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.892 0.377 . . . . 0.0 110.538 -179.735 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 63.2 tttm -102.37 128.77 48.81 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.683 -179.969 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 112' ' ' SER . . . . . 0.532 ' OG ' ' N ' ' A' ' 113' ' ' ASN . 3.1 p -87.57 -147.13 0.14 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.463 -179.875 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 113' ' ' ASN . . . . . 0.532 ' N ' ' OG ' ' A' ' 112' ' ' SER . 90.5 m-20 -62.09 -42.32 99.09 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.385 -179.442 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 92.9 p -153.86 -5.74 0.17 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.582 179.941 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 115' ' ' GLN . . . . . 0.437 ' H ' ' HG ' ' A' ' 112' ' ' SER . 94.9 mm-40 -70.82 150.3 45.96 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.422 -179.695 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 73.1 p -72.8 169.73 16.14 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.405 -179.873 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 88.8 m-20 . . . . . 0 C--N 1.33 -0.258 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.47 -179.69 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.752 0 N-CA-C 110.984 -0.846 . . . . 0.0 110.984 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 88.1 mt-30 -64.24 -38.97 92.95 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.779 0.323 . . . . 0.0 110.733 179.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . 0.412 ' O ' ' N ' ' A' ' 7' ' ' GLN . 90.4 mt-10 -47.96 -22.95 0.66 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.509 -179.969 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 51.8 tp -41.97 -34.57 0.71 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.26 -179.55 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 42.6 m -55.09 -42.05 72.34 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.077 0.465 . . . . 0.0 110.327 -179.899 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . 0.412 ' N ' ' O ' ' A' ' 4' ' ' GLU . 95.2 mt-30 -61.1 -30.8 70.57 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.883 -0.598 . . . . 0.0 110.689 179.614 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 59.4 t-80 -62.1 -41.72 98.5 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.023 0.439 . . . . 0.0 110.117 179.72 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 80.1 mm-40 -60.27 -46.65 89.07 Favored 'General case' 0 C--O 1.245 0.819 0 CA-C-O 121.562 0.696 . . . . 0.0 110.026 179.937 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.41 ' O ' ' CB ' ' A' ' 14' ' ' GLN . 24.5 mtm180 -63.48 -29.02 70.37 Favored 'General case' 0 C--O 1.217 -0.608 0 C-N-CA 120.241 -0.583 . . . . 0.0 109.799 179.506 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 37.8 t80 -62.86 -36.71 84.16 Favored 'General case' 0 C--N 1.328 -0.327 0 O-C-N 123.562 0.539 . . . . 0.0 109.888 179.902 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 3.7 t -62.66 -48.32 88.71 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 C-N-CA 119.837 -0.745 . . . . 0.0 110.834 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 79.8 mm-40 -80.87 -38.9 27.31 Favored 'General case' 0 C--N 1.322 -0.595 0 C-N-CA 119.935 -0.706 . . . . 0.0 111.767 -179.173 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . 0.41 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 63.9 tp60 -65.38 -53.05 48.92 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.538 -0.755 . . . . 0.0 110.865 -179.171 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -63.12 -45.86 90.02 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.453 -0.499 . . . . 0.0 109.917 -179.126 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 53.8 mttp -54.82 -32.5 60.48 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 120.204 -0.599 . . . . 0.0 110.503 179.79 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 59.9 tt0 -67.16 -41.32 86.19 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.556 179.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -57.58 -30.35 65.2 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.617 -0.72 . . . . 0.0 109.763 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.2 mt -86.44 -28.82 23.28 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.253 0.549 . . . . 0.0 110.651 178.848 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -51.12 -43.02 61.06 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.779 -178.784 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.73 -28.87 69.89 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.55 179.762 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 82.8 mmt-85 -71.01 -6.34 38.21 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.353 -179.831 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 108.04 20.12 8.57 Favored Glycine 0 CA--C 1.524 0.65 0 N-CA-C 111.16 -0.776 . . . . 0.0 111.16 179.93 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.4 ' CG1' ' H ' ' A' ' 25' ' ' LYS . 18.3 t -102.29 169.38 1.88 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 N-CA-C 110.345 -0.243 . . . . 0.0 110.345 179.857 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.4 ' H ' ' CG1' ' A' ' 24' ' ' VAL . 99.4 mttt -115.43 146.69 41.38 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.368 179.803 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 2.3 m -115.31 23.4 5.34 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.272 0 CA-C-O 120.996 0.427 . . . . 0.0 110.662 -179.584 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.517 ' N ' ' OD2' ' A' ' 30' ' ' ASP . 33.5 pttt -51.97 163.58 0.34 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.219 -179.712 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 75.8 m-85 -58.15 -35.83 72.12 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.819 -0.352 . . . . 0.0 110.654 -179.727 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -53.84 -23.8 13.6 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.691 -179.953 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.517 ' OD2' ' N ' ' A' ' 27' ' ' LYS . 59.3 m-20 -63.5 -46.68 84.97 Favored 'General case' 0 C--O 1.223 -0.335 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.685 -179.509 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.482 ' O ' ' CB ' ' A' ' 35' ' ' PHE . 5.4 mp -67.28 -41.09 86.03 Favored 'General case' 0 C--O 1.221 -0.446 0 CA-C-O 121.251 0.548 . . . . 0.0 110.487 179.575 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 55.7 mt -56.73 -44.84 82.06 Favored 'General case' 0 C--N 1.314 -0.948 0 C-N-CA 119.546 -0.862 . . . . 0.0 111.057 -178.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 86.5 tttt -86.09 -49.38 7.82 Favored 'General case' 0 C--N 1.32 -0.714 0 C-N-CA 120.475 -0.49 . . . . 0.0 111.421 -178.922 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 58.0 t80 -61.93 -49.88 74.36 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.237 -178.687 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.482 ' CB ' ' O ' ' A' ' 31' ' ' LEU . 7.9 t80 -62.96 -46.9 85.57 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.189 -179.827 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 94.4 m-20 -65.31 -34.32 78.07 Favored 'General case' 0 C--N 1.347 0.477 0 CA-C-O 120.721 0.296 . . . . 0.0 111.167 -179.432 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.458 ' CE2' ' CD2' ' A' ' 63' ' ' PHE . 1.9 m-85 -60.53 -47.85 84.35 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.919 0.39 . . . . 0.0 111.111 -179.053 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . 0.535 ' O ' ' N ' ' A' ' 42' ' ' CYS . 27.8 m -77.82 -40.2 26.98 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.592 -179.704 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -56.59 -26.93 56.78 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.635 -179.847 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 93.2 m-20 -54.4 -62.38 1.69 Allowed 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 120.748 -0.381 . . . . 0.0 111.292 -179.043 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' THR . . . . . 0.494 ' O ' ' SG ' ' A' ' 42' ' ' CYS . 45.8 p -114.0 5.53 16.14 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.101 -179.506 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . 0.535 ' N ' ' O ' ' A' ' 38' ' ' VAL . 28.1 p 37.5 57.97 4.28 Favored Pre-proline 0 N--CA 1.465 0.288 0 CA-C-O 120.772 0.32 . . . . 0.0 110.341 -179.235 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 69.3 Cg_endo -75.79 -11.92 20.04 Favored 'Trans proline' 0 C--N 1.312 -1.343 0 C-N-CA 122.779 2.32 . . . . 0.0 112.339 -179.312 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . 0.404 ' O ' ' C ' ' A' ' 45' ' ' PHE . 0.0 OUTLIER -82.5 12.48 4.51 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.024 -179.569 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 0.454 ' CE1' ' OE1' ' A' ' 47' ' ' GLN . 21.3 t80 39.85 54.59 5.99 Favored Pre-proline 0 C--N 1.331 -0.206 0 CA-C-O 120.864 0.364 . . . . 0.0 110.227 179.882 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.438 ' CD ' ' N ' ' A' ' 45' ' ' PHE . 19.1 Cg_endo -58.88 -2.62 1.18 Allowed 'Trans proline' 0 C--N 1.308 -1.598 0 C-N-CA 122.898 2.399 . . . . 0.0 112.256 -179.522 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.454 ' OE1' ' CE1' ' A' ' 45' ' ' PHE . 88.2 mt-30 -60.73 -52.62 64.33 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.238 179.933 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 76.9 tt0 -89.09 -21.92 23.15 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-O 121.053 0.454 . . . . 0.0 110.397 179.104 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 78.89 63.24 2.11 Favored Glycine 0 CA--C 1.523 0.554 0 N-CA-C 110.534 -1.026 . . . . 0.0 110.534 -179.486 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' THR . . . . . 0.427 ' OG1' ' NE2' ' A' ' 98' ' ' GLN . 11.2 t -137.19 160.8 37.96 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.836 0.351 . . . . 0.0 110.748 -179.411 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.3 mt -83.53 133.53 28.95 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.425 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.521 179.603 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -116.95 120.83 39.64 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.373 -0.83 . . . . 0.0 110.345 179.298 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 20.3 mm -91.43 -48.13 13.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.922 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -63.17 -44.98 93.91 Favored 'General case' 0 C--O 1.238 0.46 0 CA-C-O 121.255 0.55 . . . . 0.0 110.66 -179.399 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 85.0 mtt85 -64.14 -34.36 77.89 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.115 -0.493 . . . . 0.0 109.903 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 29.4 t-105 -59.39 -39.13 82.38 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-O 121.125 0.488 . . . . 0.0 110.4 -179.466 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 83.7 mtp180 -64.12 -39.08 93.26 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.347 179.949 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . 0.442 ' O ' ' OD2' ' A' ' 61' ' ' ASP . 83.9 mtt85 -60.88 -52.06 66.64 Favored 'General case' 0 C--N 1.331 -0.228 0 C-N-CA 120.715 -0.394 . . . . 0.0 111.209 -179.972 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 5.9 p -69.01 -31.05 48.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.13 179.179 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -67.71 -44.58 80.61 Favored Glycine 0 CA--C 1.526 0.74 0 N-CA-C 111.344 -0.703 . . . . 0.0 111.344 -179.819 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . 0.442 ' OD2' ' O ' ' A' ' 58' ' ' ARG . 0.5 OUTLIER -65.87 -38.01 87.66 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.779 0.323 . . . . 0.0 110.609 -179.42 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 76.1 m -64.98 -49.57 69.78 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.04 0.448 . . . . 0.0 110.678 -179.45 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . 0.458 ' CD2' ' CE2' ' A' ' 37' ' ' PHE . 12.0 m-85 -67.29 -28.94 68.43 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.282 179.626 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 56.9 tt0 -61.48 -45.42 94.32 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 120.658 -0.417 . . . . 0.0 110.967 -179.872 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 24.4 t0 -62.97 -51.83 65.37 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.005 0.431 . . . . 0.0 110.595 179.699 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' TYR . . . . . 0.481 ' O ' ' OG1' ' A' ' 69' ' ' THR . 54.1 m-85 -62.34 -32.81 73.64 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.037 -0.528 . . . . 0.0 110.234 179.819 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . 0.416 ' OH ' ' CD ' ' A' ' 76' ' ' PRO . 58.2 t80 -61.83 -40.2 94.46 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.312 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 88.6 m-20 -63.96 -39.92 95.23 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.343 -179.626 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.481 ' OG1' ' O ' ' A' ' 66' ' ' TYR . 61.4 p -49.3 -34.3 15.17 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.693 -179.31 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 69.1 m-85 -65.58 -47.0 77.25 Favored 'General case' 0 C--N 1.322 -0.609 0 C-N-CA 120.075 -0.65 . . . . 0.0 111.134 -179.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 110.91 71.48 0.64 Allowed Glycine 0 N--CA 1.472 1.036 0 N-CA-C 110.853 -0.899 . . . . 0.0 110.853 -179.545 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_exo -62.78 142.06 87.46 Favored 'Trans proline' 0 C--N 1.305 -1.74 0 C-N-CA 123.241 2.628 . . . . 0.0 111.891 -179.861 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 97.6 mt-10 -83.2 -46.29 12.88 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-O 121.047 0.451 . . . . 0.0 110.206 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.426 ' CD ' ' N ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -137.14 3.87 2.66 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.573 -0.739 . . . . 0.0 111.861 -179.72 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 54.1 t 57.1 100.11 0.04 OUTLIER Pre-proline 0 C--N 1.325 -0.486 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.485 -178.248 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . 0.416 ' CD ' ' OH ' ' A' ' 67' ' ' TYR . 48.6 Cg_exo -53.38 126.8 22.84 Favored 'Trans proline' 0 N--CA 1.494 1.556 0 C-N-CA 122.032 1.821 . . . . 0.0 112.176 -179.647 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . 0.477 ' O ' ' N ' ' A' ' 79' ' ' ALA . 45.3 t -84.01 -20.81 8.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.875 179.497 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' THR . . . . . 0.441 ' O ' ' OG ' ' A' ' 81' ' ' SER . 71.5 p -40.75 -24.99 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.464 -179.262 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . 0.477 ' N ' ' O ' ' A' ' 77' ' ' VAL . . . -65.5 -41.83 92.79 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.144 0.497 . . . . 0.0 110.868 179.597 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . 0.454 ' N ' ' O ' ' A' ' 77' ' ' VAL . 2.4 m-85 -62.77 -39.37 93.96 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.644 179.853 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' SER . . . . . 0.441 ' OG ' ' O ' ' A' ' 78' ' ' THR . 73.4 p -54.17 -42.39 69.58 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.355 -179.725 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 9.5 m-85 -61.05 -54.24 47.22 Favored 'General case' 0 CA--C 1.52 -0.208 0 C-N-CA 120.847 -0.341 . . . . 0.0 110.659 179.832 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' TRP . . . . . . . . . . . . . 37.7 t90 -56.78 -36.7 70.15 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.543 179.724 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 92.6 m-20 -62.86 -48.54 78.56 Favored 'General case' 0 C--O 1.235 0.327 0 C-N-CA 120.775 -0.37 . . . . 0.0 111.155 -179.409 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 33.1 tp -70.41 -51.53 28.86 Favored 'General case' 0 N--CA 1.447 -0.62 0 C-N-CA 120.532 -0.467 . . . . 0.0 110.376 179.676 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -58.22 -27.35 32.1 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 C-N-CA 120.511 -0.475 . . . . 0.0 110.513 -179.766 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 64.5 tttt -65.11 -48.9 72.0 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.666 -178.898 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.2 pp20? -80.48 -21.33 42.11 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.739 -179.876 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.11 -43.09 99.59 Favored 'General case' 0 N--CA 1.447 -0.625 0 C-N-CA 120.046 -0.662 . . . . 0.0 110.113 -178.68 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 2.2 mt -63.33 -43.12 98.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 C-N-CA 119.949 -0.7 . . . . 0.0 110.052 -179.618 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 -55.57 -17.1 4.81 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.764 -178.478 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 75.3 tttt -61.52 134.28 56.68 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.315 179.635 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -62.37 -41.22 98.46 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.683 -179.806 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . 0.448 ' O ' ' C ' ' A' ' 95' ' ' VAL . 81.0 mm-40 -74.85 -2.22 25.78 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.971 -179.603 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.448 ' C ' ' O ' ' A' ' 94' ' ' GLU . 1.9 m 30.55 -106.71 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.29 0 O-C-N 123.831 0.707 . . . . 0.0 110.442 179.939 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' ASN . . . . . 0.442 ' C ' ' H ' ' A' ' 98' ' ' GLN . 0.8 OUTLIER -152.63 164.43 20.33 Favored Pre-proline 0 C--N 1.322 -0.596 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.658 179.047 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -46.07 -13.28 0.09 OUTLIER 'Trans proline' 0 N--CA 1.494 1.52 0 C-N-CA 122.797 2.332 . . . . 0.0 112.464 179.079 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . 0.442 ' H ' ' C ' ' A' ' 96' ' ' ASN . 3.5 pt20 . . . . . 0 C--N 1.323 -0.571 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.856 179.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 19.4 m . . . . . 0 C--O 1.23 0.079 0 CA-C-O 120.489 0.185 . . . . 0.0 110.691 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 93.8 mt-10 -125.18 163.28 22.8 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.485 -179.709 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 108' ' ' GLU . . . . . 0.536 ' N ' ' OE1' ' A' ' 108' ' ' GLU . 54.5 mp0 -90.41 120.19 31.32 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.061 -0.518 . . . . 0.0 109.937 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 42.4 pt -43.1 -19.15 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.491 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . 0.514 ' N ' ' O ' ' A' ' 108' ' ' GLU . 35.1 mt -63.61 -42.04 98.25 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.429 -179.821 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 66.4 tttm -67.57 -38.34 83.92 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.449 179.895 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 51.2 m -59.47 -47.29 86.05 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.79 -179.211 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 90.1 m-20 -65.82 -42.51 90.54 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.633 179.823 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 23.1 t -158.23 139.12 13.04 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.526 179.78 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 75.2 mt-30 -89.44 20.72 3.72 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.805 179.824 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 41.3 p -63.37 -32.51 73.96 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.44 179.873 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 65.6 t0 . . . . . 0 C--N 1.328 -0.363 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.677 179.832 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.71 0 N-CA-C 110.887 -0.885 . . . . 0.0 110.887 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 99.2 mm-40 -61.81 -39.79 92.99 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.825 0.345 . . . . 0.0 110.573 179.803 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . 0.43 ' O ' ' N ' ' A' ' 7' ' ' GLN . 96.4 mt-10 -55.52 -22.4 21.15 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.517 179.765 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 51.2 tp -42.31 -34.14 0.74 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.564 -179.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 56.2 m -54.21 -37.48 64.6 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.568 179.362 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . 0.43 ' N ' ' O ' ' A' ' 4' ' ' GLU . 97.8 mm-40 -62.49 -37.3 85.48 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.588 179.741 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 59.1 t-80 -56.03 -43.93 78.28 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.585 179.689 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 81.9 tt0 -59.85 -53.16 61.18 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.563 179.114 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.479 ' O ' ' N ' ' A' ' 14' ' ' GLN . 86.8 mtt180 -60.61 -31.65 70.82 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.597 179.085 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.483 ' O ' ' HB2' ' A' ' 15' ' ' LEU . 51.1 t80 -60.66 -36.47 78.77 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.563 -179.601 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 3.0 t -63.24 -48.66 86.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.604 -179.198 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -83.49 -41.97 17.41 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.629 -179.571 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . 0.479 ' N ' ' O ' ' A' ' 10' ' ' ARG . 67.6 tp60 -61.39 -52.87 62.83 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.602 -179.119 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.483 ' HB2' ' O ' ' A' ' 11' ' ' TYR . 0.3 OUTLIER -61.25 -47.43 86.08 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.575 -179.976 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 87.0 mttt -56.29 -35.28 67.32 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.59 179.487 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 80.0 mt-30 -72.94 -36.08 67.13 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.622 178.636 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -57.22 -32.59 66.68 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.58 179.512 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.654 ' CD2' ' HG ' ' A' ' 81' ' ' SER . 3.1 mt -85.59 -33.34 21.71 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.576 177.997 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -46.97 -42.37 17.79 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.529 -179.541 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' THR . . . . . 0.543 ' C ' ' H ' ' A' ' 23' ' ' GLY . 0.2 OUTLIER -71.43 -25.75 62.45 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.581 -179.578 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 82.6 mmt-85 -72.88 19.52 0.09 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.562 179.674 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . 0.543 ' H ' ' C ' ' A' ' 21' ' ' THR . . . 86.31 18.26 59.3 Favored Glycine 0 CA--C 1.524 0.627 0 N-CA-C 110.934 -0.866 . . . . 0.0 110.934 -179.604 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.428 ' CG1' ' N ' ' A' ' 25' ' ' LYS . 22.8 t -105.39 168.85 2.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 120.787 0.327 . . . . 0.0 110.622 -179.927 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.428 ' N ' ' CG1' ' A' ' 24' ' ' VAL . 63.1 mttp -131.01 136.43 48.5 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.524 179.305 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 4.8 m -134.37 108.3 10.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.545 -179.459 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.546 ' O ' ' N ' ' A' ' 30' ' ' ASP . 13.0 ttmt -107.4 158.78 16.9 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.541 178.867 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . 0.458 ' H ' ' HG2' ' A' ' 27' ' ' LYS . 97.9 m-85 -39.01 -34.22 0.15 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.534 179.39 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -60.19 -25.48 65.61 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.575 -179.706 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.546 ' N ' ' O ' ' A' ' 27' ' ' LYS . 1.0 OUTLIER -60.06 -46.3 90.01 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.614 -179.028 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.521 ' O ' ' CB ' ' A' ' 35' ' ' PHE . 5.8 mp -63.68 -42.68 97.99 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.493 -179.959 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 36.8 mt -58.49 -46.11 87.34 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.588 -178.465 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.535 ' NZ ' ' CZ ' ' A' ' 37' ' ' PHE . 65.3 tttm -87.53 -49.22 7.33 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.52 -177.038 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . 0.487 ' CB ' ' O ' ' A' ' 30' ' ' ASP . 43.0 t80 -60.9 -50.25 74.16 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.53 -178.182 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.521 ' CB ' ' O ' ' A' ' 31' ' ' LEU . 7.1 t80 -61.84 -46.09 90.98 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.614 -178.938 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 86.1 m-20 -65.39 -35.2 80.23 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.574 -179.248 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.544 ' CE2' ' CD2' ' A' ' 63' ' ' PHE . 1.9 m-85 -60.89 -46.74 89.44 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.569 -179.191 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . 0.622 ' O ' ' N ' ' A' ' 42' ' ' CYS . 25.8 m -76.52 -37.46 30.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.532 -178.825 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -62.56 -29.67 70.75 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.584 -179.633 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 81.3 m-20 -59.14 -44.84 92.09 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.557 -178.588 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' THR . . . . . 0.524 ' C ' ' SG ' ' A' ' 42' ' ' CYS . 41.6 p -115.06 -3.25 12.63 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.58 -178.849 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . 0.622 ' N ' ' O ' ' A' ' 38' ' ' VAL . 1.8 p 36.19 60.48 3.15 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.572 -179.608 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -77.7 -40.22 0.43 Allowed 'Trans proline' 0 C--N 1.305 -1.717 0 C-N-CA 122.796 2.331 . . . . 0.0 112.115 -179.334 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . 0.78 ' HE1' ' H ' ' A' ' 52' ' ' ASP . 0.0 OUTLIER -73.43 3.44 6.02 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.552 -179.633 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 0.558 ' O ' ' N ' ' A' ' 47' ' ' GLN . 64.0 m-85 54.91 50.49 6.34 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.577 -179.527 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.528 ' CD ' ' N ' ' A' ' 45' ' ' PHE . 52.9 Cg_exo -40.1 -16.77 0.04 OUTLIER 'Trans proline' 0 C--N 1.305 -1.747 0 C-N-CA 122.835 2.357 . . . . 0.0 112.165 179.116 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.558 ' N ' ' O ' ' A' ' 45' ' ' PHE . 71.9 tp60 -63.84 -48.5 76.52 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.542 -179.532 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 51.6 tp10 -89.41 -45.22 9.62 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.636 179.867 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . 0.486 ' O ' ' NE2' ' A' ' 98' ' ' GLN . . . 96.61 68.45 0.98 Allowed Glycine 0 CA--C 1.524 0.616 0 N-CA-C 110.956 -0.857 . . . . 0.0 110.956 -179.306 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 7.0 t -130.03 170.2 14.3 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.842 0.353 . . . . 0.0 110.556 -179.333 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.3 mt -103.75 132.14 50.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.665 178.814 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . 0.78 ' H ' ' HE1' ' A' ' 44' ' ' TRP . 96.3 m-20 -118.51 121.42 40.23 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.549 179.04 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 22.0 mm -91.51 -53.86 8.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.584 -179.167 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 88.9 tttt -64.17 -48.27 76.61 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.564 -179.78 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 22.9 ttm-85 -61.53 -40.67 95.49 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.627 -179.611 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' TRP . . . . . 0.598 ' CE3' ' CH2' ' A' ' 44' ' ' TRP . 36.0 t-105 -51.74 -37.28 50.47 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.577 179.706 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -66.61 -38.92 87.97 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.596 -179.959 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 94.2 mtt-85 -61.53 -52.5 64.21 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.586 -179.857 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 2.8 p -63.34 -43.62 98.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.628 179.879 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -64.53 -33.46 87.29 Favored Glycine 0 CA--C 1.525 0.697 0 N-CA-C 110.938 -0.865 . . . . 0.0 110.938 -179.709 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 10.9 m-20 -66.1 -37.01 84.7 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.788 0.327 . . . . 0.0 110.615 -179.701 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 84.0 m -63.45 -53.67 48.48 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.572 -179.82 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . 0.544 ' CD2' ' CE2' ' A' ' 37' ' ' PHE . 56.2 m-85 -67.66 -30.37 69.9 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.572 -179.608 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 60.0 tt0 -60.72 -42.26 96.92 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.579 179.382 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 29.5 t0 -63.18 -53.8 47.53 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.525 179.581 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' TYR . . . . . 0.504 ' O ' ' OG1' ' A' ' 69' ' ' THR . 60.6 m-85 -63.17 -35.55 80.68 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.518 179.615 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 62.5 t80 -57.9 -38.36 75.7 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.61 179.788 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 98.8 m-20 -66.66 -38.82 87.63 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.553 -179.896 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.504 ' OG1' ' O ' ' A' ' 66' ' ' TYR . 58.1 p -61.38 -29.74 70.1 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.618 -179.337 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -65.81 -40.94 92.33 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.572 -179.718 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . 0.423 ' H ' ' HD3' ' A' ' 72' ' ' PRO . . . 104.38 71.75 0.85 Allowed Glycine 0 CA--C 1.525 0.705 0 N-CA-C 110.937 -0.865 . . . . 0.0 110.937 179.665 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . 0.423 ' HD3' ' H ' ' A' ' 71' ' ' GLY . 19.3 Cg_exo -65.37 144.49 80.34 Favored 'Trans proline' 0 C--N 1.305 -1.721 0 C-N-CA 122.788 2.325 . . . . 0.0 112.173 179.326 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -76.29 -50.32 14.66 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.572 -179.806 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.469 ' CD ' ' N ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -138.88 6.08 2.4 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.56 -179.495 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 52.0 t 56.06 94.32 0.05 OUTLIER Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.612 -179.775 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -52.38 124.22 14.53 Favored 'Trans proline' 0 C--N 1.304 -1.767 0 C-N-CA 122.796 2.331 . . . . 0.0 112.143 -179.755 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . 0.412 ' O ' ' N ' ' A' ' 80' ' ' PHE . 41.7 t -84.18 -15.43 11.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.565 -179.467 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 69.0 p -42.17 -27.18 0.12 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.546 179.927 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.87 -41.67 98.14 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.596 179.613 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . 0.412 ' N ' ' O ' ' A' ' 77' ' ' VAL . 2.3 m-85 -66.4 -33.28 75.35 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.547 -179.984 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' SER . . . . . 0.654 ' HG ' ' CD2' ' A' ' 19' ' ' LEU . 41.8 t -60.56 -42.52 96.78 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.568 179.802 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 7.6 m-85 -59.92 -52.23 66.3 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.553 179.445 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' TRP . . . . . 0.4 ' O ' ' CB ' ' A' ' 87' ' ' LYS . 41.1 t90 -59.03 -36.49 75.08 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.612 179.855 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 78.2 m-20 -62.02 -46.99 86.74 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.576 -179.559 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 30.9 tp -70.64 -56.96 5.27 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.609 179.506 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -54.93 -24.97 15.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.563 179.547 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . 0.4 ' CB ' ' O ' ' A' ' 83' ' ' TRP . 55.0 tttt -68.89 -47.6 65.46 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.581 -179.825 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . 0.463 ' O ' ' OE1' ' A' ' 88' ' ' GLU . 1.3 pp20? -82.71 -18.71 39.88 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.569 -179.802 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.99 -46.15 90.51 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.526 179.504 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 2.7 mt -62.73 -40.68 89.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.606 179.561 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 51.3 t0 -50.72 -42.56 57.41 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.59 -179.943 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 97.2 mttt -68.03 143.63 55.46 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.604 179.888 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -75.5 9.02 2.4 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.622 -179.818 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 40.4 tp10 -59.34 -33.72 71.48 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.499 179.859 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 8.3 m -67.18 133.26 31.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.501 179.826 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' ASN . . . . . 0.541 ' O ' ' N ' ' A' ' 98' ' ' GLN . 1.1 m-20 -85.54 162.82 46.84 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.588 -179.624 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_exo -42.64 -13.45 0.04 OUTLIER 'Trans proline' 0 C--N 1.305 -1.763 0 C-N-CA 122.896 2.397 . . . . 0.0 112.101 179.271 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . 0.541 ' N ' ' O ' ' A' ' 96' ' ' ASN . 5.0 pt20 . . . . . 0 C--N 1.33 -0.263 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.573 -179.81 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 82.0 p . . . . . 0 C--O 1.232 0.156 0 CA-C-O 120.783 0.325 . . . . 0.0 110.619 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 92.2 mt-10 54.26 -164.18 0.11 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.508 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 108' ' ' GLU . . . . . 0.598 ' C ' ' H ' ' A' ' 110' ' ' LEU . 72.7 mm-40 -90.04 125.85 35.55 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.589 179.22 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 44.0 pt -58.86 2.26 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.577 -179.976 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . 0.598 ' H ' ' C ' ' A' ' 108' ' ' GLU . 91.6 mt -95.18 -5.65 43.47 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.628 179.871 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 86.5 tttt -121.48 127.13 50.74 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.594 179.948 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 112' ' ' SER . . . . . 0.469 ' HG ' ' H ' ' A' ' 113' ' ' ASN . 95.4 p -148.52 -113.02 0.07 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.563 -179.962 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 113' ' ' ASN . . . . . 0.469 ' H ' ' HG ' ' A' ' 112' ' ' SER . 77.4 m-20 -62.17 -34.79 77.09 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.618 179.617 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 62.4 p -153.07 160.2 42.92 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.53 179.735 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 86.4 mt-30 -90.15 129.65 36.4 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.581 179.993 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 116' ' ' THR . . . . . 0.406 ' OG1' ' N ' ' A' ' 117' ' ' ASP . 67.5 p -108.68 -74.46 0.66 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.602 179.874 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 117' ' ' ASP . . . . . 0.406 ' N ' ' OG1' ' A' ' 116' ' ' THR . 92.5 m-20 . . . . . 0 C--N 1.329 -0.317 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.616 179.827 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.717 0 N-CA-C 110.95 -0.86 . . . . 0.0 110.95 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 99.4 mm-40 -62.61 -36.9 84.23 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.955 0.407 . . . . 0.0 110.369 -179.987 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 93.7 mt-10 -51.21 -21.75 2.24 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.483 179.846 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 41.5 tp -42.98 -34.86 1.06 Allowed 'General case' 0 C--O 1.236 0.348 0 CA-C-O 120.998 0.427 . . . . 0.0 110.429 -179.625 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' SER . . . . . 0.569 ' CB ' HH12 ' A' ' 10' ' ' ARG . 50.2 m -54.15 -35.18 61.96 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 120.493 -0.483 . . . . 0.0 109.958 179.789 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 71.3 tp60 -64.71 -33.24 75.5 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.96 -0.563 . . . . 0.0 110.44 179.504 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 86.3 t60 -59.16 -45.11 91.84 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-O 120.95 0.405 . . . . 0.0 110.069 -179.947 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -60.51 -43.38 97.13 Favored 'General case' 0 C--O 1.241 0.649 0 CA-C-N 116.034 -0.53 . . . . 0.0 109.874 179.478 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.569 HH12 ' CB ' ' A' ' 6' ' ' SER . 80.2 mtt85 -66.22 -37.31 85.24 Favored 'General case' 0 C--O 1.21 -0.974 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 179.61 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -53.28 -38.76 63.38 Favored 'General case' 0 C--N 1.319 -0.753 0 C-N-CA 120.445 -0.502 . . . . 0.0 110.172 -179.967 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 2.3 t -65.67 -52.93 44.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 C-N-CA 119.932 -0.707 . . . . 0.0 111.497 -179.868 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 77.0 tt0 -80.49 -48.64 12.5 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 120.403 -0.519 . . . . 0.0 112.004 -178.73 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . 0.501 ' N ' ' O ' ' A' ' 10' ' ' ARG . 60.9 tp60 -53.64 -53.0 58.12 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.909 -178.848 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -63.26 -49.29 74.7 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.35 -0.54 . . . . 0.0 110.121 -179.589 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 62.8 mttm -53.25 -33.81 54.55 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 120.499 -0.48 . . . . 0.0 110.268 179.319 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 89.3 mm-40 -75.42 -35.66 60.94 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.566 179.183 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -57.06 -34.44 68.25 Favored 'General case' 0 C--O 1.223 -0.296 0 CA-C-N 116.044 -0.526 . . . . 0.0 109.956 -179.931 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.9 mt -85.42 -33.48 21.93 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.096 0.474 . . . . 0.0 110.564 179.243 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -47.46 -43.28 24.05 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.541 -179.129 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' THR . . . . . 0.535 ' C ' ' H ' ' A' ' 23' ' ' GLY . 0.1 OUTLIER -72.02 -24.07 61.5 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.555 -179.908 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 71.8 mmt-85 -74.69 24.08 0.09 Allowed 'General case' 0 C--O 1.233 0.187 0 CA-C-O 120.945 0.402 . . . . 0.0 110.435 179.906 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . 0.535 ' H ' ' C ' ' A' ' 21' ' ' THR . . . 82.49 17.96 67.43 Favored Glycine 0 CA--C 1.526 0.724 0 N-CA-C 110.89 -0.884 . . . . 0.0 110.89 179.876 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 21.9 t -105.42 167.12 3.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 N-CA-C 110.294 -0.261 . . . . 0.0 110.294 -179.901 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 69.9 mmtt -129.43 132.26 46.94 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.26 179.518 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . 0.439 ' O ' ' CG2' ' A' ' 26' ' ' VAL . 30.8 m -127.83 105.22 13.26 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.252 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.239 -179.956 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.423 ' N ' ' OD1' ' A' ' 30' ' ' ASP . 8.3 pttm -104.89 163.39 12.56 Favored 'General case' 0 C--O 1.218 -0.579 0 N-CA-C 109.806 -0.442 . . . . 0.0 109.806 179.812 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 84.2 m-85 -42.86 -34.89 1.03 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.961 0.41 . . . . 0.0 110.782 179.981 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -56.85 -23.27 42.91 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.819 179.839 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.423 ' OD1' ' N ' ' A' ' 27' ' ' LYS . 1.1 m-20 -61.91 -46.97 87.04 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.613 -179.159 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.5 ' O ' ' CB ' ' A' ' 35' ' ' PHE . 5.8 mp -67.24 -41.56 85.42 Favored 'General case' 0 C--O 1.215 -0.73 0 CA-C-O 120.943 0.401 . . . . 0.0 110.393 179.738 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 42.3 mt -57.27 -45.86 83.64 Favored 'General case' 0 C--N 1.314 -0.973 0 C-N-CA 119.419 -0.913 . . . . 0.0 111.03 -178.359 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -84.32 -50.17 8.07 Favored 'General case' 0 C--N 1.32 -0.696 0 C-N-CA 120.472 -0.491 . . . . 0.0 111.909 -179.089 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . 0.414 ' CB ' ' O ' ' A' ' 30' ' ' ASP . 42.0 t80 -62.47 -49.56 74.92 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.461 -178.531 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.5 ' CB ' ' O ' ' A' ' 31' ' ' LEU . 22.4 t80 -61.22 -44.56 97.08 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.103 -179.567 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -69.37 -40.56 77.39 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 120.275 -0.57 . . . . 0.0 111.663 179.975 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.573 ' CE2' ' CE1' ' A' ' 63' ' ' PHE . 3.0 m-85 -62.08 -48.66 79.22 Favored 'General case' 0 CA--C 1.518 -0.278 0 CA-C-O 120.858 0.361 . . . . 0.0 111.887 -178.281 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . 0.554 ' O ' ' N ' ' A' ' 42' ' ' CYS . 17.1 m -70.03 -41.62 79.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.467 -179.745 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -63.04 -31.7 72.89 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.506 -0.316 . . . . 0.0 110.95 -179.732 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 98.8 m-20 -56.66 -49.71 74.24 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 120.906 -0.317 . . . . 0.0 111.113 -179.169 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' THR . . . . . 0.495 ' O ' ' SG ' ' A' ' 42' ' ' CYS . 15.4 p -106.64 -7.61 17.29 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.545 -0.298 . . . . 0.0 110.954 -179.741 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . 0.554 ' N ' ' O ' ' A' ' 38' ' ' VAL . 28.6 p 38.04 57.52 4.8 Favored Pre-proline 0 N--CA 1.463 0.186 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.303 -179.234 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -75.95 -31.42 5.06 Favored 'Trans proline' 0 C--N 1.314 -1.257 0 C-N-CA 122.551 2.167 . . . . 0.0 112.582 -179.4 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . 0.631 ' CH2' ' CE3' ' A' ' 56' ' ' TRP . 0.0 OUTLIER -77.76 13.75 1.25 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.89 -179.646 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 0.532 ' CD2' ' OD2' ' A' ' 52' ' ' ASP . 6.1 m-85 39.56 53.58 5.06 Favored Pre-proline 0 C--O 1.232 0.142 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.076 -179.874 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.444 ' CD ' ' N ' ' A' ' 45' ' ' PHE . 11.1 Cg_endo -53.38 -5.7 0.28 Allowed 'Trans proline' 0 C--N 1.31 -1.488 0 C-N-CA 122.714 2.276 . . . . 0.0 112.004 -179.688 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.497 ' H ' ' C ' ' A' ' 45' ' ' PHE . 64.1 tp60 -64.17 -48.79 74.6 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.333 -179.448 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -89.42 -30.24 18.47 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-O 120.908 0.385 . . . . 0.0 110.531 179.155 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 87.65 75.19 1.28 Allowed Glycine 0 CA--C 1.523 0.573 0 N-CA-C 110.844 -0.902 . . . . 0.0 110.844 -179.445 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 13.6 t -144.11 165.22 28.43 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.623 0.249 . . . . 0.0 110.653 -179.792 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.1 mt -98.96 133.85 40.05 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.265 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 179.283 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . 0.568 ' H ' ' HE1' ' A' ' 44' ' ' TRP . 73.7 m-20 -117.91 121.17 40.0 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.276 179.083 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 18.5 mm -87.32 -46.49 16.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.825 179.998 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -66.22 -45.84 79.29 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-O 121.108 0.48 . . . . 0.0 111.283 -179.775 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 77.3 mmt-85 -63.72 -33.97 76.84 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.908 -0.587 . . . . 0.0 109.909 -179.507 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' TRP . . . . . 0.631 ' CE3' ' CH2' ' A' ' 44' ' ' TRP . 50.3 t-105 -59.29 -36.79 76.21 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-O 121.3 0.572 . . . . 0.0 110.049 179.994 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 44.0 ttm180 -65.21 -41.33 94.58 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.308 179.55 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 95.2 mtt-85 -61.75 -53.07 61.01 Favored 'General case' 0 N--CA 1.466 0.334 0 C-N-CA 120.793 -0.363 . . . . 0.0 111.562 -179.491 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 4.8 p -63.16 -45.93 97.26 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.391 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.198 179.632 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -63.04 -36.72 93.85 Favored Glycine 0 CA--C 1.524 0.615 0 N-CA-C 111.05 -0.82 . . . . 0.0 111.05 179.903 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 53.9 m-20 -65.24 -35.74 82.0 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.652 0.263 . . . . 0.0 110.692 -179.479 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 80.9 m -64.29 -55.33 22.09 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.821 0.344 . . . . 0.0 110.718 -179.93 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . 0.573 ' CE1' ' CE2' ' A' ' 37' ' ' PHE . 59.4 m-85 -64.47 -33.99 77.17 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.427 179.47 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 57.9 tt0 -60.0 -42.89 95.26 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 120.891 -0.324 . . . . 0.0 110.614 -179.88 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 20.8 t0 -61.1 -51.71 68.0 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.825 179.834 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' TYR . . . . . 0.41 ' O ' ' OG1' ' A' ' 69' ' ' THR . 41.3 m-85 -65.97 -35.03 79.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.739 179.735 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 56.9 t80 -59.57 -44.41 93.31 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.291 -179.424 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 39.6 t30 -64.37 -40.33 95.62 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.579 179.941 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.41 ' OG1' ' O ' ' A' ' 66' ' ' TYR . 41.0 p -66.1 -22.5 66.4 Favored 'General case' 0 CA--C 1.516 -0.332 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.342 179.933 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -70.04 -46.85 64.14 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 120.009 -0.676 . . . . 0.0 110.995 179.911 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . 0.414 ' H ' ' HD3' ' A' ' 72' ' ' PRO . . . 113.29 70.73 0.55 Allowed Glycine 0 CA--C 1.532 1.101 0 N-CA-C 110.698 -0.961 . . . . 0.0 110.698 -179.494 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . 0.414 ' HD3' ' H ' ' A' ' 71' ' ' GLY . 23.6 Cg_exo -63.93 147.34 92.01 Favored 'Trans proline' 0 N--CA 1.499 1.822 0 C-N-CA 123.029 2.486 . . . . 0.0 112.068 179.979 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -80.8 -49.52 11.0 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-O 120.953 0.406 . . . . 0.0 110.338 179.63 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.419 ' CD ' ' N ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -137.46 2.62 2.49 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.654 -179.481 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 68.8 t 57.7 93.5 0.05 OUTLIER Pre-proline 0 C--N 1.325 -0.48 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.211 -178.805 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -53.58 126.66 22.5 Favored 'Trans proline' 0 N--CA 1.495 1.59 0 C-N-CA 121.805 1.67 . . . . 0.0 111.786 -179.583 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . 0.466 ' O ' ' N ' ' A' ' 80' ' ' PHE . 40.8 t -83.25 -20.53 9.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.679 179.822 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 63.6 p -41.55 -26.34 0.07 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.265 -179.27 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . 0.433 ' N ' ' O ' ' A' ' 77' ' ' VAL . . . -64.02 -42.69 97.04 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.546 179.654 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . 0.466 ' N ' ' O ' ' A' ' 77' ' ' VAL . 10.8 m-85 -64.5 -35.45 80.98 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.143 179.694 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 37.3 m -59.89 -42.09 93.01 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.353 179.814 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 4.1 m-85 -60.17 -51.36 69.91 Favored 'General case' 0 C--N 1.331 -0.215 0 C-N-CA 120.88 -0.328 . . . . 0.0 110.609 -179.951 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' TRP . . . . . . . . . . . . . 47.2 t90 -59.23 -39.01 81.39 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.645 179.66 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 12.4 m120 -61.86 -44.14 97.43 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.562 -179.651 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 25.0 tp -72.14 -59.32 2.8 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 120.358 -0.537 . . . . 0.0 110.135 179.359 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -50.74 -28.79 6.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-O 120.895 0.379 . . . . 0.0 110.395 179.709 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 66.0 tttt -65.26 -50.99 63.67 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.9 -179.293 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.1 pp20? -79.96 -20.1 46.35 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.801 -179.683 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.85 -46.24 90.31 Favored 'General case' 0 N--CA 1.443 -0.815 0 C-N-CA 120.158 -0.617 . . . . 0.0 110.486 -178.771 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 3.2 mt -63.67 -44.21 98.37 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 C-N-CA 119.891 -0.723 . . . . 0.0 109.937 -179.605 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 -64.88 -12.29 47.2 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.785 -178.988 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 68.1 tttt -74.04 139.83 44.98 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.377 179.736 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -74.86 -10.22 59.29 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.84 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 80.3 mm-40 -86.47 52.31 2.46 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.562 179.857 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 27.1 m -115.89 131.71 67.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.485 179.915 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' ASN . . . . . 0.456 ' OD1' ' N ' ' A' ' 96' ' ' ASN . 0.0 OUTLIER -58.76 161.88 7.73 Favored Pre-proline 0 C--N 1.324 -0.528 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.474 179.777 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -58.98 -13.22 17.86 Favored 'Trans proline' 0 N--CA 1.495 1.597 0 C-N-CA 122.821 2.347 . . . . 0.0 112.153 179.682 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . 0.43 ' OE1' ' OD1' ' A' ' 96' ' ' ASN . 0.9 OUTLIER . . . . . 0 C--N 1.321 -0.659 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.557 179.818 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 28.3 m . . . . . 0 N--CA 1.46 0.045 0 CA-C-O 120.695 0.284 . . . . 0.0 110.704 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -130.31 179.51 5.87 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.57 -179.97 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 108' ' ' GLU . . . . . 0.536 ' C ' ' H ' ' A' ' 110' ' ' LEU . 98.7 mt-10 -108.64 122.82 47.9 Favored 'General case' 0 CA--C 1.513 -0.445 0 CA-C-N 115.943 -0.571 . . . . 0.0 109.895 179.132 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 38.3 pt -49.45 -11.63 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.036 179.779 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . 0.536 ' H ' ' C ' ' A' ' 108' ' ' GLU . 36.3 mt -68.16 -40.88 82.25 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.725 179.779 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -68.47 -39.98 81.16 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.357 -179.921 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 16.2 t -62.52 -44.42 96.4 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.856 -179.549 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 10.3 m120 -63.03 -40.82 98.86 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.539 -179.941 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 35.6 p -158.04 160.92 37.93 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.593 179.872 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 14.8 pt20 -100.88 7.66 43.54 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.377 179.89 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 11.4 m -60.75 -44.63 96.46 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.395 -179.676 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 59.7 t0 . . . . . 0 C--N 1.328 -0.328 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.842 -179.962 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.646 0 N-CA-C 110.987 -0.845 . . . . 0.0 110.987 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . 0.489 ' O ' ' N ' ' A' ' 5' ' ' LEU . 89.3 mt-30 -65.37 -22.08 66.76 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.819 0.342 . . . . 0.0 110.576 -179.828 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . 0.496 ' O ' ' N ' ' A' ' 7' ' ' GLN . 91.2 mt-10 -43.09 -20.52 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.558 179.912 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.489 ' N ' ' O ' ' A' ' 3' ' ' GLN . 59.6 tp -41.42 -37.47 1.05 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.602 179.671 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 96.3 p -59.09 -37.0 76.07 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.611 179.675 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . 0.496 ' N ' ' O ' ' A' ' 4' ' ' GLU . 58.3 tt0 -65.11 -37.01 86.1 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.552 179.05 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 78.8 t60 -53.83 -45.81 70.99 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.519 179.636 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -60.77 -46.24 91.22 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.553 179.688 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.517 ' O ' ' N ' ' A' ' 14' ' ' GLN . 88.5 mtt-85 -64.91 -32.28 73.91 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.566 179.496 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.49 ' O ' ' HB2' ' A' ' 15' ' ' LEU . 48.1 t80 -59.72 -35.19 74.03 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.529 179.854 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 4.2 t -65.21 -48.27 84.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.53 -178.935 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -83.79 -32.71 25.22 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.563 -179.82 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . 0.517 ' N ' ' O ' ' A' ' 10' ' ' ARG . 60.8 tp60 -73.58 -50.27 22.11 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.562 -178.186 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.49 ' HB2' ' O ' ' A' ' 11' ' ' TYR . 0.3 OUTLIER -63.45 -47.6 81.2 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.521 179.761 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 92.7 mttt -57.33 -32.76 67.04 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.582 179.086 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 60.1 tt0 -73.12 -37.52 66.64 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.598 178.461 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -56.76 -32.98 66.13 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.533 179.442 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.416 ' O ' ' N ' ' A' ' 22' ' ' ARG . 2.8 mt -85.73 -33.13 21.55 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.597 178.569 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 63.9 tttm -44.44 -42.65 7.18 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.559 -179.928 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' THR . . . . . 0.609 ' C ' ' H ' ' A' ' 23' ' ' GLY . 0.2 OUTLIER -75.39 -27.7 59.19 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.516 -179.706 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.416 ' N ' ' O ' ' A' ' 19' ' ' LEU . 77.8 mmt-85 -68.9 21.64 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.536 -179.874 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . 0.609 ' H ' ' C ' ' A' ' 21' ' ' THR . . . 87.56 14.11 64.1 Favored Glycine 0 CA--C 1.525 0.7 0 N-CA-C 110.887 -0.885 . . . . 0.0 110.887 -179.567 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 11.3 t -104.89 167.19 2.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-O 120.871 0.367 . . . . 0.0 110.538 179.726 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -135.23 120.95 19.53 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.534 179.62 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 17.2 m -120.53 116.12 49.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.551 -179.769 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 29.9 pttt -108.67 166.93 10.43 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.541 179.953 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 98.4 m-85 -47.29 -40.01 15.86 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.551 179.384 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -57.99 -23.38 53.7 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.609 179.547 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 54.9 t0 -62.08 -43.79 98.08 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.548 -179.647 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.525 ' O ' ' CB ' ' A' ' 35' ' ' PHE . 5.6 mp -66.48 -43.45 85.38 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.588 179.545 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.431 ' O ' ' OD2' ' A' ' 36' ' ' ASP . 35.4 mt -58.4 -42.44 87.18 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.508 -177.852 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 85.3 tttt -86.33 -51.69 6.08 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.577 -178.229 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 57.6 t80 -61.7 -49.53 76.11 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.543 -177.669 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.525 ' CB ' ' O ' ' A' ' 31' ' ' LEU . 6.7 t80 -62.26 -44.83 95.66 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.593 -178.398 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . 0.431 ' OD2' ' O ' ' A' ' 32' ' ' LEU . 98.4 m-20 -66.95 -35.45 80.0 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.45 -179.644 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 2.3 m-85 -61.18 -52.56 64.29 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.558 -178.642 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . 0.561 ' O ' ' N ' ' A' ' 42' ' ' CYS . 23.0 m -68.06 -38.89 80.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.623 -178.442 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -61.62 -25.94 67.67 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.517 -179.067 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 67.3 t0 -55.61 -55.3 33.69 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.49 -178.693 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' THR . . . . . 0.515 ' O ' ' SG ' ' A' ' 42' ' ' CYS . 15.5 p -115.35 -2.65 12.58 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.561 -178.517 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . 0.561 ' N ' ' O ' ' A' ' 38' ' ' VAL . 23.1 p 38.25 59.25 5.05 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.558 -179.418 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . 0.453 ' C ' ' H ' ' A' ' 45' ' ' PHE . 64.8 Cg_endo -77.12 -23.97 9.99 Favored 'Trans proline' 0 C--N 1.305 -1.72 0 C-N-CA 122.871 2.38 . . . . 0.0 112.142 -179.57 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . 0.534 ' CZ3' ' CE3' ' A' ' 56' ' ' TRP . 0.0 OUTLIER -69.36 5.1 1.41 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.569 -179.477 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 0.453 ' H ' ' C ' ' A' ' 43' ' ' PRO . 38.4 t80 48.2 57.56 17.97 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.572 179.79 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 23.2 Cg_endo -61.0 -7.09 7.18 Favored 'Trans proline' 0 C--N 1.305 -1.74 0 C-N-CA 122.758 2.305 . . . . 0.0 112.16 -178.777 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 82.6 mt-30 -54.7 -52.91 60.95 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.541 -179.796 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 43.8 tp10 -89.68 -27.69 19.95 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.619 179.317 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 85.73 66.04 1.43 Allowed Glycine 0 CA--C 1.525 0.671 0 N-CA-C 110.978 -0.849 . . . . 0.0 110.978 -178.847 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' THR . . . . . 0.592 ' HG1' ' H ' ' A' ' 51' ' ' ILE . 10.7 t -132.77 170.2 15.61 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.788 0.327 . . . . 0.0 110.584 -179.449 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.592 ' H ' ' HG1' ' A' ' 50' ' ' THR . 1.8 mt -93.66 141.55 14.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.549 179.532 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . 0.494 ' H ' ' HE1' ' A' ' 44' ' ' TRP . 1.2 m-20 -114.51 122.76 47.56 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.542 179.784 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 25.2 mm -96.16 -55.75 5.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.648 179.648 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 67.8 mttm -73.34 -49.26 28.29 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.569 -178.978 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -62.16 -32.01 72.58 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.561 -178.555 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' TRP . . . . . 0.534 ' CE3' ' CZ3' ' A' ' 44' ' ' TRP . 13.0 t-105 -62.86 -38.28 90.2 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.557 179.304 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -64.31 -36.4 83.98 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.523 -179.728 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 94.6 mtt180 -60.54 -53.4 57.93 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.591 -179.294 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . 0.411 HG11 ' N ' ' A' ' 60' ' ' GLY . 2.6 p -66.96 -42.72 89.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.629 -179.862 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . 0.411 ' N ' HG11 ' A' ' 59' ' ' VAL . . . -62.72 -37.77 95.37 Favored Glycine 0 CA--C 1.525 0.707 0 N-CA-C 110.915 -0.874 . . . . 0.0 110.915 179.695 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 95.4 m-20 -65.88 -40.37 91.55 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.878 0.371 . . . . 0.0 110.602 -179.238 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 76.7 m -63.34 -57.18 11.2 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.568 -178.927 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 37.8 m-85 -64.4 -42.67 95.96 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.62 -179.153 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 55.8 tt0 -63.92 -34.43 77.95 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.558 -179.345 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 41.2 t0 -60.33 -53.44 57.62 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.597 -179.945 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 65.7 m-85 -69.81 -39.19 76.67 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.507 179.962 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 69.5 t80 -60.55 -41.07 93.77 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.586 -179.844 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . 0.452 ' OD1' ' O ' ' A' ' 72' ' ' PRO . 51.2 t-20 -65.36 -45.52 83.83 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.536 -179.387 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 80.4 p -68.87 -16.78 63.86 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.594 -179.185 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 2.3 m-85 -76.02 -5.66 47.45 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.596 -179.325 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . 0.493 ' O ' ' N ' ' A' ' 73' ' ' GLU . . . 153.94 -67.14 0.31 Allowed Glycine 0 CA--C 1.525 0.715 0 N-CA-C 110.912 -0.875 . . . . 0.0 110.912 179.535 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . 0.452 ' O ' ' OD1' ' A' ' 68' ' ' ASN . 38.6 Cg_exo -39.69 88.12 0.01 OUTLIER 'Trans proline' 0 C--N 1.304 -1.812 0 C-N-CA 122.815 2.344 . . . . 0.0 112.114 -176.874 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.493 ' N ' ' O ' ' A' ' 71' ' ' GLY . 83.2 tt0 -66.24 -34.65 78.49 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.576 179.589 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.608 ' CD ' ' H ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -97.0 -16.72 20.46 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.549 179.9 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.511 ' O ' ' O ' ' A' ' 74' ' ' LYS . 19.8 t 57.4 132.04 0.02 OUTLIER Pre-proline 0 C--N 1.329 -0.323 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.526 179.447 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 41.1 Cg_exo -50.44 123.65 11.68 Favored 'Trans proline' 0 C--N 1.305 -1.737 0 C-N-CA 122.864 2.376 . . . . 0.0 112.101 178.352 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . 0.417 ' O ' ' N ' ' A' ' 80' ' ' PHE . 40.6 t -81.79 -20.33 10.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.531 -179.795 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' THR . . . . . 0.478 ' O ' ' OG ' ' A' ' 81' ' ' SER . 22.7 p -43.1 -24.8 0.09 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.585 178.815 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.91 -37.74 86.88 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.534 179.92 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . 0.417 ' N ' ' O ' ' A' ' 77' ' ' VAL . 2.5 m-85 -63.1 -37.17 86.16 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.601 -179.263 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' SER . . . . . 0.518 ' HG ' ' N ' ' A' ' 82' ' ' TYR . 93.3 p -58.62 -39.6 80.94 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.574 -179.727 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' TYR . . . . . 0.518 ' N ' ' HG ' ' A' ' 81' ' ' SER . 11.2 m-85 -61.17 -47.73 84.82 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.601 179.688 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' TRP . . . . . 0.422 ' O ' ' CB ' ' A' ' 87' ' ' LYS . 40.0 t90 -59.19 -37.82 78.35 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.568 -179.528 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 97.5 m-20 -61.24 -47.04 87.87 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.549 -178.598 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 25.4 tp -72.27 -55.44 7.17 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.563 179.782 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -56.11 -25.37 19.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.567 179.506 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . 0.422 ' CB ' ' O ' ' A' ' 83' ' ' TRP . 57.1 tttt -67.56 -50.78 56.89 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.61 179.467 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . 0.469 ' C ' ' CD ' ' A' ' 88' ' ' GLU . 0.9 OUTLIER -78.96 -20.17 49.89 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.551 -179.873 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.29 -49.42 77.66 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.535 179.845 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 3.3 mt -63.79 -41.09 91.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.56 179.21 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 97.5 m-20 -69.18 -16.43 63.62 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.572 -179.409 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 70.4 tttt -68.4 140.97 55.83 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.561 -179.886 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -70.9 -4.56 25.05 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.488 -179.522 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 27.5 tp10 -84.57 46.78 1.27 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.562 -179.579 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 34.1 m -125.83 132.91 70.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.519 -179.807 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' ASN . . . . . 0.587 ' O ' ' N ' ' A' ' 98' ' ' GLN . 10.1 m-20 -87.18 157.58 53.54 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.548 -179.249 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_exo -41.35 -13.24 0.03 OUTLIER 'Trans proline' 0 C--N 1.305 -1.733 0 C-N-CA 122.812 2.341 . . . . 0.0 112.147 178.785 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . 0.587 ' N ' ' O ' ' A' ' 96' ' ' ASN . 6.9 pt20 . . . . . 0 C--N 1.33 -0.262 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.554 179.951 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 28.9 m . . . . . 0 C--O 1.231 0.11 0 CA-C-O 120.82 0.343 . . . . 0.0 110.556 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 86.9 mt-10 -124.19 -175.61 3.29 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.519 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 108' ' ' GLU . . . . . 0.56 ' C ' ' H ' ' A' ' 110' ' ' LEU . 73.8 mm-40 -106.58 122.45 46.34 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.553 179.373 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . 0.429 ' O ' ' OG ' ' A' ' 112' ' ' SER . 43.8 pt -45.49 -12.87 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.595 179.869 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . 0.56 ' H ' ' C ' ' A' ' 108' ' ' GLU . 25.6 mt -67.11 -44.94 78.68 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.509 179.843 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 62.4 tttm -65.34 -33.86 76.96 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.566 -179.605 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 112' ' ' SER . . . . . 0.429 ' OG ' ' O ' ' A' ' 109' ' ' ILE . 97.0 p -63.57 -46.83 84.09 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.551 -179.813 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 31.7 t30 -65.57 -42.45 91.79 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.588 179.608 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 114' ' ' SER . . . . . 0.481 ' C ' ' H ' ' A' ' 116' ' ' THR . 22.8 t -164.51 132.57 3.38 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.552 179.994 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 86.6 mt-30 -77.94 27.65 0.18 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.54 179.984 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 116' ' ' THR . . . . . 0.481 ' H ' ' C ' ' A' ' 114' ' ' SER . 7.8 m -61.22 -41.3 96.62 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.557 179.914 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 95.0 m-20 . . . . . 0 C--N 1.329 -0.299 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.592 179.656 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.704 0 N-CA-C 110.941 -0.864 . . . . 0.0 110.941 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 52.3 tt0 -63.14 -29.38 70.75 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.871 0.367 . . . . 0.0 110.444 -179.827 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 95.2 mt-10 -55.97 -22.98 29.52 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.651 179.811 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 43.2 tp -44.23 -35.3 2.2 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.511 -179.525 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 78.2 p -55.03 -35.14 64.13 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.641 -0.423 . . . . 0.0 109.92 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 68.2 tp60 -64.11 -35.57 81.17 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.181 179.561 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 83.2 t60 -60.28 -44.62 95.18 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.257 179.988 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -58.78 -46.53 87.3 Favored 'General case' 0 C--O 1.241 0.613 0 C-N-CA 120.522 -0.471 . . . . 0.0 110.183 -179.923 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.447 ' O ' ' N ' ' A' ' 14' ' ' GLN . 87.2 mtt-85 -67.21 -36.53 81.92 Favored 'General case' 0 C--O 1.21 -1.008 0 N-CA-C 109.322 -0.622 . . . . 0.0 109.322 179.607 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.437 ' HH ' ' CD1' ' A' ' 51' ' ' ILE . 20.3 t80 -57.87 -27.9 63.67 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 120.878 -0.329 . . . . 0.0 110.313 -179.433 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 6.7 t -73.8 -51.16 25.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 C-N-CA 120.241 -0.584 . . . . 0.0 111.109 179.69 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -81.49 -23.72 37.17 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.084 0.469 . . . . 0.0 111.635 -179.329 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . 0.447 ' N ' ' O ' ' A' ' 10' ' ' ARG . 66.5 tp60 -77.49 -53.57 7.47 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.978 -179.117 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.47 -45.4 90.98 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-O 120.896 0.379 . . . . 0.0 110.062 -179.907 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -59.99 -36.22 76.7 Favored 'General case' 0 C--O 1.232 0.145 0 C-N-CA 120.617 -0.433 . . . . 0.0 109.953 179.568 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 73.9 mt-30 -72.94 -40.33 65.48 Favored 'General case' 0 C--O 1.238 0.453 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.632 178.738 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -57.33 -26.57 61.14 Favored 'General case' 0 CA--C 1.518 -0.256 0 CA-C-N 115.918 -0.583 . . . . 0.0 109.97 179.935 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 4.2 mt -84.71 -40.96 16.71 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.846 -0.342 . . . . 0.0 110.452 178.949 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 28.8 mtmt -45.45 -44.2 12.04 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.124 -178.885 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -58.5 -34.33 70.82 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 120.422 -0.511 . . . . 0.0 110.425 -179.5 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 84.2 mmt-85 -66.56 -7.09 17.72 Favored 'General case' 0 C--N 1.332 -0.195 0 C-N-CA 120.656 -0.418 . . . . 0.0 110.295 -179.881 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 107.22 23.7 6.87 Favored Glycine 0 CA--C 1.526 0.778 0 N-CA-C 111.021 -0.832 . . . . 0.0 111.021 -179.721 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.457 ' CG1' ' N ' ' A' ' 25' ' ' LYS . 38.6 t -102.89 169.32 1.96 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 N-CA-C 110.337 -0.246 . . . . 0.0 110.337 -179.991 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.457 ' N ' ' CG1' ' A' ' 24' ' ' VAL . 99.0 mttt -134.65 131.82 38.22 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.985 -0.376 . . . . 0.0 109.985 179.268 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 28.4 m -122.88 129.23 75.26 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.285 0 N-CA-C 109.989 -0.374 . . . . 0.0 109.989 179.887 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.423 ' HG2' ' H ' ' A' ' 28' ' ' TYR . 23.7 ttmt -109.53 159.99 16.61 Favored 'General case' 0 N--CA 1.463 0.18 0 N-CA-C 110.065 -0.346 . . . . 0.0 110.065 179.585 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . 0.423 ' H ' ' HG2' ' A' ' 27' ' ' LYS . 96.6 m-85 -50.61 -31.77 16.93 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.001 0.429 . . . . 0.0 109.867 179.341 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -55.34 -23.31 23.29 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.225 179.414 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.423 ' O ' ' CB ' ' A' ' 34' ' ' PHE . 86.0 m-20 -61.2 -48.15 82.84 Favored 'General case' 0 C--O 1.219 -0.512 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.56 -179.525 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.495 ' O ' ' CB ' ' A' ' 35' ' ' PHE . 5.3 mp -66.07 -41.45 90.74 Favored 'General case' 0 C--O 1.216 -0.708 0 C-N-CA 120.571 -0.452 . . . . 0.0 110.385 179.469 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 37.8 mt -58.97 -46.3 88.45 Favored 'General case' 0 C--N 1.313 -0.99 0 C-N-CA 119.468 -0.893 . . . . 0.0 111.176 -178.013 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.441 ' O ' ' CB ' ' A' ' 37' ' ' PHE . 87.9 tttt -85.49 -48.17 9.22 Favored 'General case' 0 C--N 1.319 -0.754 0 C-N-CA 120.553 -0.459 . . . . 0.0 112.091 -178.692 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . 0.423 ' CB ' ' O ' ' A' ' 30' ' ' ASP . 44.0 t80 -63.54 -48.07 79.04 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.376 -178.993 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.495 ' CB ' ' O ' ' A' ' 31' ' ' LEU . 18.4 t80 -61.85 -48.41 80.68 Favored 'General case' 0 C--N 1.33 -0.242 0 C-N-CA 120.475 -0.49 . . . . 0.0 110.363 -179.146 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 65.8 t0 -72.96 -34.8 66.72 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 120.474 -0.49 . . . . 0.0 111.462 -179.803 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.441 ' CB ' ' O ' ' A' ' 33' ' ' LYS . 4.3 t80 -60.99 -48.5 81.55 Favored 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 120.984 -0.286 . . . . 0.0 111.635 -178.296 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . 0.548 ' O ' ' N ' ' A' ' 42' ' ' CYS . 15.4 m -74.6 -36.93 42.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 C-N-CA 120.408 -0.517 . . . . 0.0 110.688 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -55.7 -29.79 60.02 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.867 -179.813 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 68.0 t0 -47.03 -61.49 1.85 Allowed 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 120.646 -0.421 . . . . 0.0 110.745 -179.744 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 13.9 p -114.8 2.01 14.27 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.345 -0.388 . . . . 0.0 111.049 179.822 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . 0.548 ' N ' ' O ' ' A' ' 38' ' ' VAL . 1.9 m 38.07 58.59 4.9 Favored Pre-proline 0 CA--C 1.534 0.364 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.831 -178.706 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . 0.527 ' C ' ' H ' ' A' ' 45' ' ' PHE . 26.9 Cg_exo -63.39 -36.97 52.32 Favored 'Trans proline' 0 N--CA 1.5 1.885 0 C-N-CA 122.617 2.211 . . . . 0.0 112.857 -179.069 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . 0.757 ' HE1' ' H ' ' A' ' 52' ' ' ASP . 0.0 OUTLIER -66.45 6.19 0.48 Allowed 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.62 -179.281 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 0.528 ' C ' ' H ' ' A' ' 47' ' ' GLN . 19.8 m-85 44.25 56.48 13.51 Favored Pre-proline 0 C--N 1.33 -0.24 0 N-CA-C 109.887 -0.412 . . . . 0.0 109.887 -179.832 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 10.2 Cg_endo -51.27 -6.34 0.12 Allowed 'Trans proline' 0 N--CA 1.493 1.445 0 C-N-CA 122.773 2.316 . . . . 0.0 111.917 179.929 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.528 ' H ' ' C ' ' A' ' 45' ' ' PHE . 95.9 mm-40 -62.72 -52.04 64.82 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.128 -179.913 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . 0.482 ' N ' ' CD ' ' A' ' 48' ' ' GLU . 0.0 OUTLIER -88.0 -31.82 19.14 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-O 121.04 0.448 . . . . 0.0 110.169 178.973 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 85.7 66.18 1.42 Allowed Glycine 0 CA--C 1.523 0.554 0 N-CA-C 110.616 -0.994 . . . . 0.0 110.616 -178.731 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 14.8 t -125.98 170.24 11.91 Favored 'General case' 0 CA--C 1.517 -0.305 0 CA-C-O 120.679 0.276 . . . . 0.0 110.772 -179.502 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.437 ' CD1' ' HH ' ' A' ' 11' ' ' TYR . 1.3 mt -102.36 138.88 25.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.198 179.814 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . 0.757 ' H ' ' HE1' ' A' ' 44' ' ' TRP . 84.2 m-20 -114.28 122.15 45.84 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.726 179.644 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.404 HG22 HD12 ' A' ' 53' ' ' ILE . 29.9 mm -94.63 -55.86 5.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.506 179.735 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -78.01 -50.48 12.02 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-O 121.032 0.444 . . . . 0.0 111.707 -179.06 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 93.1 mtt-85 -59.47 -32.01 69.85 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.082 -0.508 . . . . 0.0 109.863 -179.64 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' TRP . . . . . 0.573 ' CE3' ' CH2' ' A' ' 44' ' ' TRP . 23.2 t-105 -60.7 -40.81 93.64 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.449 179.098 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 92.5 mtm-85 -63.28 -33.63 75.93 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 120.291 -0.564 . . . . 0.0 109.831 179.92 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . 0.442 ' O ' ' SG ' ' A' ' 62' ' ' CYS . 74.0 ttt180 -60.41 -52.47 65.1 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 120.315 -0.554 . . . . 0.0 110.853 -179.571 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 4.3 p -69.0 -42.8 82.26 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.571 0 CA-C-O 120.71 0.29 . . . . 0.0 110.567 179.48 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . 0.435 ' O ' ' CB ' ' A' ' 64' ' ' GLN . . . -65.27 -47.58 78.72 Favored Glycine 0 CA--C 1.525 0.688 0 CA-C-N 116.297 -0.41 . . . . 0.0 112.337 -178.945 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 96.9 m-20 -60.98 -40.76 94.65 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.784 0.292 . . . . 0.0 111.296 -178.552 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' CYS . . . . . 0.442 ' SG ' ' O ' ' A' ' 58' ' ' ARG . 70.7 m -61.72 -59.92 4.45 Favored 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 120.708 -0.397 . . . . 0.0 111.467 -179.299 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 15.4 m-85 -65.72 -42.71 90.75 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.342 -179.805 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . 0.435 ' CB ' ' O ' ' A' ' 60' ' ' GLY . 58.2 tt0 -61.17 -41.31 96.57 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.388 -179.458 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 24.8 t0 -55.46 -56.78 16.19 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.872 0.368 . . . . 0.0 110.906 -179.757 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 50.5 m-85 -64.57 -43.31 94.3 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 120.57 -0.452 . . . . 0.0 110.421 179.664 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 64.7 t80 -52.65 -42.33 64.58 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.596 -179.351 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . 0.423 HD22 ' HG2' ' A' ' 64' ' ' GLN . 19.3 m-20 -62.77 -42.51 99.72 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.421 -179.298 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 25.0 p -71.67 -16.46 62.25 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.495 -179.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -87.35 12.83 11.04 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.769 -179.632 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 152.06 -79.17 0.2 Allowed Glycine 0 CA--C 1.53 0.98 0 C-N-CA 120.384 -0.912 . . . . 0.0 112.322 179.039 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_exo -40.59 100.84 0.03 OUTLIER 'Trans proline' 0 C--N 1.307 -1.642 0 C-N-CA 122.712 2.275 . . . . 0.0 112.06 -178.514 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 80.2 mm-40 -73.47 -42.76 61.51 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.655 -0.702 . . . . 0.0 109.928 179.19 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.575 ' CD ' ' H ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -94.95 -13.39 25.38 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.091 179.779 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.485 ' O ' ' O ' ' A' ' 74' ' ' LYS . 36.4 t 56.22 123.77 0.01 OUTLIER Pre-proline 0 CA--C 1.544 0.715 0 O-C-N 123.143 0.277 . . . . 0.0 111.416 -179.938 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_exo -53.24 128.04 27.56 Favored 'Trans proline' 0 N--CA 1.495 1.616 0 C-N-CA 121.166 1.244 . . . . 0.0 112.251 179.232 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . 0.453 ' O ' ' N ' ' A' ' 80' ' ' PHE . 59.8 t -82.84 -18.42 10.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 115.38 -0.827 . . . . 0.0 110.65 179.211 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 62.7 p -42.98 -24.23 0.06 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.924 0.392 . . . . 0.0 110.433 -179.621 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . 0.436 ' N ' ' O ' ' A' ' 77' ' ' VAL . . . -64.88 -37.88 89.09 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.784 179.642 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . 0.453 ' N ' ' O ' ' A' ' 77' ' ' VAL . 3.7 m-85 -58.94 -33.14 70.25 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.418 -179.744 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 39.0 t -60.3 -42.94 96.59 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.115 179.708 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 -59.69 -49.91 75.92 Favored 'General case' 0 CA--C 1.517 -0.311 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.586 179.722 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' TRP . . . . . 0.471 ' C ' ' CD1' ' A' ' 83' ' ' TRP . 8.3 t-105 -54.51 -40.38 68.51 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.733 -179.826 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 87.6 m-20 -61.98 -44.84 95.9 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 120.461 -0.496 . . . . 0.0 111.153 -179.404 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 29.9 tp -73.29 -55.08 6.9 Favored 'General case' 0 C--O 1.222 -0.377 0 C-N-CA 120.31 -0.556 . . . . 0.0 110.565 179.569 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -55.58 -25.77 18.54 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 C-N-CA 120.591 -0.444 . . . . 0.0 110.406 179.921 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 67.4 tttt -67.4 -50.68 58.49 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.656 179.648 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . 0.413 ' O ' ' OE1' ' A' ' 88' ' ' GLU . 1.1 pp20? -79.76 -20.02 47.3 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.745 -0.661 . . . . 0.0 111.113 -179.077 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.05 -46.3 89.76 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 120.66 -0.416 . . . . 0.0 110.227 -179.446 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 3.8 mt -64.69 -43.05 96.61 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.215 0 C-N-CA 120.184 -0.606 . . . . 0.0 109.85 -179.662 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -54.92 -42.83 72.7 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.974 -178.758 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 58.9 mmtt -48.32 131.13 16.71 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 120.668 -0.413 . . . . 0.0 110.4 -179.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -63.57 -37.43 87.29 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.603 179.854 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 70.5 tt0 -69.92 54.98 0.13 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.347 -179.625 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 35.5 m -70.44 155.51 7.58 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-O 120.946 0.403 . . . . 0.0 110.057 -179.948 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' ASN . . . . . . . . . . . . . 1.3 m-20 -59.28 160.42 12.63 Favored Pre-proline 0 C--N 1.325 -0.476 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.873 -179.289 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -60.02 -10.83 13.46 Favored 'Trans proline' 0 N--CA 1.494 1.503 0 C-N-CA 123.101 2.534 . . . . 0.0 111.941 179.391 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 5.0 pt20 . . . . . 0 C--N 1.321 -0.633 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.869 -179.412 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 3.6 t . . . . . 0 C--O 1.231 0.118 0 CA-C-O 120.711 0.291 . . . . 0.0 110.635 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 89.9 mt-10 -89.0 149.17 23.38 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.459 -179.822 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 108' ' ' GLU . . . . . 0.558 ' C ' ' H ' ' A' ' 110' ' ' LEU . 97.0 mt-10 -73.84 139.16 44.89 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 120.378 -0.529 . . . . 0.0 109.655 179.092 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 26.7 pt -54.86 -5.21 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.127 179.452 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . 0.558 ' H ' ' C ' ' A' ' 108' ' ' GLU . 3.4 pp -170.35 120.05 0.59 Allowed 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 116.251 -0.431 . . . . 0.0 109.99 179.789 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 25.5 pttm -139.4 151.12 46.03 Favored 'General case' 0 C--O 1.231 0.124 0 CA-C-O 120.67 0.271 . . . . 0.0 110.377 -179.512 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 88.1 p -60.42 -22.28 63.21 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.667 -179.358 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 39.7 t30 -64.63 -40.81 96.11 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.682 179.73 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 23.3 t -117.64 -68.0 0.95 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.917 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 9.3 mt-30 41.31 86.48 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.034 0.445 . . . . 0.0 110.744 -179.73 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 72.0 p -74.28 -22.86 59.11 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.009 -0.542 . . . . 0.0 110.353 179.869 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 97.7 m-20 . . . . . 0 C--N 1.329 -0.298 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.6 179.855 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.704 0 N-CA-C 110.958 -0.857 . . . . 0.0 110.958 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 77.5 mt-30 -58.27 -31.31 67.33 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.898 0.38 . . . . 0.0 110.624 -179.921 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . 0.431 ' OE1' ' OE1' ' A' ' 7' ' ' GLN . 78.0 mm-40 -51.91 -23.48 5.0 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.284 -179.945 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 37.2 tp -42.84 -27.2 0.17 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.439 -179.406 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 37.6 t -59.68 -41.64 91.14 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.15 179.661 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . 0.431 ' OE1' ' OE1' ' A' ' 4' ' ' GLU . 89.1 mt-30 -61.96 -30.19 70.75 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.569 179.827 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 84.5 t60 -63.46 -44.83 93.33 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.822 0.344 . . . . 0.0 110.359 179.932 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 80.5 tt0 -59.66 -50.13 75.04 Favored 'General case' 0 C--O 1.243 0.721 0 CA-C-O 121.361 0.6 . . . . 0.0 110.352 179.7 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.43 ' O ' ' CB ' ' A' ' 14' ' ' GLN . 86.2 mtt180 -62.44 -33.18 74.3 Favored 'General case' 0 C--O 1.211 -0.956 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 179.55 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 31.7 t80 -58.89 -36.4 74.59 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 110.175 -0.305 . . . . 0.0 110.175 -179.588 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 3.6 t -64.36 -49.66 79.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 C-N-CA 119.987 -0.685 . . . . 0.0 111.488 179.997 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -81.08 -30.74 34.62 Favored 'General case' 0 C--N 1.324 -0.523 0 C-N-CA 120.582 -0.447 . . . . 0.0 111.826 -179.357 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . 0.43 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 60.5 tp60 -74.23 -52.17 13.18 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.916 -0.583 . . . . 0.0 110.896 -178.982 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.91 -44.21 96.7 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 120.407 -0.517 . . . . 0.0 109.809 -179.557 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 66.0 mttm -59.53 -34.4 72.6 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.848 0.356 . . . . 0.0 110.198 179.091 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 35.8 mm-40 -66.58 -42.01 87.65 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.489 0.661 . . . . 0.0 110.022 179.038 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.39 -28.66 69.4 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.912 -0.585 . . . . 0.0 109.732 179.277 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.9 mt -74.19 -33.85 63.56 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.933 0.397 . . . . 0.0 110.652 178.651 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 67.8 mttm -54.56 -37.33 65.34 Favored 'General case' 0 C--N 1.323 -0.548 0 C-N-CA 120.188 -0.605 . . . . 0.0 109.883 -179.775 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 1.2 t -60.57 -28.1 68.2 Favored 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 120.397 -0.521 . . . . 0.0 110.863 179.37 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 7.7 mmm180 -80.2 12.79 2.65 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-O 120.98 0.419 . . . . 0.0 110.584 -179.567 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 81.04 14.0 80.1 Favored Glycine 0 CA--C 1.522 0.514 0 N-CA-C 110.491 -1.044 . . . . 0.0 110.491 -179.8 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 37.9 t -86.83 165.34 2.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 C-N-CA 120.981 -0.287 . . . . 0.0 110.446 -179.706 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -139.12 129.61 25.76 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 120.916 -0.314 . . . . 0.0 110.235 179.429 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 13.7 m -126.74 130.89 71.57 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.239 0 N-CA-C 109.943 -0.391 . . . . 0.0 109.943 179.584 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.55 ' N ' ' OD2' ' A' ' 30' ' ' ASP . 10.9 ttmt -109.16 161.78 14.89 Favored 'General case' 0 C--O 1.221 -0.401 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 179.674 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . 0.435 ' H ' ' HG2' ' A' ' 27' ' ' LYS . 98.4 m-85 -41.89 -33.28 0.51 Allowed 'General case' 0 C--O 1.236 0.392 0 CA-C-O 121.101 0.477 . . . . 0.0 110.796 179.646 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -55.7 -22.45 23.52 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.525 179.702 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.55 ' OD2' ' N ' ' A' ' 27' ' ' LYS . 3.2 m-20 -58.55 -49.48 77.27 Favored 'General case' 0 CA--C 1.516 -0.364 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.281 -179.396 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.5 ' O ' ' CB ' ' A' ' 35' ' ' PHE . 4.9 mp -67.21 -41.27 86.05 Favored 'General case' 0 C--O 1.215 -0.75 0 CA-C-O 120.985 0.421 . . . . 0.0 110.242 179.273 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.448 ' O ' ' OD1' ' A' ' 36' ' ' ASP . 40.8 mt -59.04 -44.97 91.84 Favored 'General case' 0 C--N 1.315 -0.927 0 C-N-CA 119.692 -0.803 . . . . 0.0 111.246 -178.238 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.527 ' O ' ' CD1' ' A' ' 37' ' ' PHE . 88.6 tttt -84.53 -37.79 20.82 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.939 -178.658 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . 0.413 ' CB ' ' O ' ' A' ' 30' ' ' ASP . 62.4 t80 -78.07 -51.03 10.93 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.393 -178.681 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.5 ' CB ' ' O ' ' A' ' 31' ' ' LEU . 12.9 t80 -60.07 -46.55 89.19 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.389 -179.327 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . 0.468 ' OD1' ' O ' ' A' ' 33' ' ' LYS . 3.7 p-10 -70.28 -31.37 68.7 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 120.216 -0.594 . . . . 0.0 111.198 -179.438 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.527 ' CD1' ' O ' ' A' ' 33' ' ' LYS . 1.4 m-85 -60.68 -55.62 31.07 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-O 120.73 0.3 . . . . 0.0 111.673 -179.037 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . 0.521 ' O ' ' N ' ' A' ' 42' ' ' CYS . 5.3 m -69.7 -37.65 74.38 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 C-N-CA 120.556 -0.458 . . . . 0.0 110.717 -179.565 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 65.5 tttm -56.92 -27.61 61.07 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.57 -179.822 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 93.4 m-20 -50.6 -62.98 1.27 Allowed 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 120.685 -0.406 . . . . 0.0 110.63 -179.546 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' THR . . . . . 0.504 ' O ' ' SG ' ' A' ' 42' ' ' CYS . 24.9 p -115.05 8.99 15.87 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.293 -179.943 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . 0.521 ' N ' ' O ' ' A' ' 38' ' ' VAL . 7.4 p 38.42 59.14 5.24 Favored Pre-proline 0 N--CA 1.465 0.279 0 CA-C-O 120.883 0.373 . . . . 0.0 110.679 -179.529 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . 0.528 ' C ' ' H ' ' A' ' 45' ' ' PHE . 57.5 Cg_endo -74.21 -28.1 10.99 Favored 'Trans proline' 0 C--N 1.31 -1.499 0 C-N-CA 122.79 2.327 . . . . 0.0 112.445 -179.619 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . 0.465 ' CD1' ' O ' ' A' ' 50' ' ' THR . 0.6 OUTLIER -62.28 1.37 0.33 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.603 -179.469 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 0.544 ' O ' ' N ' ' A' ' 47' ' ' GLN . 60.8 m-85 50.44 55.61 16.81 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.44 -179.277 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.425 ' CD ' ' N ' ' A' ' 45' ' ' PHE . 70.1 Cg_exo -42.14 -14.82 0.05 OUTLIER 'Trans proline' 0 C--N 1.307 -1.627 0 C-N-CA 122.849 2.366 . . . . 0.0 112.218 179.644 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.544 ' N ' ' O ' ' A' ' 45' ' ' PHE . 87.1 mt-30 -65.98 -53.07 43.64 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.248 -179.27 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 65.8 tt0 -88.87 -30.21 19.07 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.373 178.599 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 73.78 50.64 10.74 Favored Glycine 0 CA--C 1.526 0.764 0 N-CA-C 110.383 -1.087 . . . . 0.0 110.383 -179.239 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' THR . . . . . 0.493 ' OG1' ' NE2' ' A' ' 98' ' ' GLN . 15.0 t -107.68 160.71 15.49 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.842 0.354 . . . . 0.0 110.744 -179.468 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.448 ' N ' ' HG1' ' A' ' 50' ' ' THR . 1.5 mt -89.71 137.35 21.59 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-O 121.143 0.497 . . . . 0.0 110.593 179.452 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 57.9 m-20 -108.18 120.77 43.29 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.435 -0.802 . . . . 0.0 111.328 179.227 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 30.2 mm -95.03 -57.01 4.68 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.255 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.17 179.166 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -77.09 -49.03 16.21 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-O 121.076 0.465 . . . . 0.0 111.215 -179.659 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 84.5 mtt85 -60.31 -32.47 71.25 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.01 -179.628 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 13.8 t-105 -61.87 -40.3 94.91 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.735 179.48 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 80.2 mtp85 -62.82 -38.55 91.16 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.531 -179.555 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . 0.494 ' O ' ' SG ' ' A' ' 62' ' ' CYS . 83.7 mtt85 -60.84 -52.65 64.16 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 120.593 -0.443 . . . . 0.0 111.385 -179.546 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 3.2 p -66.55 -42.12 89.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.6 179.739 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . 0.402 ' O ' ' CB ' ' A' ' 64' ' ' GLN . . . -61.7 -45.37 96.4 Favored Glycine 0 CA--C 1.522 0.521 0 N-CA-C 111.229 -0.748 . . . . 0.0 111.229 -179.399 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 71.3 m-20 -64.67 -35.15 80.1 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 121.118 -0.233 . . . . 0.0 110.669 -179.444 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' CYS . . . . . 0.494 ' SG ' ' O ' ' A' ' 58' ' ' ARG . 72.4 m -64.21 -59.73 4.06 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.809 0.338 . . . . 0.0 111.144 -179.492 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 50.7 m-85 -65.4 -39.7 92.52 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.284 -0.417 . . . . 0.0 110.86 179.642 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . 0.402 ' CB ' ' O ' ' A' ' 60' ' ' GLY . 58.5 tt0 -63.91 -36.02 82.57 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.749 -179.65 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 31.4 t0 -60.75 -52.77 63.7 Favored 'General case' 0 C--N 1.323 -0.549 0 C-N-CA 120.709 -0.396 . . . . 0.0 110.497 179.957 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 69.8 m-85 -70.5 -42.73 70.94 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.911 179.69 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 65.0 t80 -57.99 -43.39 86.54 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.226 -179.457 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . 0.455 ' OD1' ' C ' ' A' ' 68' ' ' ASN . 21.2 t-20 -60.58 -44.32 96.35 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.28 -179.917 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 82.2 p -74.48 -18.36 60.63 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 120.555 -0.458 . . . . 0.0 110.111 -179.934 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 26.7 m-85 -109.04 16.5 22.53 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.261 179.736 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -167.7 -105.61 0.18 Allowed Glycine 0 CA--C 1.533 1.156 0 C-N-CA 120.579 -0.82 . . . . 0.0 111.126 -179.99 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . 0.444 ' O ' ' OD1' ' A' ' 68' ' ' ASN . 67.7 Cg_endo -74.13 147.61 38.27 Favored 'Trans proline' 0 N--CA 1.494 1.558 0 C-N-CA 121.893 1.729 . . . . 0.0 113.093 -179.592 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 98.1 mt-10 -85.64 -47.49 9.77 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.286 179.541 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.613 ' CD ' ' H ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -95.84 -17.34 21.21 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.512 -178.821 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.433 ' O ' ' O ' ' A' ' 74' ' ' LYS . 26.7 t 59.2 131.87 0.02 OUTLIER Pre-proline 0 C--N 1.324 -0.505 0 CA-C-N 115.589 -0.732 . . . . 0.0 111.214 -179.186 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 49.4 Cg_exo -52.43 127.88 25.72 Favored 'Trans proline' 0 N--CA 1.494 1.536 0 C-N-CA 121.629 1.552 . . . . 0.0 111.358 179.045 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 46.2 t -82.62 -8.5 11.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.898 179.988 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 73.7 p -48.22 -20.51 0.38 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.361 -179.707 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -60.45 -24.62 65.37 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.499 179.5 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 47.8 t80 -60.81 -39.25 88.26 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.436 -179.987 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 77.4 p -58.46 -40.52 82.88 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.529 -179.958 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 23.5 m-85 -60.62 -52.3 65.75 Favored 'General case' 0 C--O 1.221 -0.412 0 C-N-CA 120.674 -0.41 . . . . 0.0 110.812 179.736 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' TRP . . . . . 0.405 ' O ' ' CB ' ' A' ' 87' ' ' LYS . 77.2 t90 -54.14 -39.67 66.69 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.431 -0.349 . . . . 0.0 110.638 -179.807 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 67.7 m-20 -63.28 -47.12 83.68 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.768 -0.373 . . . . 0.0 111.197 -179.813 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 32.7 tp -70.67 -54.39 12.07 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 120.21 -0.596 . . . . 0.0 110.705 179.399 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -56.53 -26.62 23.41 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.162 -179.81 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . 0.405 ' CB ' ' O ' ' A' ' 83' ' ' TRP . 53.8 tttt -66.61 -49.18 67.14 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.841 -179.473 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.2 pp20? -79.6 -20.44 46.88 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.54 -179.788 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.36 -45.82 91.42 Favored 'General case' 0 N--CA 1.446 -0.64 0 C-N-CA 120.077 -0.649 . . . . 0.0 110.574 -179.224 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 3.5 mt -64.91 -43.57 96.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 C-N-CA 120.332 -0.547 . . . . 0.0 109.78 -179.936 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 91.1 m-20 -44.06 -36.86 2.72 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.844 -178.455 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -50.49 129.28 21.85 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 120.475 -0.49 . . . . 0.0 110.427 179.803 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -62.34 -40.72 97.29 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.652 -179.853 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . 0.468 ' O ' ' C ' ' A' ' 95' ' ' VAL . 97.7 mt-10 -71.33 -3.96 23.48 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.823 -179.607 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.468 ' C ' ' O ' ' A' ' 94' ' ' GLU . 2.4 m 29.58 -109.88 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.36 0 O-C-N 123.711 0.632 . . . . 0.0 110.403 -179.791 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' ASN . . . . . 0.498 ' N ' ' OD1' ' A' ' 96' ' ' ASN . 0.0 OUTLIER -154.17 169.93 9.24 Favored Pre-proline 0 C--N 1.325 -0.461 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.482 178.962 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -48.56 -13.14 0.23 Allowed 'Trans proline' 0 N--CA 1.494 1.542 0 C-N-CA 122.705 2.27 . . . . 0.0 112.296 179.118 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . 0.493 ' NE2' ' OG1' ' A' ' 50' ' ' THR . 3.5 pt20 . . . . . 0 C--N 1.323 -0.544 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.704 -179.908 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 87.1 m . . . . . 0 N--CA 1.458 -0.057 0 CA-C-O 120.798 0.333 . . . . 0.0 110.135 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 90.3 mt-10 49.85 -161.01 0.06 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.17 -179.845 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 108' ' ' GLU . . . . . 0.555 ' N ' ' OE1' ' A' ' 108' ' ' GLU . 56.3 mp0 -112.21 118.82 36.38 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 179.613 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . 0.409 HD11 HG21 ' A' ' 109' ' ' ILE . 41.5 pt -48.82 -14.13 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.339 -179.853 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . 0.479 ' H ' ' C ' ' A' ' 108' ' ' GLU . 30.9 mt -64.91 -41.23 95.75 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.395 179.467 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -68.36 -35.82 78.29 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.399 179.818 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 44.7 t -60.81 -47.63 85.49 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.668 -179.508 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 17.0 m120 -65.57 -45.0 84.99 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.548 179.769 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 114' ' ' SER . . . . . 0.601 ' HG ' ' H ' ' A' ' 116' ' ' THR . 40.3 t -158.2 139.02 12.99 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.344 179.809 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 87.9 mt-30 -85.42 -4.63 59.22 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.384 179.843 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 116' ' ' THR . . . . . 0.601 ' H ' ' HG ' ' A' ' 114' ' ' SER . 15.0 m -62.5 -46.68 87.34 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.706 -179.631 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 . . . . . 0 C--N 1.329 -0.326 0 CA-C-O 120.962 0.41 . . . . 0.0 110.47 179.977 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.725 0 N-CA-C 111.096 -0.802 . . . . 0.0 111.096 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 99.4 mm-40 -62.86 -30.18 71.31 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.899 0.381 . . . . 0.0 110.483 -179.871 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . 0.427 ' O ' ' N ' ' A' ' 7' ' ' GLN . 80.0 mm-40 -56.01 -22.15 25.38 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.542 179.593 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 36.6 tp -41.38 -28.94 0.13 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.031 0.443 . . . . 0.0 110.266 -179.403 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 54.1 m -58.25 -41.27 83.86 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.963 0.411 . . . . 0.0 110.173 179.675 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . 0.427 ' N ' ' O ' ' A' ' 4' ' ' GLU . 88.1 mt-30 -64.26 -31.83 73.18 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.835 179.97 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 86.4 t60 -60.18 -45.67 92.31 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-O 120.913 0.387 . . . . 0.0 110.285 179.95 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 99.3 mt-10 -60.48 -43.96 96.42 Favored 'General case' 0 C--O 1.244 0.772 0 CA-C-O 121.243 0.544 . . . . 0.0 110.126 179.769 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.436 ' O ' ' CB ' ' A' ' 14' ' ' GLN . 92.2 mtt-85 -63.18 -34.09 76.88 Favored 'General case' 0 C--O 1.211 -0.969 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 179.578 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 37.4 t80 -59.11 -38.68 80.15 Favored 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 120.765 -0.374 . . . . 0.0 110.369 -179.636 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 2.2 t -60.55 -51.81 68.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 C-N-CA 119.624 -0.83 . . . . 0.0 110.983 -179.675 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 82.8 tt0 -79.56 -38.31 34.43 Favored 'General case' 0 C--N 1.322 -0.609 0 C-N-CA 120.14 -0.624 . . . . 0.0 112.053 -178.968 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . 0.436 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 69.0 tp60 -64.32 -50.5 67.57 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.847 -179.0 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.98 -46.39 87.94 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.487 -0.485 . . . . 0.0 110.073 -179.648 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 61.0 mttp -58.14 -31.6 67.36 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 120.746 -0.381 . . . . 0.0 110.203 179.482 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 75.5 mt-30 -75.73 -35.19 60.3 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.723 178.889 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -57.14 -35.99 70.16 Favored 'General case' 0 CA--C 1.519 -0.224 0 CA-C-N 115.727 -0.67 . . . . 0.0 110.01 -179.992 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.436 ' O ' ' N ' ' A' ' 22' ' ' ARG . 3.0 mt -84.97 -32.92 22.76 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.131 0.491 . . . . 0.0 110.587 179.172 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -46.02 -42.04 12.76 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.472 -179.121 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' THR . . . . . 0.533 ' C ' ' H ' ' A' ' 23' ' ' GLY . 0.1 OUTLIER -74.74 -23.5 58.57 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.693 -179.972 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.436 ' N ' ' O ' ' A' ' 19' ' ' LEU . 27.0 mmt180 -73.44 19.91 0.1 Allowed 'General case' 0 N--CA 1.463 0.224 0 CA-C-O 120.78 0.324 . . . . 0.0 110.4 179.987 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . 0.533 ' H ' ' C ' ' A' ' 21' ' ' THR . . . 87.75 16.84 59.25 Favored Glycine 0 CA--C 1.524 0.633 0 N-CA-C 110.941 -0.863 . . . . 0.0 110.941 -179.976 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 21.7 t -106.4 167.97 3.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 120.635 0.255 . . . . 0.0 110.533 -179.873 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -135.37 128.84 32.4 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 109.881 -0.414 . . . . 0.0 109.881 179.345 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 26.5 m -125.48 118.46 52.49 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.16 0 N-CA-C 109.993 -0.373 . . . . 0.0 109.993 -179.925 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.47 ' HD3' ' H ' ' A' ' 29' ' ' ALA . 13.7 tmtt? -110.03 160.07 16.75 Favored 'General case' 0 C--O 1.222 -0.392 0 N-CA-C 109.716 -0.476 . . . . 0.0 109.716 179.614 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 88.7 m-85 -41.94 -28.99 0.19 Allowed 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.028 0.442 . . . . 0.0 110.968 179.841 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . 0.47 ' H ' ' HD3' ' A' ' 27' ' ' LYS . . . -60.27 -24.62 65.07 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.828 -179.849 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.455 ' O ' ' CB ' ' A' ' 34' ' ' PHE . 13.0 m-20 -62.48 -44.73 95.68 Favored 'General case' 0 C--O 1.216 -0.658 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.564 -179.673 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.475 ' O ' ' CB ' ' A' ' 35' ' ' PHE . 5.7 mp -65.48 -40.89 93.66 Favored 'General case' 0 C--N 1.322 -0.619 0 C-N-CA 120.576 -0.449 . . . . 0.0 110.101 179.449 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 32.1 mt -59.84 -45.23 93.08 Favored 'General case' 0 C--N 1.317 -0.833 0 C-N-CA 119.433 -0.907 . . . . 0.0 111.122 -178.698 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.424 ' O ' ' CB ' ' A' ' 37' ' ' PHE . 48.7 tttp -85.57 -47.37 9.93 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 112.084 0.402 . . . . 0.0 112.084 -179.016 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . 0.455 ' CB ' ' O ' ' A' ' 30' ' ' ASP . 54.4 t80 -63.42 -50.41 69.91 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.976 -178.833 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.475 ' CB ' ' O ' ' A' ' 31' ' ' LEU . 9.3 t80 -62.69 -45.1 94.34 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.298 -179.673 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 56.7 t0 -73.1 -37.17 66.82 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 120.558 -0.457 . . . . 0.0 111.332 -179.508 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.424 ' CB ' ' O ' ' A' ' 33' ' ' LYS . 5.6 t80 -61.43 -47.87 83.79 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.332 -178.376 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . 0.5 ' O ' ' N ' ' A' ' 42' ' ' CYS . 19.6 m -72.26 -35.89 54.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 115.626 -0.716 . . . . 0.0 110.341 -179.869 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 65.1 tttm -58.57 -28.98 66.04 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.475 179.78 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 62.9 t0 -45.05 -59.65 2.49 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 120.58 -0.448 . . . . 0.0 110.606 -179.857 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 11.4 p -113.86 -5.28 13.24 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.744 0.307 . . . . 0.0 110.885 179.945 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . 0.529 ' N ' ' HD3' ' A' ' 43' ' ' PRO . 0.0 OUTLIER 48.65 54.36 15.91 Favored Pre-proline 0 CA--C 1.538 0.493 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.572 -178.738 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . 0.529 ' HD3' ' N ' ' A' ' 42' ' ' CYS . 27.0 Cg_exo -62.16 -38.97 51.95 Favored 'Trans proline' 0 N--CA 1.496 1.649 0 C-N-CA 122.051 1.834 . . . . 0.0 113.034 -179.075 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . 0.805 ' HE1' ' H ' ' A' ' 52' ' ' ASP . 0.0 OUTLIER -71.7 0.75 8.06 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.025 -178.911 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 0.566 ' O ' ' N ' ' A' ' 47' ' ' GLN . 33.9 m-85 53.37 48.51 5.13 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.664 -179.086 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.535 ' CD ' ' N ' ' A' ' 45' ' ' PHE . 44.7 Cg_exo -39.02 -17.83 0.04 OUTLIER 'Trans proline' 0 C--N 1.312 -1.394 0 C-N-CA 122.845 2.363 . . . . 0.0 112.348 179.11 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.566 ' N ' ' O ' ' A' ' 45' ' ' PHE . 83.6 mt-30 -58.25 -52.84 63.88 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.428 -179.642 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 47.1 tp10 -88.3 -34.22 17.74 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.821 -0.352 . . . . 0.0 110.236 178.975 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 87.29 71.7 1.29 Allowed Glycine 0 CA--C 1.526 0.723 0 N-CA-C 110.171 -1.172 . . . . 0.0 110.171 -178.514 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 12.4 t -129.76 171.78 12.32 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 110.4 -0.222 . . . . 0.0 110.4 -179.377 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.1 mt -102.19 142.59 16.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 120.982 0.42 . . . . 0.0 110.491 179.29 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . 0.805 ' H ' ' HE1' ' A' ' 44' ' ' TRP . 73.6 m-20 -122.41 121.66 37.17 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.46 -0.791 . . . . 0.0 111.465 179.343 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 23.5 mm -95.58 -56.19 5.43 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.352 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.24 178.964 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -74.15 -50.65 18.41 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-O 120.94 0.4 . . . . 0.0 111.438 -179.531 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 91.4 mtt-85 -61.04 -35.62 77.4 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.533 -179.891 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' TRP . . . . . 0.637 ' CE3' ' CH2' ' A' ' 44' ' ' TRP . 24.8 t-105 -59.38 -36.25 75.42 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.191 0.52 . . . . 0.0 110.452 179.102 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 61.4 ttp180 -66.41 -37.95 86.37 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.162 179.852 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 87.5 mtt180 -60.48 -51.85 67.7 Favored 'General case' 0 N--CA 1.466 0.375 0 C-N-CA 120.956 -0.298 . . . . 0.0 111.75 -178.866 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 2.9 p -62.46 -42.49 95.9 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.459 0 CA-C-O 120.95 0.405 . . . . 0.0 110.153 -179.952 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -68.95 -39.4 85.15 Favored Glycine 0 CA--C 1.527 0.836 0 N-CA-C 111.452 -0.659 . . . . 0.0 111.452 179.865 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 12.7 m-20 -64.97 -42.1 94.85 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.734 0.302 . . . . 0.0 111.075 -179.191 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 5.4 m -60.04 -53.29 59.56 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.619 -179.263 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 13.8 m-85 -67.61 -37.18 82.15 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.785 179.586 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 53.3 tt0 -62.45 -41.09 98.5 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.717 -179.715 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 46.2 t0 -60.74 -52.51 64.79 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.756 -179.9 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' TYR . . . . . 0.478 ' O ' ' OG1' ' A' ' 69' ' ' THR . 25.5 m-85 -66.17 -30.58 71.08 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.362 179.482 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 76.8 t80 -68.04 -41.77 81.57 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.541 -179.859 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . 0.427 ' O ' ' N ' ' A' ' 71' ' ' GLY . 99.0 m-20 -63.56 -40.24 96.48 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.129 -179.44 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.478 ' OG1' ' O ' ' A' ' 66' ' ' TYR . 74.5 p -49.8 -17.76 0.4 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.515 -179.73 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . 0.401 ' N ' ' C ' ' A' ' 68' ' ' ASN . 59.5 m-85 -93.31 15.72 14.94 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.82 -179.953 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . 0.427 ' N ' ' O ' ' A' ' 68' ' ' ASN . . . 40.58 58.02 2.64 Favored Glycine 0 CA--C 1.53 0.999 0 N-CA-C 110.905 -0.878 . . . . 0.0 110.905 -179.295 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -76.48 132.54 13.6 Favored 'Trans proline' 0 N--CA 1.495 1.606 0 C-N-CA 122.89 2.393 . . . . 0.0 112.13 179.715 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 83.5 tt0 -90.88 -19.94 22.8 Favored 'General case' 0 CA--C 1.507 -0.701 0 CA-C-O 121.408 0.623 . . . . 0.0 110.673 179.813 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.505 ' O ' ' C ' ' A' ' 75' ' ' VAL . 53.9 mmtt -73.01 -47.21 47.14 Favored 'General case' 0 C--N 1.31 -1.134 0 CA-C-N 115.237 -0.892 . . . . 0.0 112.056 -178.134 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.505 ' C ' ' O ' ' A' ' 74' ' ' LYS . 53.5 t 25.48 80.56 0.21 Allowed Pre-proline 0 CA--C 1.528 0.099 0 O-C-N 123.765 0.665 . . . . 0.0 111.476 179.874 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_exo -55.76 125.37 18.89 Favored 'Trans proline' 0 C--N 1.307 -1.654 0 C-N-CA 121.663 1.575 . . . . 0.0 111.703 -178.842 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 96.6 t -83.88 -21.09 8.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.788 179.811 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 40.2 p -43.41 -27.57 0.28 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.732 -179.079 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -51.95 -43.28 63.44 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.041 179.777 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . 0.528 ' CE2' ' OD1' ' A' ' 84' ' ' ASN . 60.2 t80 -63.05 -42.39 99.71 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.839 179.388 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 39.3 m -58.22 -44.63 88.28 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.477 -0.329 . . . . 0.0 110.871 -179.103 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 14.4 m-85 -60.67 -48.5 81.5 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 120.79 -0.364 . . . . 0.0 110.702 179.751 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' TRP . . . . . 0.407 ' O ' ' CB ' ' A' ' 87' ' ' LYS . 68.5 t90 -56.09 -39.81 72.68 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.647 179.936 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . 0.528 ' OD1' ' CE2' ' A' ' 80' ' ' PHE . 13.3 m120 -61.96 -45.2 94.69 Favored 'General case' 0 C--N 1.326 -0.429 0 C-N-CA 120.658 -0.417 . . . . 0.0 110.966 -179.496 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 50.8 tp -72.47 -56.88 4.7 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 120.466 -0.494 . . . . 0.0 110.449 179.717 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -54.11 -27.25 16.2 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 C-N-CA 120.671 -0.412 . . . . 0.0 110.123 -179.834 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . 0.407 ' CB ' ' O ' ' A' ' 83' ' ' TRP . 65.0 tttt -65.61 -50.89 63.4 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.218 -179.734 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . 0.466 ' O ' ' OE1' ' A' ' 88' ' ' GLU . 1.0 OUTLIER -79.66 -19.94 47.88 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.72 -179.371 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.51 -46.42 90.04 Favored 'General case' 0 N--CA 1.444 -0.736 0 C-N-CA 120.128 -0.629 . . . . 0.0 110.043 -179.148 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 3.5 mt -64.05 -42.62 96.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 C-N-CA 120.229 -0.588 . . . . 0.0 109.867 -179.908 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 71.3 m-20 -53.24 -44.81 68.41 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.676 -178.028 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . 0.518 ' C ' ' H ' ' A' ' 94' ' ' GLU . 97.5 mttt -71.39 142.76 50.32 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.797 0.332 . . . . 0.0 110.762 179.354 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -71.99 14.95 0.18 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.507 179.841 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . 0.518 ' H ' ' C ' ' A' ' 92' ' ' LYS . 40.4 tp10 -61.99 -35.21 77.85 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.296 -179.895 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 34.9 m -70.89 137.58 23.54 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.45 179.924 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' ASN . . . . . 0.525 ' O ' ' N ' ' A' ' 98' ' ' GLN . 0.9 OUTLIER -82.76 166.2 37.33 Favored Pre-proline 0 C--N 1.325 -0.471 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.743 -179.813 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 67.7 Cg_exo -44.94 -11.36 0.04 OUTLIER 'Trans proline' 0 N--CA 1.492 1.384 0 C-N-CA 122.434 2.089 . . . . 0.0 112.111 178.963 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . 0.525 ' N ' ' O ' ' A' ' 96' ' ' ASN . 6.1 pt20 . . . . . 0 C--N 1.324 -0.516 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.717 -179.597 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 87.9 m . . . . . 0 N--CA 1.461 0.101 0 CA-C-O 120.778 0.323 . . . . 0.0 110.399 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . 0.477 ' H ' ' CD ' ' A' ' 107' ' ' GLU . 30.3 mp0 -68.33 161.58 27.09 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.53 -179.406 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 108' ' ' GLU . . . . . 0.596 ' C ' ' H ' ' A' ' 110' ' ' LEU . 94.7 mt-10 -92.25 140.37 29.68 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.201 -0.454 . . . . 0.0 109.923 179.705 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 33.0 pt -60.74 3.75 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.379 179.848 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . 0.596 ' H ' ' C ' ' A' ' 108' ' ' GLU . 85.3 mt -109.54 32.33 5.1 Favored 'General case' 0 N--CA 1.461 0.082 0 CA-C-O 121.023 0.439 . . . . 0.0 110.37 -179.899 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . 0.4 ' N ' ' OE1' ' A' ' 115' ' ' GLN . 43.3 pttt -82.2 -115.41 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.484 179.962 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 112' ' ' SER . . . . . 0.499 ' OG ' ' N ' ' A' ' 113' ' ' ASN . 29.1 p -129.59 -132.88 0.21 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.259 179.584 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 113' ' ' ASN . . . . . 0.499 ' N ' ' OG ' ' A' ' 112' ' ' SER . 99.2 m-20 56.41 34.59 24.49 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.597 -179.802 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER 76.26 94.12 0.07 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.141 0.496 . . . . 0.0 110.623 179.962 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 115' ' ' GLN . . . . . 0.4 ' OE1' ' N ' ' A' ' 111' ' ' LYS . 82.7 mt-30 -144.12 164.52 30.42 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.819 -179.967 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 8.2 m -60.8 -45.34 94.77 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.916 -0.583 . . . . 0.0 110.463 -179.494 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 93.0 m-20 . . . . . 0 C--N 1.33 -0.27 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.542 179.91 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.732 0 N-CA-C 110.991 -0.844 . . . . 0.0 110.991 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 85.7 mt-30 -60.81 -27.06 67.76 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.859 0.361 . . . . 0.0 110.571 -179.937 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . 0.449 ' O ' ' N ' ' A' ' 7' ' ' GLN . 97.1 mt-10 -60.6 -23.6 64.83 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.611 179.823 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 37.6 tp -43.53 -32.74 0.97 Allowed 'General case' 0 C--O 1.234 0.271 0 CA-C-O 121.115 0.483 . . . . 0.0 110.362 -179.458 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 78.0 p -57.98 -37.76 74.84 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 120.662 -0.415 . . . . 0.0 110.111 179.952 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . 0.449 ' N ' ' O ' ' A' ' 4' ' ' GLU . 68.5 tp60 -65.43 -32.19 73.69 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.406 179.605 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 75.3 t60 -59.73 -45.35 92.44 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.809 0.338 . . . . 0.0 110.292 -179.941 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -59.79 -46.71 88.36 Favored 'General case' 0 C--O 1.244 0.77 0 CA-C-O 121.177 0.513 . . . . 0.0 110.233 179.713 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.421 ' O ' ' CB ' ' A' ' 14' ' ' GLN . 63.6 mtp85 -64.27 -33.47 75.88 Favored 'General case' 0 C--O 1.209 -1.066 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 179.707 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 29.8 t80 -58.78 -36.74 74.9 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.774 0.321 . . . . 0.0 110.322 -179.547 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 4.2 t -64.15 -50.28 77.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 C-N-CA 120.179 -0.608 . . . . 0.0 111.288 -179.939 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 93.7 mt-10 -80.24 -31.77 38.48 Favored 'General case' 0 C--N 1.325 -0.49 0 C-N-CA 120.485 -0.486 . . . . 0.0 111.767 -179.285 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . 0.421 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 65.1 tp60 -72.58 -53.22 12.54 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.025 -178.936 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.33 -45.51 92.88 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.842 -0.429 . . . . 0.0 109.842 -179.673 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 66.0 mttm -56.28 -34.42 66.42 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 120.49 -0.484 . . . . 0.0 109.977 179.489 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 69.7 mm-40 -72.05 -41.42 67.46 Favored 'General case' 0 C--O 1.241 0.608 0 CA-C-O 121.175 0.512 . . . . 0.0 110.521 178.551 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -53.64 -45.88 70.32 Favored 'General case' 0 C--O 1.223 -0.342 0 N-CA-C 109.693 -0.484 . . . . 0.0 109.693 179.902 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.449 ' O ' ' N ' ' A' ' 22' ' ' ARG . 4.5 mt -65.58 -37.11 85.72 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 120.984 0.421 . . . . 0.0 110.421 178.838 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 78.5 tttt -45.4 -37.22 4.85 Favored 'General case' 0 C--N 1.321 -0.646 0 C-N-CA 120.418 -0.513 . . . . 0.0 109.83 -179.798 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' THR . . . . . 0.574 ' C ' ' H ' ' A' ' 23' ' ' GLY . 0.9 OUTLIER -63.14 -34.08 76.86 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.11 179.43 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.449 ' N ' ' O ' ' A' ' 19' ' ' LEU . 12.8 mmt180 -70.37 17.59 0.06 Allowed 'General case' 0 C--O 1.233 0.215 0 CA-C-O 120.801 0.334 . . . . 0.0 110.393 -179.721 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . 0.574 ' H ' ' C ' ' A' ' 21' ' ' THR . . . 83.13 13.11 77.94 Favored Glycine 0 CA--C 1.523 0.562 0 N-CA-C 110.356 -1.098 . . . . 0.0 110.356 -179.878 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 12.7 t -89.2 167.49 1.68 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 N-CA-C 110.333 -0.247 . . . . 0.0 110.333 -179.907 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 58.5 mttp -134.87 127.46 30.75 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.223 179.335 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 3.0 m -121.63 126.31 74.58 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.247 0 C-N-CA 121.018 -0.273 . . . . 0.0 110.393 -179.921 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.405 ' HG2' ' H ' ' A' ' 28' ' ' TYR . 20.2 ttmt -110.88 159.38 17.75 Favored 'General case' 0 CA--C 1.528 0.114 0 N-CA-C 110.167 -0.308 . . . . 0.0 110.167 179.496 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . 0.405 ' H ' ' HG2' ' A' ' 27' ' ' LYS . 76.5 m-85 -49.67 -32.34 13.01 Favored 'General case' 0 C--O 1.237 0.44 0 CA-C-O 121.159 0.504 . . . . 0.0 110.224 179.414 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -55.21 -23.42 22.02 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.151 179.664 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.437 ' O ' ' CB ' ' A' ' 34' ' ' PHE . 87.5 m-20 -61.83 -46.77 88.03 Favored 'General case' 0 C--O 1.216 -0.66 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.758 -179.38 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.486 ' O ' ' CB ' ' A' ' 35' ' ' PHE . 5.4 mp -65.65 -40.76 92.83 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 121.106 0.479 . . . . 0.0 109.924 179.736 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 35.6 mt -59.2 -45.36 91.29 Favored 'General case' 0 C--N 1.314 -0.962 0 C-N-CA 119.798 -0.761 . . . . 0.0 110.962 -178.473 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.623 ' NZ ' ' CZ ' ' A' ' 37' ' ' PHE . 63.9 tttm -86.05 -50.25 7.18 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 112.064 0.394 . . . . 0.0 112.064 -179.089 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . 0.437 ' CB ' ' O ' ' A' ' 30' ' ' ASP . 51.4 t80 -60.21 -50.21 74.57 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.707 -0.678 . . . . 0.0 110.758 -178.591 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.486 ' CB ' ' O ' ' A' ' 31' ' ' LEU . 7.5 t80 -62.29 -46.84 86.96 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.354 -179.659 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 96.7 m-20 -63.03 -36.43 83.55 Favored 'General case' 0 C--N 1.344 0.329 0 CA-C-O 120.908 0.385 . . . . 0.0 111.209 -179.533 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.623 ' CZ ' ' NZ ' ' A' ' 33' ' ' LYS . 1.9 m-85 -57.33 -46.34 83.37 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.825 -179.479 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . 0.561 ' O ' ' N ' ' A' ' 42' ' ' CYS . 23.8 m -81.78 -24.84 9.7 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 C-N-CA 120.299 -0.56 . . . . 0.0 110.395 179.694 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 45.8 tttp -58.03 -31.57 67.12 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 120.78 -0.368 . . . . 0.0 110.4 -179.208 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 65.2 t0 -52.94 -61.14 2.48 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 120.587 -0.445 . . . . 0.0 111.232 -179.548 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' THR . . . . . 0.409 ' C ' ' SG ' ' A' ' 42' ' ' CYS . 31.5 p -114.43 -32.03 6.05 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-O 121.141 0.496 . . . . 0.0 111.261 -179.531 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . 0.561 ' N ' ' O ' ' A' ' 38' ' ' VAL . 2.4 m 70.57 58.59 0.48 Allowed Pre-proline 0 C--N 1.324 -0.518 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.386 -178.698 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . 0.569 ' C ' ' H ' ' A' ' 45' ' ' PHE . 19.9 Cg_exo -68.08 -25.13 38.04 Favored 'Trans proline' 0 N--CA 1.495 1.591 0 C-N-CA 122.443 2.096 . . . . 0.0 112.319 179.885 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -58.1 0.39 0.07 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.059 -179.34 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 0.569 ' H ' ' C ' ' A' ' 43' ' ' PRO . 0.1 OUTLIER 63.86 82.11 0.22 Allowed Pre-proline 0 C--N 1.328 -0.369 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.25 -179.987 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_endo -71.89 -9.79 25.27 Favored 'Trans proline' 0 N--CA 1.489 1.219 0 C-N-CA 122.041 1.828 . . . . 0.0 112.24 -179.55 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 88.1 mt-30 -81.02 -54.72 5.31 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 120.525 -0.47 . . . . 0.0 110.516 -179.81 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 63.2 tt0 -88.82 -26.72 21.52 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.48 178.984 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 68.56 61.01 5.0 Favored Glycine 0 CA--C 1.52 0.404 0 N-CA-C 110.086 -1.206 . . . . 0.0 110.086 -179.363 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 13.5 t -118.34 154.19 32.76 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.7 0.286 . . . . 0.0 110.995 -179.274 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.4 mt -80.63 137.06 22.07 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-O 121.259 0.552 . . . . 0.0 110.841 179.494 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . 0.427 ' OD2' ' O ' ' A' ' 43' ' ' PRO . 79.9 m-20 -108.85 121.48 45.18 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.106 -0.952 . . . . 0.0 111.249 179.504 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 27.6 mm -94.81 -56.02 5.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.111 179.145 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -78.66 -50.09 12.05 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-O 121.032 0.444 . . . . 0.0 111.243 -179.609 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 78.1 mtp180 -58.88 -31.94 69.04 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.016 179.756 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 19.1 t-105 -62.41 -39.18 92.44 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.061 0.458 . . . . 0.0 110.616 178.987 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -62.44 -36.27 81.89 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.135 -179.717 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 95.5 mtt-85 -62.14 -55.32 29.94 Favored 'General case' 0 C--N 1.331 -0.224 0 C-N-CA 120.508 -0.477 . . . . 0.0 111.54 -179.655 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 5.0 p -65.6 -43.33 94.06 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.441 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.447 179.803 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . 0.437 ' O ' ' CB ' ' A' ' 64' ' ' GLN . . . -63.67 -41.53 98.99 Favored Glycine 0 C--O 1.22 -0.729 0 N-CA-C 111.33 -0.708 . . . . 0.0 111.33 -179.455 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 76.1 m-20 -61.64 -39.93 93.08 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.82 0.31 . . . . 0.0 110.749 -179.096 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 85.3 m -60.09 -62.98 1.47 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.996 0.427 . . . . 0.0 111.002 -179.694 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 70.7 m-85 -63.35 -42.2 98.9 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.864 -179.917 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . 0.437 ' CB ' ' O ' ' A' ' 60' ' ' GLY . 56.5 tt0 -57.31 -40.49 78.0 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.814 0.34 . . . . 0.0 110.776 -179.736 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -58.87 -53.75 54.87 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.986 -179.79 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 71.1 m-85 -67.47 -36.49 81.25 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.681 179.851 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 67.7 t80 -60.69 -43.62 97.52 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.61 -179.469 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . 0.418 HD22 ' HG2' ' A' ' 64' ' ' GLN . 32.8 m-20 -63.79 -41.8 97.85 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.792 -179.203 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 40.5 p -71.64 -17.59 62.25 Favored 'General case' 0 CA--C 1.514 -0.441 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.227 -179.996 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -69.11 -18.59 63.99 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.955 179.881 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 165.24 -62.73 0.23 Allowed Glycine 0 CA--C 1.53 1.019 0 C-N-CA 120.887 -0.673 . . . . 0.0 111.453 -179.237 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -41.39 100.8 0.03 OUTLIER 'Trans proline' 0 C--N 1.313 -1.311 0 C-N-CA 122.691 2.261 . . . . 0.0 112.363 -179.616 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -73.81 -41.69 61.99 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.523 179.282 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.558 ' CD ' ' H ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -95.11 -13.9 24.69 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.243 -179.878 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.447 ' O ' ' O ' ' A' ' 74' ' ' LYS . 28.9 t 58.27 130.14 0.02 OUTLIER Pre-proline 0 CA--C 1.538 0.504 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.192 -178.985 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 48.6 Cg_exo -52.51 126.47 20.92 Favored 'Trans proline' 0 N--CA 1.496 1.636 0 C-N-CA 121.405 1.403 . . . . 0.0 112.283 179.102 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . 0.46 ' O ' ' N ' ' A' ' 80' ' ' PHE . 56.6 t -83.9 -22.57 8.17 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.333 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.848 179.254 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 28.4 p -42.08 -24.65 0.05 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.371 -179.378 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . 0.446 ' N ' ' O ' ' A' ' 77' ' ' VAL . . . -65.76 -38.46 89.14 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.862 179.691 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . 0.46 ' N ' ' O ' ' A' ' 77' ' ' VAL . 3.8 m-85 -57.85 -34.8 70.11 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.435 -179.6 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 35.6 t -60.77 -42.88 98.38 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.269 179.947 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 21.8 m-85 -60.38 -50.15 74.74 Favored 'General case' 0 C--O 1.223 -0.32 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.038 179.905 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' TRP . . . . . . . . . . . . . 55.1 t90 -54.43 -39.14 67.08 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.573 -179.555 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 89.6 m-20 -62.31 -47.07 85.89 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 120.649 -0.42 . . . . 0.0 111.02 -179.584 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 41.0 tp -71.79 -54.35 10.45 Favored 'General case' 0 C--O 1.219 -0.545 0 C-N-CA 120.328 -0.549 . . . . 0.0 110.574 179.86 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -56.84 -25.93 23.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.372 179.643 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 63.9 tttt -65.1 -50.62 65.4 Favored 'General case' 0 C--N 1.321 -0.653 0 C-N-CA 120.177 -0.609 . . . . 0.0 110.16 179.892 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . 0.437 ' O ' ' OE1' ' A' ' 88' ' ' GLU . 0.9 OUTLIER -80.78 -20.07 43.42 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.008 -179.992 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 14.2 tp -61.03 -44.33 97.57 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.629 -178.95 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 3.3 mt -63.99 -43.58 97.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 C-N-CA 120.12 -0.632 . . . . 0.0 109.711 -179.634 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . 0.429 ' OD1' ' O ' ' A' ' 91' ' ' ASP . 64.9 t0 -47.45 -34.98 7.93 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.843 -179.02 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . 0.429 ' O ' ' CG2' ' A' ' 95' ' ' VAL . 72.1 tttt -58.84 143.84 46.23 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.924 -179.965 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 64.5 tttm -74.26 -42.56 59.42 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.087 179.846 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 69.1 tt0 -94.24 54.96 1.95 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.02 0.438 . . . . 0.0 110.47 -178.899 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.46 ' CG1' ' ND2' ' A' ' 96' ' ' ASN . 5.0 t -61.19 -74.3 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.717 -179.736 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' ASN . . . . . 0.644 ' ND2' ' N ' ' A' ' 96' ' ' ASN . 0.0 OUTLIER -154.04 162.84 25.83 Favored Pre-proline 0 C--N 1.328 -0.352 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.617 179.972 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 14.1 Cg_endo -56.12 -11.01 5.09 Favored 'Trans proline' 0 N--CA 1.496 1.65 0 C-N-CA 122.999 2.466 . . . . 0.0 112.161 179.072 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . 0.598 ' OE1' ' ND2' ' A' ' 96' ' ' ASN . 5.5 pt20 . . . . . 0 C--N 1.323 -0.575 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.614 -179.769 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 87.7 m . . . . . 0 N--CA 1.461 0.116 0 CA-C-O 120.739 0.304 . . . . 0.0 110.451 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 93.7 mt-10 -112.54 146.88 37.73 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.432 -179.895 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 108' ' ' GLU . . . . . 0.597 ' C ' ' H ' ' A' ' 110' ' ' LEU . 99.1 mt-10 -64.61 130.6 44.23 Favored 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 120.699 -0.4 . . . . 0.0 110.216 179.572 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . 0.402 HD11 HG21 ' A' ' 109' ' ' ILE . 37.9 pt -58.0 -0.31 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.192 179.313 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . 0.597 ' H ' ' C ' ' A' ' 108' ' ' GLU . 97.8 mt -96.23 -2.72 45.57 Favored 'General case' 0 C--O 1.233 0.185 0 C-N-CA 120.723 -0.391 . . . . 0.0 110.518 -179.725 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -111.15 128.89 56.04 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.314 179.916 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 112' ' ' SER . . . . . 0.458 ' OG ' ' N ' ' A' ' 113' ' ' ASN . 86.8 p -136.87 -120.37 0.15 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.883 -0.598 . . . . 0.0 110.33 179.942 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 113' ' ' ASN . . . . . 0.458 ' N ' ' OG ' ' A' ' 112' ' ' SER . 8.2 m120 -63.13 -40.68 98.28 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.437 -179.889 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 45.0 t -140.53 143.66 35.51 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.466 179.85 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 88.3 mt-30 -70.68 90.52 0.77 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.535 -179.966 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 40.1 p -66.83 -34.77 78.53 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.567 179.995 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 64.9 t0 . . . . . 0 C--N 1.328 -0.327 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.643 -179.877 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . 0.425 ' C ' ' N ' ' A' ' 4' ' ' GLU . . . . . . . . 0 CA--C 1.526 0.737 0 N-CA-C 111.009 -0.836 . . . . 0.0 111.009 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 86.9 mt-30 -46.42 -19.78 0.09 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.877 0.37 . . . . 0.0 110.736 -179.965 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . 0.425 ' N ' ' C ' ' A' ' 2' ' ' GLY . 82.6 tt0 -54.37 -24.13 18.33 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.471 179.975 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 41.7 tp -42.26 -28.22 0.18 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.386 -179.736 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 59.7 p -59.95 -40.01 87.51 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.665 -179.88 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 90.0 mm-40 -61.72 -36.04 79.81 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.158 179.569 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 84.4 t60 -61.13 -41.25 96.38 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.361 179.657 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 79.1 tt0 -58.38 -47.36 84.1 Favored 'General case' 0 C--O 1.24 0.597 0 CA-C-O 121.327 0.584 . . . . 0.0 110.122 179.878 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.406 ' O ' ' CB ' ' A' ' 14' ' ' GLN . 61.9 mmt-85 -63.54 -34.76 78.51 Favored 'General case' 0 C--O 1.213 -0.854 0 N-CA-C 109.186 -0.672 . . . . 0.0 109.186 179.562 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 35.9 t80 -58.29 -37.43 75.0 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 120.222 -0.591 . . . . 0.0 110.334 -179.642 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 16.9 t -63.33 -48.5 87.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 C-N-CA 120.24 -0.584 . . . . 0.0 111.898 179.885 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -83.39 -26.92 30.0 Favored 'General case' 0 C--N 1.322 -0.617 0 C-N-CA 120.383 -0.527 . . . . 0.0 111.777 -179.125 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . 0.406 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 68.2 tp60 -77.82 -51.79 9.93 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.823 -179.181 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.98 -45.98 89.87 Favored 'General case' 0 CA--C 1.535 0.38 0 N-CA-C 109.839 -0.43 . . . . 0.0 109.839 179.886 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 96.8 mttt -58.68 -37.64 76.49 Favored 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 120.464 -0.494 . . . . 0.0 110.265 179.514 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 75.4 mt-30 -70.24 -37.35 74.95 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.619 178.644 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -56.35 -33.07 65.3 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.114 -0.494 . . . . 0.0 109.935 179.842 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.8 mt -85.63 -32.16 22.18 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.043 0.449 . . . . 0.0 110.65 178.969 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 66.0 tttm -48.84 -43.02 38.26 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.497 -178.794 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' THR . . . . . 0.504 ' C ' ' H ' ' A' ' 23' ' ' GLY . 0.1 OUTLIER -70.32 -25.0 63.1 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.611 179.752 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 29.1 mmt180 -74.14 19.04 0.13 Allowed 'General case' 0 N--CA 1.463 0.178 0 CA-C-O 120.812 0.339 . . . . 0.0 110.393 -179.753 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . 0.504 ' H ' ' C ' ' A' ' 21' ' ' THR . . . 87.66 17.18 58.81 Favored Glycine 0 N--CA 1.468 0.824 0 N-CA-C 111.138 -0.785 . . . . 0.0 111.138 179.957 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.437 ' CG1' ' N ' ' A' ' 25' ' ' LYS . 24.7 t -105.61 169.37 2.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 120.57 0.224 . . . . 0.0 110.527 179.953 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.437 ' N ' ' CG1' ' A' ' 24' ' ' VAL . 67.4 mttm -133.23 136.17 45.44 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.366 179.58 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 19.3 m -132.64 111.45 17.31 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.36 0 C-N-CA 121.148 -0.221 . . . . 0.0 110.666 -179.97 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.431 ' O ' ' N ' ' A' ' 30' ' ' ASP . 23.8 pttt -108.74 166.25 10.94 Favored 'General case' 0 CA--C 1.522 -0.122 0 N-CA-C 110.4 -0.222 . . . . 0.0 110.4 179.601 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 90.1 m-85 -46.92 -36.78 8.01 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-O 121.103 0.478 . . . . 0.0 110.019 179.719 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -56.73 -23.76 44.8 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.889 -0.596 . . . . 0.0 109.909 179.159 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.431 ' N ' ' O ' ' A' ' 27' ' ' LYS . 50.4 t0 -61.96 -49.78 74.73 Favored 'General case' 0 C--O 1.223 -0.291 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.974 -179.694 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.49 ' O ' ' CB ' ' A' ' 35' ' ' PHE . 5.8 mp -63.12 -41.13 99.27 Favored 'General case' 0 C--O 1.218 -0.561 0 CA-C-O 120.867 0.365 . . . . 0.0 110.336 179.965 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 51.2 mt -53.34 -46.07 69.36 Favored 'General case' 0 C--N 1.31 -1.109 0 C-N-CA 119.297 -0.961 . . . . 0.0 111.008 -178.985 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.495 ' O ' ' CD1' ' A' ' 37' ' ' PHE . 87.0 tttt -82.22 -53.16 6.29 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 112.151 0.426 . . . . 0.0 112.151 -179.003 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 10.2 m-85 -63.09 -50.44 70.53 Favored 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 120.405 -0.518 . . . . 0.0 111.52 -178.866 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.49 ' CB ' ' O ' ' A' ' 31' ' ' LEU . 22.4 t80 -58.21 -47.76 82.46 Favored 'General case' 0 C--N 1.323 -0.56 0 C-N-CA 120.752 -0.379 . . . . 0.0 110.577 -178.584 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 85.2 m-20 -71.33 -21.5 62.04 Favored 'General case' 0 C--N 1.339 0.122 0 C-N-CA 120.11 -0.636 . . . . 0.0 111.052 -179.43 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.506 ' O ' ' OG1' ' A' ' 41' ' ' THR . 2.7 m-85 -76.36 -63.43 1.33 Allowed 'General case' 0 C--O 1.224 -0.238 0 C-N-CA 120.508 -0.477 . . . . 0.0 111.92 -178.666 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . 0.525 ' O ' ' N ' ' A' ' 42' ' ' CYS . 0.3 OUTLIER -63.41 -38.54 82.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-O 120.927 0.394 . . . . 0.0 110.805 -179.24 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 89.0 tttt -63.03 -45.18 93.51 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.36 -179.56 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.428 ' N ' ' OD1' ' A' ' 40' ' ' ASP . 4.4 m-20 -85.06 -33.58 22.44 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 120.951 -0.299 . . . . 0.0 111.46 -179.664 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' THR . . . . . 0.512 ' O ' ' C ' ' A' ' 42' ' ' CYS . 34.8 p -86.96 -25.83 24.14 Favored 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 120.746 -0.382 . . . . 0.0 111.255 -178.969 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . 0.525 ' N ' ' O ' ' A' ' 38' ' ' VAL . 1.7 m 23.15 67.46 0.36 Allowed Pre-proline 0 N--CA 1.466 0.362 0 O-C-N 123.954 0.784 . . . . 0.0 110.539 -178.378 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 16.8 Cg_exo -64.0 -43.38 15.79 Favored 'Trans proline' 0 C--N 1.306 -1.689 0 C-N-CA 121.814 1.676 . . . . 0.0 115.056 -175.914 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . 0.514 ' HE1' ' C ' ' A' ' 50' ' ' THR . 5.7 p90 -125.97 17.05 7.93 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.685 0.755 . . . . 0.0 110.128 179.89 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 0.543 ' N ' ' HD3' ' A' ' 46' ' ' PRO . 4.3 t80 74.96 56.91 0.26 Allowed Pre-proline 0 C--N 1.32 -0.711 0 CA-C-N 114.786 -1.097 . . . . 0.0 111.16 -179.233 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.543 ' HD3' ' N ' ' A' ' 45' ' ' PHE . 11.3 Cg_exo -68.66 -19.83 41.29 Favored 'Trans proline' 0 N--CA 1.495 1.614 0 C-N-CA 123.018 2.479 . . . . 0.0 112.491 179.83 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 58.2 tt0 -54.24 -40.49 67.78 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.903 -179.002 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 31.6 tp10 -68.45 -32.25 72.13 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.825 -0.435 . . . . 0.0 109.825 179.637 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . 0.436 ' O ' ' OE1' ' A' ' 98' ' ' GLN . . . 116.62 -17.93 13.45 Favored Glycine 0 CA--C 1.521 0.431 0 N-CA-C 110.448 -1.061 . . . . 0.0 110.448 -179.27 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' THR . . . . . 0.514 ' C ' ' HE1' ' A' ' 44' ' ' TRP . 6.2 t -56.38 159.49 3.6 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 109.284 -0.635 . . . . 0.0 109.284 179.411 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.454 ' HA ' ' NE1' ' A' ' 44' ' ' TRP . 0.7 OUTLIER -128.28 132.29 68.39 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.488 0 CA-C-O 120.743 0.306 . . . . 0.0 110.49 -179.977 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 48.3 t0 -123.18 117.69 25.94 Favored 'General case' 0 C--N 1.312 -1.039 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.9 177.88 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 25.3 mm -72.95 -43.4 59.3 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.882 -179.561 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -62.74 -55.62 24.99 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 121.241 0.543 . . . . 0.0 111.168 -178.374 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 91.2 mtt180 -64.48 -34.92 79.35 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.305 179.201 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 33.6 t-105 -55.85 -37.29 68.54 Favored 'General case' 0 C--N 1.332 -0.18 0 N-CA-C 109.698 -0.482 . . . . 0.0 109.698 179.394 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.62 ' NH2' ' CH2' ' A' ' 83' ' ' TRP . 63.7 ttm-85 -67.12 -36.97 83.05 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.003 179.126 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 44.3 ttm180 -59.65 -46.22 89.68 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 120.766 -0.373 . . . . 0.0 111.427 -179.509 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 3.1 p -69.08 -36.56 74.08 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 CA-C-O 120.774 0.321 . . . . 0.0 110.436 179.266 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -67.15 -50.53 45.04 Favored Glycine 0 CA--C 1.526 0.754 0 N-CA-C 111.296 -0.722 . . . . 0.0 111.296 179.827 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -63.83 -40.65 97.11 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.624 0.25 . . . . 0.0 111.207 -179.744 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 3.1 m -58.68 -51.56 69.43 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.993 0.425 . . . . 0.0 110.694 -179.464 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . 0.494 ' CE2' ' CE2' ' A' ' 37' ' ' PHE . 14.1 m-85 -68.3 -33.79 74.97 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.362 179.386 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 72.2 tp60 -60.1 -45.25 93.58 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.639 -179.755 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 16.3 t0 -60.63 -51.85 67.64 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.025 0.441 . . . . 0.0 110.603 179.971 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' TYR . . . . . 0.45 ' O ' ' OG1' ' A' ' 69' ' ' THR . 49.3 m-85 -63.71 -33.19 75.08 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.103 179.65 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 76.4 t80 -61.74 -40.43 95.06 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.105 179.703 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 98.5 m-20 -62.64 -38.11 88.97 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.065 -179.705 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.45 ' OG1' ' O ' ' A' ' 66' ' ' TYR . 43.5 p -47.23 -32.58 4.64 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 120.458 -0.497 . . . . 0.0 110.472 -179.084 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 60.2 m-85 -67.35 -38.35 84.7 Favored 'General case' 0 C--N 1.32 -0.69 0 C-N-CA 120.211 -0.596 . . . . 0.0 111.209 179.774 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . 0.421 ' H ' ' HD3' ' A' ' 72' ' ' PRO . . . 100.68 58.24 0.85 Allowed Glycine 0 CA--C 1.528 0.866 0 N-CA-C 110.715 -0.954 . . . . 0.0 110.715 -179.37 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . 0.421 ' HD3' ' H ' ' A' ' 71' ' ' GLY . 66.4 Cg_endo -76.36 116.64 4.38 Favored 'Trans proline' 0 C--N 1.31 -1.454 0 C-N-CA 122.781 2.321 . . . . 0.0 111.59 -179.941 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 79.4 tt0 -85.18 -21.23 29.26 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.248 -179.8 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.647 ' CD ' ' H ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -98.44 -29.14 13.29 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.867 -0.606 . . . . 0.0 112.392 -179.765 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.497 ' H ' ' HD3' ' A' ' 74' ' ' LYS . 24.4 t 39.3 92.68 0.05 OUTLIER Pre-proline 0 C--N 1.331 -0.231 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.736 -178.827 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -58.07 125.52 18.81 Favored 'Trans proline' 0 C--N 1.316 -1.169 0 C-N-CA 121.113 1.209 . . . . 0.0 111.049 179.792 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . 0.443 ' O ' ' N ' ' A' ' 80' ' ' PHE . 96.0 t -84.23 -16.24 10.82 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.618 179.452 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 36.4 p -40.68 -27.07 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.637 -178.688 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . 0.426 ' N ' ' O ' ' A' ' 77' ' ' VAL . . . -59.92 -42.47 94.0 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.031 0.443 . . . . 0.0 110.313 179.648 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . 0.475 ' CZ ' ' OD1' ' A' ' 84' ' ' ASN . 55.4 t80 -61.34 -41.54 97.21 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.54 179.682 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 17.9 m -58.05 -43.53 86.91 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.905 -179.215 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 6.4 m-85 -58.65 -53.63 56.16 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.916 0.389 . . . . 0.0 111.298 -179.504 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' TRP . . . . . 0.62 ' CH2' ' NH2' ' A' ' 57' ' ' ARG . 15.2 t90 -59.58 -38.43 81.15 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.103 179.966 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . 0.475 ' OD1' ' CZ ' ' A' ' 80' ' ' PHE . 5.3 m120 -61.55 -44.46 97.0 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 120.67 -0.412 . . . . 0.0 110.796 -179.611 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 53.9 tp -71.47 -53.72 13.0 Favored 'General case' 0 C--O 1.218 -0.575 0 C-N-CA 120.343 -0.543 . . . . 0.0 110.119 179.511 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -58.9 -24.85 27.67 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 C-N-CA 120.8 -0.36 . . . . 0.0 110.883 179.763 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 70.0 tttt -67.97 -49.68 60.26 Favored 'General case' 0 C--N 1.313 -1.0 0 C-N-CA 120.351 -0.54 . . . . 0.0 110.144 179.647 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.2 pp20? -79.97 -20.57 45.23 Favored 'General case' 0 C--N 1.32 -0.682 0 C-N-CA 120.321 -0.552 . . . . 0.0 110.366 -179.883 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 14.0 tp -62.19 -44.87 95.63 Favored 'General case' 0 N--CA 1.445 -0.705 0 C-N-CA 120.338 -0.545 . . . . 0.0 109.879 179.918 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -64.16 -43.42 97.38 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.228 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.936 179.57 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 99.4 m-20 -43.74 -37.51 2.72 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.025 -178.545 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -47.36 144.09 3.09 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 120.72 -0.392 . . . . 0.0 110.499 179.629 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 89.0 tttt -71.91 -49.16 40.21 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.874 0.369 . . . . 0.0 111.207 -179.662 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -108.31 54.21 0.67 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.583 -179.286 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 11.5 t -45.21 -73.88 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.242 -179.159 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' ASN . . . . . 0.408 ' OD1' ' N ' ' A' ' 96' ' ' ASN . 0.0 OUTLIER -153.42 160.5 30.87 Favored Pre-proline 0 C--N 1.325 -0.496 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.598 -179.965 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -59.31 -13.35 19.79 Favored 'Trans proline' 0 C--N 1.306 -1.659 0 C-N-CA 122.672 2.248 . . . . 0.0 111.87 179.063 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . 0.436 ' OE1' ' O ' ' A' ' 49' ' ' GLY . 9.5 pt20 . . . . . 0 C--N 1.324 -0.526 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.89 -179.962 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 65.0 p . . . . . 0 N--CA 1.458 -0.073 0 CA-C-O 120.72 0.295 . . . . 0.0 110.584 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 85.4 mt-10 -137.13 179.4 6.41 Favored 'General case' 0 CA--C 1.52 -0.206 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.29 179.974 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 108' ' ' GLU . . . . . 0.526 ' C ' ' H ' ' A' ' 110' ' ' LEU . 95.4 mt-10 -105.62 128.55 53.7 Favored 'General case' 0 CA--C 1.513 -0.463 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.003 179.198 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 44.8 pt -50.16 -12.18 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-N 115.938 -0.574 . . . . 0.0 109.962 179.805 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . 0.526 ' H ' ' C ' ' A' ' 108' ' ' GLU . 31.2 mt -65.51 -40.45 93.04 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.609 179.606 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . 0.417 ' O ' ' O ' ' A' ' 114' ' ' SER . 86.8 tttt -68.09 -19.35 64.84 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.991 179.828 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 6.3 t -57.25 -44.2 83.64 Favored 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 120.615 -0.434 . . . . 0.0 110.611 -179.263 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 10.1 m120 -64.06 -41.51 97.34 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.88 179.939 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 114' ' ' SER . . . . . 0.417 ' O ' ' O ' ' A' ' 111' ' ' LYS . 29.6 p -157.6 167.46 30.07 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.491 -179.695 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 86.8 mt-30 -40.96 -28.99 0.09 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.846 0.355 . . . . 0.0 110.887 -179.773 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 2.8 t -166.9 176.49 6.98 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.528 -179.759 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 63.4 t0 . . . . . 0 C--N 1.328 -0.329 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.305 -179.912 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . 0.406 ' C ' ' N ' ' A' ' 4' ' ' GLU . . . . . . . . 0 CA--C 1.526 0.765 0 N-CA-C 110.992 -0.843 . . . . 0.0 110.992 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 85.0 mt-30 -44.15 -23.29 0.09 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.977 0.417 . . . . 0.0 110.507 -179.853 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . 0.44 ' O ' ' N ' ' A' ' 7' ' ' GLN . 95.0 mt-10 -53.05 -20.95 4.0 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.77 179.799 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 27.3 tp -40.85 -35.67 0.54 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.413 -178.716 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 78.1 p -54.61 -40.68 69.13 Favored 'General case' 0 C--N 1.325 -0.481 0 C-N-CA 120.432 -0.507 . . . . 0.0 110.011 179.532 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . 0.44 ' N ' ' O ' ' A' ' 4' ' ' GLU . 76.7 mt-30 -64.66 -32.31 73.92 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.612 179.735 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 63.3 t-80 -57.37 -45.32 84.56 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 121.12 0.486 . . . . 0.0 109.851 -179.925 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -61.31 -41.69 97.41 Favored 'General case' 0 C--O 1.24 0.588 0 CA-C-O 121.265 0.555 . . . . 0.0 109.625 179.498 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.463 ' O ' ' N ' ' A' ' 14' ' ' GLN . 93.8 mtt-85 -65.13 -38.8 91.78 Favored 'General case' 0 C--O 1.212 -0.904 0 C-N-CA 119.983 -0.687 . . . . 0.0 109.253 179.632 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -52.59 -40.06 62.25 Favored 'General case' 0 C--N 1.32 -0.692 0 C-N-CA 120.194 -0.603 . . . . 0.0 110.451 -179.848 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 5.6 t -62.32 -53.83 42.3 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 C-N-CA 120.154 -0.618 . . . . 0.0 111.366 -179.808 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 91.4 mt-10 -79.22 -48.13 14.73 Favored 'General case' 0 N--CA 1.466 0.356 0 C-N-CA 120.104 -0.639 . . . . 0.0 111.907 -179.258 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . 0.463 ' N ' ' O ' ' A' ' 10' ' ' ARG . 70.5 tp60 -49.34 -55.74 11.86 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.056 -179.461 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.02 -47.66 83.75 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.85 -0.426 . . . . 0.0 109.85 -179.629 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 92.4 mttt -55.46 -32.06 62.47 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 120.728 -0.389 . . . . 0.0 110.206 179.217 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 83.8 mt-30 -77.98 -36.58 48.78 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.512 178.967 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -56.7 -32.08 65.11 Favored 'General case' 0 C--O 1.226 -0.165 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.019 -179.907 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.463 ' O ' ' N ' ' A' ' 22' ' ' ARG . 3.5 mt -85.49 -37.42 19.72 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.248 0.547 . . . . 0.0 109.939 178.826 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 64.6 tttm -42.88 -45.62 5.01 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.447 -178.944 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' THR . . . . . 0.572 ' C ' ' H ' ' A' ' 23' ' ' GLY . 0.5 OUTLIER -68.39 -30.67 69.64 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.708 179.895 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.463 ' N ' ' O ' ' A' ' 19' ' ' LEU . 86.8 mmt-85 -69.81 24.06 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.634 -179.778 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . 0.572 ' H ' ' C ' ' A' ' 21' ' ' THR . . . 82.4 17.09 69.68 Favored Glycine 0 N--CA 1.468 0.83 0 N-CA-C 110.994 -0.842 . . . . 0.0 110.994 179.606 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.441 ' CG1' ' N ' ' A' ' 25' ' ' LYS . 26.2 t -105.5 169.03 2.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-O 120.742 0.306 . . . . 0.0 110.599 -179.93 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.441 ' N ' ' CG1' ' A' ' 24' ' ' VAL . 98.7 mttt -137.98 133.56 33.8 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.162 179.167 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 3.7 m -124.19 129.6 74.02 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.349 0 CA-C-O 120.558 0.218 . . . . 0.0 110.666 -179.977 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.456 ' HG2' ' H ' ' A' ' 28' ' ' TYR . 19.0 ttmt -111.35 162.12 15.36 Favored 'General case' 0 CA--C 1.529 0.136 0 N-CA-C 110.253 -0.277 . . . . 0.0 110.253 179.628 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . 0.456 ' H ' ' HG2' ' A' ' 27' ' ' LYS . 97.7 m-85 -51.22 -30.44 17.36 Favored 'General case' 0 C--O 1.238 0.482 0 CA-C-O 121.257 0.551 . . . . 0.0 110.017 179.228 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -57.24 -23.25 46.79 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.21 179.434 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.415 ' O ' ' CB ' ' A' ' 34' ' ' PHE . 87.8 m-20 -61.0 -47.43 86.47 Favored 'General case' 0 C--O 1.22 -0.496 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.47 -179.44 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.486 ' O ' ' CB ' ' A' ' 35' ' ' PHE . 5.6 mp -65.68 -40.35 92.28 Favored 'General case' 0 C--O 1.216 -0.681 0 C-N-CA 120.769 -0.372 . . . . 0.0 110.277 179.373 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 41.5 mt -58.21 -45.39 87.74 Favored 'General case' 0 C--N 1.313 -0.99 0 C-N-CA 119.429 -0.908 . . . . 0.0 111.164 -178.381 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.597 ' NZ ' ' CZ ' ' A' ' 37' ' ' PHE . 64.8 tttm -86.0 -48.49 8.62 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 121.072 0.463 . . . . 0.0 111.802 -179.222 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . 0.415 ' CB ' ' O ' ' A' ' 30' ' ' ASP . 60.2 t80 -61.1 -49.01 79.03 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.844 -179.0 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.486 ' CB ' ' O ' ' A' ' 31' ' ' LEU . 13.8 t80 -63.17 -46.62 86.27 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.576 -179.639 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 99.1 m-20 -64.48 -34.39 78.09 Favored 'General case' 0 C--N 1.341 0.227 0 CA-C-O 120.862 0.363 . . . . 0.0 110.965 -179.668 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.597 ' CZ ' ' NZ ' ' A' ' 33' ' ' LYS . 1.6 m-85 -59.35 -48.02 83.23 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.114 -179.597 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . 0.575 ' O ' ' N ' ' A' ' 42' ' ' CYS . 14.8 m -74.81 -36.35 39.39 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.68 179.878 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -55.54 -27.7 50.5 Favored 'General case' 0 C--N 1.322 -0.606 0 C-N-CA 120.733 -0.387 . . . . 0.0 110.15 -179.792 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 85.0 m-20 -54.1 -62.27 1.76 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.797 -179.719 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' THR . . . . . 0.44 ' C ' ' SG ' ' A' ' 42' ' ' CYS . 7.8 p -114.33 -27.37 7.62 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 120.864 0.364 . . . . 0.0 111.392 -179.801 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . 0.575 ' N ' ' O ' ' A' ' 38' ' ' VAL . 2.3 m 71.46 55.57 0.4 Allowed Pre-proline 0 C--N 1.326 -0.436 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.468 -179.151 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . 0.556 ' C ' ' H ' ' A' ' 45' ' ' PHE . 73.0 Cg_endo -77.18 -37.32 1.08 Allowed 'Trans proline' 0 N--CA 1.494 1.512 0 C-N-CA 122.753 2.302 . . . . 0.0 113.054 -179.536 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . 0.639 ' HE1' ' H ' ' A' ' 52' ' ' ASP . 0.0 OUTLIER -62.83 4.68 0.16 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.787 -179.974 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 0.556 ' H ' ' C ' ' A' ' 43' ' ' PRO . 0.2 OUTLIER 55.17 53.54 9.19 Favored Pre-proline 0 CA--C 1.539 0.533 0 CA-C-O 121.49 0.662 . . . . 0.0 110.233 -178.85 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.508 ' HD3' ' N ' ' A' ' 45' ' ' PHE . 48.0 Cg_exo -52.46 -28.93 37.73 Favored 'Trans proline' 0 N--CA 1.493 1.453 0 C-N-CA 122.09 1.86 . . . . 0.0 111.84 179.327 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -70.45 -42.87 70.91 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.132 -179.44 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 14.1 tt0 -84.71 -15.22 45.97 Favored 'General case' 0 N--CA 1.465 0.305 0 C-N-CA 120.687 -0.405 . . . . 0.0 109.978 -179.69 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 63.26 56.86 17.74 Favored Glycine 0 C--O 1.229 -0.181 0 N-CA-C 110.142 -1.183 . . . . 0.0 110.142 -179.947 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' THR . . . . . 0.512 ' OG1' ' NE2' ' A' ' 98' ' ' GLN . 6.5 t -121.11 165.88 14.72 Favored 'General case' 0 C--N 1.327 -0.397 0 O-C-N 123.586 0.227 . . . . 0.0 110.785 -179.295 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.54 ' H ' HE22 ' A' ' 98' ' ' GLN . 1.1 mt -101.24 137.95 27.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 N-CA-C 109.688 -0.486 . . . . 0.0 109.688 179.522 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . 0.639 ' H ' ' HE1' ' A' ' 44' ' ' TRP . 20.0 m-20 -115.05 120.43 39.83 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.279 179.836 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 23.2 mm -94.69 -56.39 5.25 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.904 179.147 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 99.8 mttt -78.44 -48.33 15.66 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.226 -179.733 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 83.0 mtp180 -60.19 -32.92 71.54 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.091 -179.844 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' TRP . . . . . 0.525 ' CE3' ' CZ3' ' A' ' 44' ' ' TRP . 17.2 t-105 -62.16 -39.24 91.98 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-O 120.998 0.428 . . . . 0.0 110.536 179.437 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 63.5 ttm-85 -62.43 -38.11 88.47 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.325 179.849 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . 0.499 ' O ' ' SG ' ' A' ' 62' ' ' CYS . 61.6 ttt85 -59.69 -56.65 19.14 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 120.63 -0.428 . . . . 0.0 110.909 -179.36 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 6.6 p -66.7 -42.79 90.09 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.552 0 CA-C-O 120.803 0.335 . . . . 0.0 111.049 -179.865 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . 0.427 ' O ' ' CB ' ' A' ' 64' ' ' GLN . . . -63.34 -46.74 92.11 Favored Glycine 0 C--O 1.222 -0.636 0 N-CA-C 111.681 -0.568 . . . . 0.0 111.681 -179.259 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 66.7 t0 -61.0 -36.89 80.66 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.574 0.226 . . . . 0.0 110.948 -179.444 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' CYS . . . . . 0.499 ' SG ' ' O ' ' A' ' 58' ' ' ARG . 71.3 m -61.03 -64.83 0.82 Allowed 'General case' 0 C--N 1.325 -0.468 0 C-N-CA 120.712 -0.395 . . . . 0.0 111.304 -179.674 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 73.3 m-85 -64.77 -43.58 92.79 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.334 -0.393 . . . . 0.0 111.441 -179.666 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . 0.427 ' CB ' ' O ' ' A' ' 60' ' ' GLY . 53.0 tt0 -59.45 -40.7 87.7 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.768 -179.394 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 18.9 t0 -58.09 -55.4 35.47 Favored 'General case' 0 C--N 1.323 -0.548 0 C-N-CA 120.65 -0.42 . . . . 0.0 110.853 -179.885 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 61.9 m-85 -66.27 -38.89 88.85 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 120.617 -0.433 . . . . 0.0 110.868 179.89 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . 0.442 ' O ' ' N ' ' A' ' 71' ' ' GLY . 59.9 t80 -58.99 -42.34 89.8 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.533 -179.496 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . 0.406 ' CG ' ' O ' ' A' ' 64' ' ' GLN . 23.5 m-20 -62.99 -42.74 99.93 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.225 -179.015 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 10.1 p -77.33 -18.92 57.06 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 120.609 -0.436 . . . . 0.0 109.958 -179.575 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 40.5 m-85 -113.41 16.47 18.89 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.797 179.715 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . 0.442 ' N ' ' O ' ' A' ' 67' ' ' TYR . . . -154.16 -109.76 0.36 Allowed Glycine 0 CA--C 1.535 1.329 0 C-N-CA 120.594 -0.813 . . . . 0.0 111.133 -179.875 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -74.34 144.82 33.34 Favored 'Trans proline' 0 N--CA 1.492 1.386 0 C-N-CA 121.906 1.738 . . . . 0.0 113.296 -179.432 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 84.7 tt0 -85.43 -43.92 13.2 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.718 -0.673 . . . . 0.0 110.659 179.773 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.564 ' CD ' ' H ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -87.21 -18.13 31.03 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.984 -179.83 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.424 ' H ' ' HD3' ' A' ' 74' ' ' LYS . 99.6 t 57.22 114.46 0.02 OUTLIER Pre-proline 0 N--CA 1.448 -0.571 0 CA-C-N 115.846 -0.616 . . . . 0.0 111.5 -179.465 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_exo -53.23 128.8 30.59 Favored 'Trans proline' 0 N--CA 1.491 1.337 0 C-N-CA 121.312 1.342 . . . . 0.0 111.58 179.847 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 42.5 t -82.53 -7.81 10.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.59 179.483 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 75.4 p -48.21 -23.57 0.91 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.957 0.408 . . . . 0.0 110.172 -179.916 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.72 -36.57 84.73 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.797 179.461 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 -58.33 -34.59 70.78 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.119 179.934 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 49.5 m -59.32 -40.59 86.76 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.352 179.573 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 11.8 m-85 -60.97 -49.58 76.85 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 120.793 -0.363 . . . . 0.0 111.022 179.826 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' TRP . . . . . 0.491 ' CD1' ' N ' ' A' ' 83' ' ' TRP . 21.9 m0 -58.6 -35.34 72.28 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.508 -179.756 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 77.5 m-20 -63.49 -46.52 85.74 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 120.618 -0.433 . . . . 0.0 110.758 179.727 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 35.1 tp -71.24 -53.32 14.77 Favored 'General case' 0 C--O 1.219 -0.501 0 C-N-CA 120.486 -0.486 . . . . 0.0 110.274 179.344 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -56.85 -27.51 26.43 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-O 120.863 0.363 . . . . 0.0 110.466 -179.988 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 34.8 tttm -65.8 -49.68 67.41 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.72 -179.599 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . 0.536 ' OE1' ' NZ ' ' A' ' 92' ' ' LYS . 1.1 pp20? -80.08 -20.1 45.91 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.794 -179.64 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.48 -45.06 94.77 Favored 'General case' 0 N--CA 1.444 -0.753 0 C-N-CA 120.263 -0.575 . . . . 0.0 110.427 -179.104 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 3.4 mt -64.79 -43.19 96.46 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.153 0 C-N-CA 120.504 -0.478 . . . . 0.0 109.955 -179.831 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 88.7 m-20 -44.31 -42.05 6.45 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.604 -178.487 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . 0.536 ' NZ ' ' OE1' ' A' ' 88' ' ' GLU . 51.2 mttp -57.14 124.96 20.58 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.025 0.441 . . . . 0.0 110.773 179.923 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -71.43 -38.28 71.37 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.436 179.187 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 93.0 mt-10 -81.72 50.25 1.48 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.915 -179.395 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.511 ' CG1' ' N ' ' A' ' 96' ' ' ASN . 13.1 t -80.61 162.35 3.67 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.057 179.719 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' ASN . . . . . 0.602 ' O ' ' N ' ' A' ' 98' ' ' GLN . 0.0 OUTLIER -40.87 166.35 0.06 OUTLIER Pre-proline 0 C--N 1.328 -0.362 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.324 179.95 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 77.3 Cg_exo -40.19 -14.05 0.03 OUTLIER 'Trans proline' 0 C--N 1.313 -1.335 0 C-N-CA 122.864 2.376 . . . . 0.0 112.695 179.327 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . 0.602 ' N ' ' O ' ' A' ' 96' ' ' ASN . 4.8 tt0 . . . . . 0 C--N 1.321 -0.632 0 C-N-CA 120.742 -0.383 . . . . 0.0 110.056 179.281 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 30.7 p . . . . . 0 N--CA 1.461 0.121 0 CA-C-O 120.753 0.311 . . . . 0.0 110.325 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -99.43 147.0 25.72 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.538 -179.846 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 108' ' ' GLU . . . . . 0.45 ' C ' ' H ' ' A' ' 110' ' ' LEU . 79.6 mm-40 -79.57 129.69 34.7 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.15 -0.477 . . . . 0.0 109.978 179.499 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . 0.443 ' O ' ' OG ' ' A' ' 112' ' ' SER . 39.1 pt -54.29 -12.1 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 115.922 -0.581 . . . . 0.0 109.846 -179.887 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . 0.45 ' H ' ' C ' ' A' ' 108' ' ' GLU . 79.1 mt -73.47 -39.08 65.19 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.429 179.278 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -65.64 -33.73 76.56 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.424 -179.884 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 112' ' ' SER . . . . . 0.534 ' HG ' ' N ' ' A' ' 113' ' ' ASN . 94.0 p -59.74 -44.5 93.76 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.968 -179.304 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 113' ' ' ASN . . . . . 0.534 ' N ' ' HG ' ' A' ' 112' ' ' SER . 40.6 t30 -64.77 -41.74 95.64 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.192 179.944 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 17.1 p -167.81 157.24 9.92 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.514 179.498 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 86.7 mt-30 -99.75 10.34 41.49 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.835 0.35 . . . . 0.0 110.495 179.764 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 43.7 p -65.02 -36.75 85.39 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.471 -179.901 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 91.0 m-20 . . . . . 0 C--N 1.329 -0.323 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.528 179.962 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.743 0 N-CA-C 111.2 -0.76 . . . . 0.0 111.2 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 97.2 mm-40 -60.01 -21.58 61.49 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.911 0.386 . . . . 0.0 110.315 -179.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . 0.513 ' OE2' ' H62' ' A' ' 201' ' ' MYR . 82.8 tt0 -56.23 -22.62 30.68 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.468 179.705 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 34.2 tp -41.63 -28.54 0.14 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.373 -179.681 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 78.2 p -57.73 -36.97 72.76 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 120.662 -0.415 . . . . 0.0 110.112 -179.762 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 88.0 mt-30 -64.28 -33.04 74.92 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.573 179.431 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 58.5 t-80 -61.85 -45.62 92.99 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.596 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 98.1 mt-10 -59.84 -44.84 93.88 Favored 'General case' 0 C--O 1.243 0.718 0 CA-C-O 121.243 0.544 . . . . 0.0 110.111 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.408 ' O ' ' N ' ' A' ' 14' ' ' GLN . 77.9 mmt-85 -62.27 -33.47 74.69 Favored 'General case' 0 C--O 1.214 -0.813 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 179.235 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.64 ' CD2' H121 ' A' ' 201' ' ' MYR . 40.7 t80 -59.96 -37.29 79.14 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 120.548 -0.461 . . . . 0.0 110.353 -179.762 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 3.4 t -61.62 -48.28 89.45 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 C-N-CA 119.75 -0.78 . . . . 0.0 110.888 179.885 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 98.4 mt-10 -82.02 -46.85 13.38 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 120.038 -0.665 . . . . 0.0 111.66 -179.554 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . 0.408 ' N ' ' O ' ' A' ' 10' ' ' ARG . 71.2 tp60 -58.3 -51.38 70.04 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.89 -0.595 . . . . 0.0 111.201 -179.131 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -63.48 -46.12 87.65 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-O 120.991 0.424 . . . . 0.0 109.933 179.875 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 91.8 mttt -58.32 -35.54 72.02 Favored 'General case' 0 C--N 1.329 -0.284 0 O-C-N 121.962 -0.461 . . . . 0.0 110.478 179.359 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 93.2 mt-30 -71.91 -36.25 69.94 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.369 178.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.16 -38.68 80.31 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.087 179.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.5 mt -79.88 -28.01 39.96 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.965 0.412 . . . . 0.0 110.581 179.293 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 65.1 tttm -55.29 -39.81 70.31 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.243 -179.337 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 1.5 t -74.13 -18.18 60.83 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.877 -179.821 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 62.8 mmt-85 -77.22 -0.19 24.28 Favored 'General case' 0 C--N 1.331 -0.2 0 C-N-CA 120.672 -0.411 . . . . 0.0 110.202 179.544 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 106.67 13.57 21.84 Favored Glycine 0 N--CA 1.466 0.7 0 N-CA-C 110.884 -0.886 . . . . 0.0 110.884 -179.554 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 17.9 t -100.86 168.74 1.83 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 N-CA-C 110.441 -0.207 . . . . 0.0 110.441 -179.838 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -125.54 137.9 53.95 Favored 'General case' 0 C--O 1.233 0.209 0 N-CA-C 110.175 -0.306 . . . . 0.0 110.175 179.591 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 3.2 m -135.63 107.12 6.9 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.374 0 CA-C-O 120.761 0.315 . . . . 0.0 110.801 -179.651 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.465 ' O ' ' N ' ' A' ' 30' ' ' ASP . 27.8 pttt -108.55 165.83 11.23 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-O 120.75 0.309 . . . . 0.0 110.527 179.979 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 81.6 t80 -47.97 -38.52 17.02 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-O 121.04 0.447 . . . . 0.0 109.884 179.442 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -56.98 -23.08 43.26 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.021 -0.536 . . . . 0.0 109.984 179.041 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.465 ' N ' ' O ' ' A' ' 27' ' ' LYS . 58.2 t0 -62.26 -44.36 96.72 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.559 -179.594 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.518 ' O ' ' CB ' ' A' ' 35' ' ' PHE . 5.6 mp -67.47 -41.29 84.87 Favored 'General case' 0 C--O 1.213 -0.828 0 CA-C-O 121.164 0.507 . . . . 0.0 109.694 179.184 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 49.4 mt -56.97 -44.57 82.77 Favored 'General case' 0 C--N 1.313 -0.987 0 C-N-CA 119.715 -0.794 . . . . 0.0 111.26 -178.605 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -84.31 -50.86 7.45 Favored 'General case' 0 C--N 1.32 -0.702 0 C-N-CA 120.666 -0.413 . . . . 0.0 111.617 -179.013 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 59.7 t80 -63.48 -48.27 78.35 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.47 -178.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.518 ' CB ' ' O ' ' A' ' 31' ' ' LEU . 17.4 t80 -61.97 -44.47 96.68 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 110.009 -0.367 . . . . 0.0 110.009 -179.442 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 92.4 m-20 -70.39 -37.96 74.6 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 120.717 -0.393 . . . . 0.0 111.683 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.472 ' CE2' ' CE2' ' A' ' 63' ' ' PHE . 2.7 m-85 -62.34 -50.46 71.52 Favored 'General case' 0 N--CA 1.464 0.253 0 N-CA-C 112.116 0.413 . . . . 0.0 112.116 -178.629 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.533 ' O ' ' N ' ' A' ' 42' ' ' CYS . 13.9 m -68.17 -42.58 84.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 C-N-CA 120.541 -0.463 . . . . 0.0 110.493 -179.599 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 43.3 mmtt -64.24 -28.5 69.77 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.069 179.872 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 67.3 t0 -54.2 -49.24 69.84 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 120.725 -0.39 . . . . 0.0 110.542 -179.309 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' THR . . . . . 0.509 ' O ' ' SG ' ' A' ' 42' ' ' CYS . 12.1 p -113.38 -2.77 13.89 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.026 179.766 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . 0.533 ' N ' ' O ' ' A' ' 38' ' ' VAL . 29.8 p 37.72 57.6 4.48 Favored Pre-proline 0 N--CA 1.465 0.3 0 CA-C-N 116.484 -0.325 . . . . 0.0 110.553 -179.223 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 69.7 Cg_endo -76.54 -33.23 3.26 Favored 'Trans proline' 0 C--N 1.31 -1.461 0 C-N-CA 122.538 2.159 . . . . 0.0 112.806 -179.062 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . 0.594 ' HE1' ' H ' ' A' ' 52' ' ' ASP . 0.0 OUTLIER -75.94 2.36 12.78 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.711 -179.775 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.514 ' C ' ' H ' ' A' ' 47' ' ' GLN . 16.7 m-85 50.14 51.41 10.64 Favored Pre-proline 0 C--N 1.327 -0.397 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.02 -179.786 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.489 ' CD ' ' N ' ' A' ' 45' ' ' PHE . 10.1 Cg_endo -51.14 -7.24 0.14 Allowed 'Trans proline' 0 C--N 1.308 -1.587 0 C-N-CA 122.805 2.337 . . . . 0.0 111.973 -179.783 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.514 ' H ' ' C ' ' A' ' 45' ' ' PHE . 99.5 mm-40 -62.21 -52.8 62.31 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.627 -179.576 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.465 ' O ' ' H52' ' A' ' 201' ' ' MYR . 55.1 tt0 -88.3 -12.86 42.31 Favored 'General case' 0 N--CA 1.466 0.326 0 C-N-CA 120.569 -0.452 . . . . 0.0 110.387 179.713 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . 0.626 ' O ' ' H72' ' A' ' 201' ' ' MYR . . . 71.73 69.05 1.46 Allowed Glycine 0 CA--C 1.524 0.651 0 N-CA-C 110.486 -1.045 . . . . 0.0 110.486 -179.504 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 3.0 t -136.39 161.31 36.16 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.712 0.291 . . . . 0.0 110.945 -179.249 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.1 mt -99.92 139.75 20.75 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.248 0 CA-C-O 120.98 0.419 . . . . 0.0 110.29 179.428 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . 0.594 ' H ' ' HE1' ' A' ' 44' ' ' TRP . 4.9 t70 -125.44 120.83 32.08 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.588 -0.733 . . . . 0.0 109.648 179.405 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 20.1 mm -88.04 -44.74 15.87 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.834 -179.26 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 65.4 tttm -66.92 -51.45 55.15 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-O 121.077 0.465 . . . . 0.0 111.618 -179.718 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 79.3 mmt-85 -62.09 -32.52 73.08 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.807 -0.442 . . . . 0.0 109.807 -179.665 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' TRP . . . . . 0.594 ' CE3' ' CH2' ' A' ' 44' ' ' TRP . 29.9 t-105 -57.59 -39.72 77.42 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 120.564 -0.454 . . . . 0.0 110.097 -179.897 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -65.22 -37.81 88.44 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.981 -0.554 . . . . 0.0 109.944 179.544 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . 0.46 ' O ' ' SG ' ' A' ' 62' ' ' CYS . 68.6 ttt180 -61.24 -53.35 58.02 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 120.67 -0.412 . . . . 0.0 111.144 -179.723 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 3.5 p -64.46 -43.87 96.97 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.507 0 CA-C-O 120.721 0.296 . . . . 0.0 110.274 179.695 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -62.65 -40.4 99.12 Favored Glycine 0 CA--C 1.524 0.645 0 N-CA-C 111.047 -0.821 . . . . 0.0 111.047 179.741 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . 0.43 ' O ' ' OD1' ' A' ' 61' ' ' ASP . 67.9 t0 -64.17 -37.8 88.76 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.742 0.306 . . . . 0.0 110.929 -179.688 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' CYS . . . . . 0.46 ' SG ' ' O ' ' A' ' 58' ' ' ARG . 67.5 m -60.55 -53.08 61.77 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.911 -179.367 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . 0.472 ' CE2' ' CE2' ' A' ' 37' ' ' PHE . 44.3 m-85 -68.97 -37.03 78.55 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.725 179.457 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 69.5 tp60 -59.71 -43.34 94.16 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.867 0.365 . . . . 0.0 110.358 -179.805 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 18.4 t0 -60.56 -50.77 72.21 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.568 179.707 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' TYR . . . . . 0.465 ' O ' ' OG1' ' A' ' 69' ' ' THR . 70.9 t80 -66.36 -26.16 67.14 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.113 179.749 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 59.2 t80 -73.36 -42.08 62.65 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.612 179.882 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . 0.473 ' O ' ' N ' ' A' ' 71' ' ' GLY . 94.0 m-20 -63.35 -37.1 85.97 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.025 -179.14 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.465 ' OG1' ' O ' ' A' ' 66' ' ' TYR . 40.5 p -48.35 -17.08 0.12 Allowed 'General case' 0 N--CA 1.464 0.256 0 C-N-CA 120.786 -0.366 . . . . 0.0 110.664 -179.593 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . 0.418 ' N ' ' C ' ' A' ' 68' ' ' ASN . 90.3 m-85 -95.59 15.47 19.77 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 120.806 -0.358 . . . . 0.0 111.047 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . 0.473 ' N ' ' O ' ' A' ' 68' ' ' ASN . . . 38.0 59.18 1.46 Allowed Glycine 0 N--CA 1.471 1.018 0 N-CA-C 110.976 -0.85 . . . . 0.0 110.976 -179.451 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 69.4 Cg_endo -80.62 125.42 5.57 Favored 'Trans proline' 0 C--N 1.309 -1.5 0 C-N-CA 122.431 2.087 . . . . 0.0 112.223 -179.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 77.5 mm-40 -85.73 -39.2 17.43 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.885 179.771 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.641 ' CD ' ' H ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -62.58 -41.29 98.84 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.424 -0.807 . . . . 0.0 111.646 -179.752 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.452 ' C ' ' O ' ' A' ' 74' ' ' LYS . 29.0 t 31.77 93.05 0.05 OUTLIER Pre-proline 0 N--CA 1.463 0.212 0 O-C-N 123.296 0.373 . . . . 0.0 111.194 179.633 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 34.6 Cg_exo -55.63 125.62 19.73 Favored 'Trans proline' 0 C--N 1.311 -1.441 0 C-N-CA 121.442 1.428 . . . . 0.0 111.645 -179.073 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . 0.448 ' O ' ' N ' ' A' ' 80' ' ' PHE . 60.5 t -82.8 -19.61 10.09 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.452 179.576 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 10.3 p -41.56 -28.26 0.12 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.328 -179.187 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . 0.407 ' N ' ' C ' ' A' ' 77' ' ' VAL . . . -59.78 -41.48 91.22 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.371 179.724 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . 0.448 ' N ' ' O ' ' A' ' 77' ' ' VAL . 3.2 m-85 -63.21 -40.27 97.01 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.672 179.701 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 43.5 m -59.1 -42.12 89.75 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.866 -179.77 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 5.6 m-85 -60.05 -51.23 70.55 Favored 'General case' 0 C--N 1.331 -0.22 0 C-N-CA 120.813 -0.355 . . . . 0.0 110.74 -179.736 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' TRP . . . . . . . . . . . . . 32.9 t90 -58.48 -38.52 77.78 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.536 179.565 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 92.8 m-20 -61.51 -44.18 97.52 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 120.652 -0.419 . . . . 0.0 110.529 -179.475 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 23.7 tp -72.98 -56.06 5.68 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 120.328 -0.549 . . . . 0.0 110.242 179.403 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -54.88 -25.56 15.85 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 CA-C-O 120.9 0.381 . . . . 0.0 110.364 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 64.4 tttt -67.19 -50.64 60.21 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.576 179.83 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . 0.442 ' O ' ' OE1' ' A' ' 88' ' ' GLU . 1.0 OUTLIER -80.42 -19.89 45.15 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.917 -179.473 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.31 -44.82 95.63 Favored 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 120.549 -0.461 . . . . 0.0 110.327 -179.346 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 3.4 mt -64.28 -43.27 97.18 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 C-N-CA 120.007 -0.677 . . . . 0.0 109.991 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -47.94 -40.24 21.57 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.405 -0.362 . . . . 0.0 110.445 -179.09 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 43.1 mttm -60.02 136.29 57.97 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.991 0.424 . . . . 0.0 110.841 179.821 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -90.27 -8.96 49.63 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.192 -179.811 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 42.2 tp10 -66.45 -31.62 72.49 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.894 -0.593 . . . . 0.0 110.442 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 21.2 t -41.7 135.48 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.298 -0.41 . . . . 0.0 109.902 -179.66 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' ASN . . . . . 0.491 ' O ' ' N ' ' A' ' 98' ' ' GLN . 0.9 OUTLIER -40.48 157.22 0.17 Allowed Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.07 -178.833 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 40.9 Cg_exo -45.62 -13.0 0.07 OUTLIER 'Trans proline' 0 N--CA 1.492 1.414 0 C-N-CA 122.432 2.088 . . . . 0.0 112.209 179.23 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . 0.491 ' N ' ' O ' ' A' ' 96' ' ' ASN . 1.9 pt20 -46.72 -23.74 0.46 Allowed 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.742 -179.436 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 72.5 t -63.61 -50.3 78.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.761 -179.399 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 95.8 mtp -78.78 -39.02 37.04 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.775 179.725 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . 0.403 ' O ' ' OE2' ' A' ' 48' ' ' GLU . . . -65.18 -33.46 76.07 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.781 -179.68 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -59.35 -15.73 18.21 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.555 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 90.8 t -63.79 -19.91 25.38 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.186 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.359 179.591 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -57.74 -37.7 74.07 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.43 -179.807 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 88.8 mt-30 -64.36 -40.31 95.59 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.474 179.882 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 98.7 m -62.79 -45.42 92.72 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.577 179.865 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 67.3 mm-40 -66.27 -163.38 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.139 -179.908 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . 0.524 ' C ' ' H ' ' A' ' 110' ' ' LEU . 97.4 mt-10 -106.73 129.12 54.66 Favored 'General case' 0 CA--C 1.516 -0.346 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.009 179.073 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 38.9 pt -50.42 -11.84 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-N 116.075 -0.511 . . . . 0.0 109.928 179.645 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.524 ' H ' ' C ' ' A' ' 108' ' ' GLU . 26.3 mt -64.41 -40.59 96.07 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.577 179.649 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -94.6 87.18 5.01 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.956 -179.895 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 50.2 m -63.24 -41.63 99.11 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.679 179.441 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 96.3 m-20 -137.18 -166.26 1.89 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.644 -179.565 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 77.8 p -64.02 -17.27 63.17 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.441 -179.832 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 84.4 mt-30 -56.13 -165.98 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.375 -179.915 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 77.0 p -83.34 -171.73 3.74 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.53 179.872 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . 0.424 ' OD1' ' N ' ' A' ' 117' ' ' ASP . 33.9 p-10 -63.34 -28.32 69.92 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.763 -179.894 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 95.6 mt -101.5 129.82 47.65 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.613 -179.847 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 17.0 pt-20 -88.33 139.3 30.63 Favored 'General case' 0 C--N 1.334 -0.075 0 CA-C-O 120.625 0.25 . . . . 0.0 110.502 179.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 98.0 m-70 -113.2 143.68 43.99 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.653 -179.901 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 99.5 m-70 -135.02 145.57 48.18 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.544 179.897 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 90.9 m-70 -62.17 -36.82 83.04 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.457 -179.938 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 62.5 m80 -64.4 -43.9 92.98 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.682 -179.872 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' HIS . . . . . . . . . . . . . 24.9 m170 -66.94 -40.75 87.65 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.567 179.915 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 82.0 t60 . . . . . 0 C--O 1.22 -0.481 0 CA-C-O 117.985 -1.007 . . . . 0.0 110.608 -179.931 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 201' ' ' MYR . . . . . 0.64 H121 ' CD2' ' A' ' 11' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.67 0 N-CA-C 110.972 -0.851 . . . . 0.0 110.972 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 99.4 mt-30 -64.97 -38.74 91.95 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.856 0.36 . . . . 0.0 110.601 179.857 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . 0.628 ' OE1' ' H51' ' A' ' 201' ' ' MYR . 83.7 tt0 -52.88 -22.88 6.03 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.523 179.995 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.416 ' HB2' ' H22' ' A' ' 201' ' ' MYR . 40.0 tp -42.12 -31.42 0.37 Allowed 'General case' 0 C--O 1.237 0.426 0 CA-C-O 121.016 0.436 . . . . 0.0 110.349 -179.625 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 70.4 m -56.34 -36.74 69.1 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.112 -0.495 . . . . 0.0 109.954 179.743 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . 0.4 ' N ' ' O ' ' A' ' 4' ' ' GLU . 57.6 tt0 -63.38 -34.82 78.56 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.586 179.537 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 73.6 t60 -60.29 -46.08 91.1 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.813 0.34 . . . . 0.0 110.277 -179.672 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 77.1 tt0 -61.17 -48.77 80.01 Favored 'General case' 0 C--O 1.244 0.804 0 CA-C-O 121.391 0.615 . . . . 0.0 110.288 179.552 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.412 ' O ' ' N ' ' A' ' 14' ' ' GLN . 85.9 mtm180 -62.47 -32.6 73.52 Favored 'General case' 0 C--O 1.213 -0.844 0 N-CA-C 108.624 -0.88 . . . . 0.0 108.624 179.462 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 26.4 t80 -58.68 -37.17 75.46 Favored 'General case' 0 C--N 1.324 -0.51 0 C-N-CA 120.41 -0.516 . . . . 0.0 110.186 -179.839 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 2.3 t -61.26 -50.69 79.41 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 C-N-CA 119.601 -0.84 . . . . 0.0 110.658 179.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 78.1 tt0 -81.66 -46.92 13.66 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 119.989 -0.684 . . . . 0.0 112.108 -179.215 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . 0.412 ' N ' ' O ' ' A' ' 10' ' ' ARG . 66.4 tp60 -57.61 -52.47 65.28 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.428 -179.018 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -63.31 -45.64 90.42 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 109.619 -0.512 . . . . 0.0 109.619 -179.693 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 87.7 mttt -57.25 -35.2 69.43 Favored 'General case' 0 C--N 1.332 -0.182 0 C-N-CA 120.511 -0.475 . . . . 0.0 110.365 179.36 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 81.6 mm-40 -71.07 -41.89 70.11 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.071 0.462 . . . . 0.0 110.616 178.988 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -54.21 -45.64 72.26 Favored 'General case' 0 C--O 1.223 -0.294 0 CA-C-N 116.02 -0.536 . . . . 0.0 109.641 179.931 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.444 ' O ' ' N ' ' A' ' 22' ' ' ARG . 4.7 mt -68.03 -35.23 77.92 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.888 0.375 . . . . 0.0 110.851 178.849 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 56.1 tttm -47.37 -37.57 11.45 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 -179.424 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' THR . . . . . 0.532 ' C ' ' H ' ' A' ' 23' ' ' GLY . 0.7 OUTLIER -64.56 -31.55 72.82 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.947 -0.569 . . . . 0.0 111.149 179.019 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.444 ' N ' ' O ' ' A' ' 19' ' ' LEU . 30.9 mmt-85 -73.16 21.3 0.08 Allowed 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 120.921 0.391 . . . . 0.0 110.761 -179.615 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . 0.532 ' H ' ' C ' ' A' ' 21' ' ' THR . . . 81.58 13.24 80.51 Favored Glycine 0 N--CA 1.466 0.652 0 N-CA-C 110.487 -1.045 . . . . 0.0 110.487 179.972 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 4.3 t -92.12 167.33 1.66 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 N-CA-C 110.082 -0.34 . . . . 0.0 110.082 179.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -129.52 134.49 47.8 Favored 'General case' 0 N--CA 1.455 -0.219 0 N-CA-C 110.149 -0.315 . . . . 0.0 110.149 179.64 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 2.6 m -132.03 105.7 10.04 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.371 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.141 179.927 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.455 ' O ' ' OD1' ' A' ' 30' ' ' ASP . 11.6 ttmt -107.99 162.08 14.35 Favored 'General case' 0 C--O 1.224 -0.276 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 179.822 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . 0.449 ' H ' ' HG2' ' A' ' 27' ' ' LYS . 93.6 m-85 -38.83 -33.33 0.11 Allowed 'General case' 0 C--O 1.235 0.334 0 CA-C-O 121.118 0.485 . . . . 0.0 110.823 179.837 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -52.62 -23.13 5.93 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.196 179.836 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.488 ' CG ' ' N ' ' A' ' 31' ' ' LEU . 21.6 p-10 -59.03 -54.19 49.87 Favored 'General case' 0 C--O 1.217 -0.646 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.763 -179.33 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.488 ' N ' ' CG ' ' A' ' 30' ' ' ASP . 0.5 OUTLIER -63.49 -40.07 96.12 Favored 'General case' 0 C--O 1.217 -0.619 0 C-N-CA 120.439 -0.504 . . . . 0.0 109.814 -179.724 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 45.7 mt -56.74 -50.21 72.93 Favored 'General case' 0 C--N 1.314 -0.959 0 C-N-CA 119.267 -0.973 . . . . 0.0 111.021 -178.76 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.415 ' O ' ' N ' ' A' ' 37' ' ' PHE . 88.1 tttt -85.54 -52.77 5.61 Favored 'General case' 0 C--N 1.32 -0.68 0 C-N-CA 120.317 -0.553 . . . . 0.0 112.031 -179.295 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . 0.462 ' CB ' ' O ' ' A' ' 30' ' ' ASP . 45.1 t80 -55.2 -47.8 74.76 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.027 -178.121 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.47 ' CB ' ' O ' ' A' ' 31' ' ' LEU . 14.7 t80 -61.2 -46.62 89.69 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 120.083 -0.647 . . . . 0.0 109.513 -179.794 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 98.1 m-20 -71.22 -23.65 62.05 Favored 'General case' 0 C--N 1.345 0.401 0 C-N-CA 120.511 -0.476 . . . . 0.0 111.404 179.949 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.415 ' N ' ' O ' ' A' ' 33' ' ' LYS . 7.5 t80 -61.28 -48.06 83.14 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.849 0.357 . . . . 0.0 110.403 -178.934 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.555 ' O ' ' N ' ' A' ' 42' ' ' CYS . 6.6 m -77.85 -30.68 16.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.387 179.343 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -55.96 -30.1 61.21 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.44 -0.504 . . . . 0.0 110.545 -179.41 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 65.0 t0 -55.37 -63.97 0.99 Allowed 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 120.699 -0.4 . . . . 0.0 111.805 -179.208 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' THR . . . . . 0.428 ' C ' ' SG ' ' A' ' 42' ' ' CYS . 17.0 p -116.27 -19.77 10.06 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-O 120.98 0.419 . . . . 0.0 111.481 -179.559 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . 0.555 ' N ' ' O ' ' A' ' 38' ' ' VAL . 1.7 m 65.84 58.48 1.14 Allowed Pre-proline 0 CA--C 1.537 0.443 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.625 -178.461 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . 0.493 ' HD3' ' N ' ' A' ' 42' ' ' CYS . 11.8 Cg_exo -70.23 -37.35 8.17 Favored 'Trans proline' 0 N--CA 1.498 1.783 0 C-N-CA 122.891 2.394 . . . . 0.0 112.889 -179.409 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . 0.746 ' HE1' ' H ' ' A' ' 52' ' ' ASP . 0.0 OUTLIER -75.91 15.29 0.55 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.455 -179.387 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.484 ' CE1' ' NE2' ' A' ' 105' ' ' GLN . 62.1 m-85 41.57 53.65 7.47 Favored Pre-proline 0 C--N 1.332 -0.188 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.027 -179.879 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.439 ' CD ' ' N ' ' A' ' 45' ' ' PHE . 9.8 Cg_endo -52.39 -9.62 0.61 Allowed 'Trans proline' 0 C--N 1.308 -1.569 0 C-N-CA 122.803 2.335 . . . . 0.0 112.077 -179.883 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.443 ' H ' ' C ' ' A' ' 45' ' ' PHE . 98.3 mm-40 -64.99 -52.81 54.11 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.255 179.729 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 46.7 tp10 -87.02 -51.26 6.12 Favored 'General case' 0 N--CA 1.466 0.357 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 178.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . 0.496 ' O ' ' H92' ' A' ' 201' ' ' MYR . . . 108.25 77.89 1.05 Allowed Glycine 0 CA--C 1.526 0.719 0 N-CA-C 109.619 -1.392 . . . . 0.0 109.619 -178.714 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 13.0 t -134.49 170.87 15.12 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 110.179 -0.304 . . . . 0.0 110.179 -179.106 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.414 ' HA ' H143 ' A' ' 201' ' ' MYR . 1.1 mt -101.95 137.63 29.08 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.283 0 CA-C-O 121.027 0.441 . . . . 0.0 109.952 178.977 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . 0.746 ' H ' ' HE1' ' A' ' 44' ' ' TRP . 11.7 m-20 -117.15 121.21 40.64 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.646 -0.706 . . . . 0.0 111.377 179.807 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.404 HD11 HG21 ' A' ' 53' ' ' ILE . 22.9 mm -94.86 -56.14 5.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.756 179.045 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 67.7 mttm -75.86 -48.37 21.73 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-O 121.105 0.479 . . . . 0.0 111.364 -179.856 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 74.6 mtp85 -60.27 -32.46 71.2 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.253 179.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' TRP . . . . . 0.454 ' CE3' ' CZ3' ' A' ' 44' ' ' TRP . 22.8 t-105 -59.8 -38.8 82.94 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.133 178.727 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 85.7 mtp180 -65.22 -36.18 83.35 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 120.51 -0.476 . . . . 0.0 110.406 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 94.5 mtt180 -59.82 -50.15 74.94 Favored 'General case' 0 N--CA 1.466 0.359 0 C-N-CA 120.25 -0.58 . . . . 0.0 111.579 -179.175 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 3.2 p -64.4 -43.74 97.05 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.508 0 CA-C-O 120.809 0.337 . . . . 0.0 110.141 179.717 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -64.0 -35.51 92.09 Favored Glycine 0 CA--C 1.524 0.65 0 N-CA-C 111.072 -0.811 . . . . 0.0 111.072 179.611 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 97.3 m-20 -63.6 -36.53 84.1 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.659 0.266 . . . . 0.0 110.802 -179.694 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 63.4 m -65.58 -56.21 13.5 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 120.845 -0.342 . . . . 0.0 110.945 -179.713 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 59.4 m-85 -65.51 -37.22 86.14 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.721 179.819 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 55.8 tt0 -63.1 -40.14 96.76 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.675 -179.719 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 37.7 t0 -59.75 -51.03 71.53 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.449 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' TYR . . . . . 0.48 ' O ' ' OG1' ' A' ' 69' ' ' THR . 53.8 m-85 -69.08 -33.13 73.06 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.681 179.585 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 56.2 t80 -66.69 -44.09 82.7 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.983 0.42 . . . . 0.0 110.415 -179.641 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 94.1 m-20 -64.2 -39.09 93.26 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.425 -179.237 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.48 ' OG1' ' O ' ' A' ' 66' ' ' TYR . 44.8 p -48.24 -28.53 3.11 Favored 'General case' 0 CA--C 1.516 -0.342 0 C-N-CA 120.766 -0.374 . . . . 0.0 110.676 -179.125 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 67.5 m-85 -69.77 -35.82 75.24 Favored 'General case' 0 C--N 1.32 -0.686 0 C-N-CA 120.283 -0.567 . . . . 0.0 111.31 179.263 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . 0.51 ' N ' ' CD ' ' A' ' 72' ' ' PRO . . . 90.65 46.4 4.0 Favored Glycine 0 CA--C 1.533 1.185 0 N-CA-C 110.64 -0.984 . . . . 0.0 110.64 -178.457 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . 0.51 ' CD ' ' N ' ' A' ' 71' ' ' GLY . 66.8 Cg_endo -75.0 128.26 11.34 Favored 'Trans proline' 0 N--CA 1.49 1.285 0 C-N-CA 122.744 2.296 . . . . 0.0 111.861 -179.671 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 80.4 mm-40 -86.77 -38.63 16.71 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.342 0.591 . . . . 0.0 111.089 -179.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.627 ' CD ' ' H ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -59.12 -39.52 82.55 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 115.261 -0.882 . . . . 0.0 111.559 -179.436 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.516 ' C ' ' O ' ' A' ' 74' ' ' LYS . 41.6 t 20.87 90.0 0.05 OUTLIER Pre-proline 0 N--CA 1.466 0.349 0 O-C-N 124.074 0.859 . . . . 0.0 111.287 -179.972 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_exo -55.53 125.44 19.13 Favored 'Trans proline' 0 C--N 1.313 -1.307 0 C-N-CA 121.131 1.221 . . . . 0.0 111.613 -178.725 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . 0.475 ' O ' ' N ' ' A' ' 79' ' ' ALA . 89.4 t -83.8 -18.98 9.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 115.301 -0.863 . . . . 0.0 110.638 179.663 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' THR . . . . . 0.43 ' O ' ' OG ' ' A' ' 81' ' ' SER . 71.5 p -41.94 -22.55 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.707 -178.901 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . 0.475 ' N ' ' O ' ' A' ' 77' ' ' VAL . . . -61.94 -39.0 90.6 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.251 179.711 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 38.6 t80 -61.41 -40.39 94.22 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.464 179.956 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' SER . . . . . 0.43 ' OG ' ' O ' ' A' ' 78' ' ' THR . 82.8 p -58.36 -40.33 81.94 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.709 0.29 . . . . 0.0 110.727 -179.489 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 7.5 m-85 -60.46 -50.63 72.79 Favored 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 120.745 -0.382 . . . . 0.0 110.716 179.915 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' TRP . . . . . . . . . . . . . 55.6 t90 -58.34 -38.34 76.96 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.604 179.938 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 87.6 m-20 -61.29 -44.86 96.51 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 120.594 -0.442 . . . . 0.0 110.838 -179.364 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 29.1 tp -73.67 -57.15 4.19 Favored 'General case' 0 N--CA 1.449 -0.478 0 C-N-CA 120.262 -0.575 . . . . 0.0 110.194 179.552 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -52.59 -26.8 10.61 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 C-N-CA 120.531 -0.468 . . . . 0.0 110.454 179.667 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 63.7 tttt -66.81 -50.32 63.0 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.976 -0.557 . . . . 0.0 110.78 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . 0.413 ' O ' ' OE1' ' A' ' 88' ' ' GLU . 1.2 pp20? -80.02 -20.24 45.83 Favored 'General case' 0 C--N 1.319 -0.738 0 C-N-CA 120.302 -0.559 . . . . 0.0 110.899 -179.396 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.16 -46.94 86.73 Favored 'General case' 0 N--CA 1.447 -0.613 0 C-N-CA 120.72 -0.392 . . . . 0.0 110.324 -178.865 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 3.3 mt -63.79 -43.43 97.93 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.141 0 C-N-CA 120.121 -0.632 . . . . 0.0 109.695 -179.821 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 96.2 m-20 -48.92 -44.86 40.73 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.56 -178.817 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 95.0 mttt -64.35 147.9 51.56 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.933 0.397 . . . . 0.0 110.759 179.599 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 69.8 mmtt -81.63 8.0 10.89 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.261 -179.83 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 80.5 tt0 -61.11 -33.81 73.97 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.128 179.801 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 2.9 m -67.89 137.39 24.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.284 -0.417 . . . . 0.0 110.184 179.872 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' ASN . . . . . 0.532 ' ND2' ' OE2' ' A' ' 4' ' ' GLU . 0.0 OUTLIER -81.07 176.23 4.04 Favored Pre-proline 0 C--N 1.328 -0.354 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.93 -179.369 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . 0.401 ' C ' ' N ' ' A' ' 99' ' ' VAL . 34.7 Cg_exo -57.95 -13.32 14.76 Favored 'Trans proline' 0 N--CA 1.495 1.606 0 C-N-CA 122.551 2.168 . . . . 0.0 112.268 179.428 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . 0.47 ' OE1' ' ND2' ' A' ' 96' ' ' ASN . 6.0 pt20 -46.67 -21.09 0.16 Allowed 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.785 -179.577 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . 0.401 ' N ' ' C ' ' A' ' 97' ' ' PRO . 94.4 t -63.28 -48.09 89.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 C-N-CA 120.725 -0.39 . . . . 0.0 110.801 179.927 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 62.6 ttp -77.65 -36.98 50.88 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.445 179.844 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -61.98 -23.64 66.52 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.772 -179.741 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -60.59 -16.46 38.35 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.623 -179.831 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 95.5 t -62.46 -22.61 30.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.385 -0.371 . . . . 0.0 110.413 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -62.01 -38.88 90.33 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.712 179.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . 0.484 ' NE2' ' CE1' ' A' ' 45' ' ' PHE . 86.8 mt-30 47.92 -116.5 0.77 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.565 -179.976 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 89.7 m -115.4 126.22 54.11 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.248 179.878 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 86.3 mt-10 -77.98 172.64 13.19 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.244 -179.557 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . 0.511 ' C ' ' H ' ' A' ' 110' ' ' LEU . 94.8 mt-10 -106.2 124.42 49.56 Favored 'General case' 0 CA--C 1.513 -0.451 0 N-CA-C 109.85 -0.426 . . . . 0.0 109.85 179.129 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . 0.425 HD11 HG21 ' A' ' 109' ' ' ILE . 45.7 pt -48.66 -13.16 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.971 179.76 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.511 ' H ' ' C ' ' A' ' 108' ' ' GLU . 33.0 mt -65.25 -42.22 93.5 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.596 179.778 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . 0.804 ' HZ2' ' NE2' ' A' ' 121' ' ' HIS . 88.6 tttt -69.01 -38.64 79.34 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.929 -179.988 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 60.2 m -58.86 -43.63 90.88 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.835 -179.369 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 24.4 t-20 -66.76 -43.4 84.17 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.473 179.848 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 99.7 p -165.73 156.37 13.34 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.42 179.686 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 87.3 mt-30 -100.96 11.81 38.89 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.767 0.318 . . . . 0.0 110.567 179.81 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 41.0 p -65.58 -35.87 82.11 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.803 -179.797 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 55.2 m-20 -62.2 -47.28 85.16 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.467 -0.333 . . . . 0.0 110.281 -179.714 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 48.2 tp -139.33 94.64 2.82 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.4 179.41 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . 0.412 ' OE1' ' N ' ' A' ' 119' ' ' GLU . 56.3 mp0 -69.79 -40.49 75.96 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.303 179.904 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 90.2 m-70 -119.65 144.54 47.1 Favored 'General case' 0 C--O 1.231 0.125 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.954 179.977 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 121' ' ' HIS . . . . . 0.804 ' NE2' ' HZ2' ' A' ' 111' ' ' LYS . 92.2 m-70 -82.11 137.76 34.93 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.737 -179.92 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 17.8 t-80 -83.94 130.88 34.89 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.594 179.678 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 98.2 m-70 -125.07 137.58 54.2 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.455 179.941 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 124' ' ' HIS . . . . . . . . . . . . . 70.2 m80 -58.18 -44.23 87.91 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.564 -179.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 97.5 m-70 . . . . . 0 C--O 1.22 -0.493 0 CA-C-O 117.967 -1.016 . . . . 0.0 110.442 179.889 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 201' ' ' MYR . . . . . 0.628 ' H51' ' OE1' ' A' ' 4' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.653 0 N-CA-C 110.912 -0.875 . . . . 0.0 110.912 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 84.5 mt-30 -64.03 -38.73 92.14 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.791 0.329 . . . . 0.0 110.559 -179.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . 0.492 ' O ' ' N ' ' A' ' 7' ' ' GLN . 92.8 mt-10 -55.79 -21.29 18.55 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.567 -179.852 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 46.5 tp -40.63 -37.22 0.7 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.546 179.951 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 82.5 p -55.72 -38.0 69.18 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.578 179.366 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . 0.492 ' N ' ' O ' ' A' ' 4' ' ' GLU . 85.6 mt-30 -65.96 -30.58 71.18 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.523 179.798 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 59.3 t-80 -61.1 -43.69 98.49 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.557 179.695 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -62.11 -43.27 99.21 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.614 179.251 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.542 ' O ' ' N ' ' A' ' 14' ' ' GLN . 89.1 mtt-85 -65.93 -33.89 76.87 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.54 178.889 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.467 ' O ' ' CB ' ' A' ' 15' ' ' LEU . 0.1 OUTLIER -57.69 -43.2 84.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.609 -179.488 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 2.2 t -60.43 -52.31 62.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.546 -178.649 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 80.9 tt0 -78.16 -46.54 20.31 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.545 -178.683 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . 0.542 ' N ' ' O ' ' A' ' 10' ' ' ARG . 65.1 tp60 -59.29 -46.73 87.75 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.594 -178.423 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.531 ' C ' ' CD1' ' A' ' 15' ' ' LEU . 3.4 tm? -62.37 -51.25 68.33 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.562 -179.159 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -61.19 -37.15 81.95 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.558 -179.522 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 76.0 mt-30 -66.51 -40.3 89.13 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.557 177.832 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.445 ' O ' HG22 ' A' ' 21' ' ' THR . . . -63.04 -19.28 64.23 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.591 178.676 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.484 ' CD1' ' CE2' ' A' ' 82' ' ' TYR . 9.1 mt -86.59 -35.66 19.32 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.597 178.229 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 96.6 mttt -55.03 -42.26 72.4 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.543 -179.702 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' THR . . . . . 0.445 HG22 ' O ' ' A' ' 18' ' ' ALA . 0.5 OUTLIER -63.09 -29.2 70.62 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.597 -179.73 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 75.0 mmt-85 -71.91 -7.33 47.86 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.582 179.462 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 105.82 23.96 7.21 Favored Glycine 0 CA--C 1.524 0.641 0 N-CA-C 110.92 -0.872 . . . . 0.0 110.92 179.854 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.444 ' CG1' ' N ' ' A' ' 25' ' ' LYS . 34.7 t -103.4 168.61 2.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 120.809 0.337 . . . . 0.0 110.579 179.839 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.444 ' N ' ' CG1' ' A' ' 24' ' ' VAL . 49.1 tttp -130.46 110.56 11.55 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.541 178.807 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . 0.423 ' CG1' ' OD2' ' A' ' 30' ' ' ASP . 2.1 t -128.3 90.56 1.52 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.603 -179.391 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 19.2 pttt -78.56 166.55 22.43 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.555 179.416 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 87.7 m-85 -47.84 -35.69 10.68 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.588 179.812 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -48.98 -22.16 0.81 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.577 179.057 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.492 ' O ' ' N ' ' A' ' 34' ' ' PHE . 20.3 t0 -66.62 -41.5 88.25 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.511 -179.56 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.541 ' O ' ' CB ' ' A' ' 35' ' ' PHE . 4.0 mp -61.45 -40.82 95.89 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.556 179.217 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 32.5 mt -62.28 -48.01 81.78 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.557 -179.014 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 82.0 tttt -84.82 -53.97 4.99 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.608 -177.469 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . 0.492 ' N ' ' O ' ' A' ' 30' ' ' ASP . 35.4 t80 -56.94 -52.03 66.83 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.597 -177.434 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.541 ' CB ' ' O ' ' A' ' 31' ' ' LEU . 5.5 t80 -61.55 -45.79 92.69 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.534 -177.85 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 91.1 m-20 -65.72 -32.81 74.56 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.585 -179.08 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -65.85 -49.81 66.81 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.533 -178.831 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.605 ' O ' ' N ' ' A' ' 42' ' ' CYS . 26.9 m -72.08 -36.28 56.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.532 -179.037 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -61.97 -29.2 70.09 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.541 -179.354 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 97.5 m-20 -57.99 -47.49 82.85 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.55 -179.148 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' THR . . . . . 0.474 ' O ' ' C ' ' A' ' 42' ' ' CYS . 82.7 p -113.9 0.1 14.32 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.59 -178.91 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . 0.605 ' N ' ' O ' ' A' ' 38' ' ' VAL . 26.0 p 33.78 61.02 1.86 Allowed Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.595 -179.494 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -78.43 -36.61 0.89 Allowed 'Trans proline' 0 C--N 1.305 -1.721 0 C-N-CA 122.816 2.344 . . . . 0.0 112.133 -179.256 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . 0.811 ' HE1' ' H ' ' A' ' 52' ' ' ASP . 0.0 OUTLIER -71.73 -2.01 15.94 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.565 -179.755 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.576 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 69.0 m-85 58.1 47.5 2.22 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.58 -179.677 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.576 ' CD ' ' N ' ' A' ' 45' ' ' PHE . 46.9 Cg_exo -38.48 -19.0 0.04 OUTLIER 'Trans proline' 0 C--N 1.305 -1.725 0 C-N-CA 122.837 2.358 . . . . 0.0 112.112 178.248 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.564 ' N ' ' O ' ' A' ' 45' ' ' PHE . 86.5 mt-30 -65.85 -53.64 37.21 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.601 -178.468 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.518 ' O ' ' H52' ' A' ' 201' ' ' MYR . 1.2 tt0 -86.09 -15.77 40.15 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.544 -179.861 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 64.76 84.24 0.08 OUTLIER Glycine 0 CA--C 1.525 0.661 0 N-CA-C 110.97 -0.852 . . . . 0.0 110.97 -179.746 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' THR . . . . . 0.625 ' O ' H131 ' A' ' 201' ' ' MYR . 14.8 t -145.33 171.29 14.8 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.816 0.341 . . . . 0.0 110.537 -179.284 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.567 ' H ' ' HG1' ' A' ' 50' ' ' THR . 1.2 mt -104.85 134.3 46.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.57 179.277 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . 0.811 ' H ' ' HE1' ' A' ' 44' ' ' TRP . 1.7 m-20 -111.93 121.94 46.39 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.536 -179.764 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.462 HG22 HD11 ' A' ' 53' ' ' ILE . 33.4 mm -94.6 -56.17 5.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.591 179.578 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -74.99 -51.56 13.34 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.566 -179.391 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.4 ' HA ' ' HE ' ' A' ' 58' ' ' ARG . 84.5 mtt85 -59.26 -29.75 67.78 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.553 -179.042 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' TRP . . . . . 0.585 ' CE3' ' CH2' ' A' ' 44' ' ' TRP . 24.9 t-105 -63.44 -36.96 85.46 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.529 178.923 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 79.3 mtp85 -64.96 -35.37 80.96 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.565 179.217 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . 0.4 ' HE ' ' HA ' ' A' ' 55' ' ' ARG . 69.8 mtm180 -60.11 -52.59 64.67 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.621 -179.466 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 2.8 p -65.44 -33.35 63.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.612 -179.86 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -71.22 -38.97 62.94 Favored Glycine 0 CA--C 1.525 0.689 0 N-CA-C 110.944 -0.862 . . . . 0.0 110.944 179.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 56.0 t0 -63.36 -48.75 76.65 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.792 0.329 . . . . 0.0 110.554 -179.627 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 99.8 m -64.06 -46.59 83.68 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.553 -179.863 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 6.3 m-85 -63.79 -31.65 72.9 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.6 179.767 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 70.8 tp60 -61.57 -40.22 93.95 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.514 179.647 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 20.6 t0 -63.19 -52.03 63.97 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.561 179.583 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' TYR . . . . . 0.461 ' O ' ' OG1' ' A' ' 69' ' ' THR . 68.8 m-85 -66.81 -32.06 73.1 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.579 179.743 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 63.9 t80 -60.41 -43.37 96.76 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.525 179.388 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 99.0 m-20 -65.65 -38.68 90.03 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.526 -179.863 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.461 ' OG1' ' O ' ' A' ' 66' ' ' TYR . 62.0 p -64.91 -22.59 67.02 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.568 -179.571 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -72.21 -42.58 65.61 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.561 179.938 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . 0.447 ' H ' ' HD3' ' A' ' 72' ' ' PRO . . . 110.24 72.34 0.69 Allowed Glycine 0 CA--C 1.525 0.715 0 N-CA-C 110.925 -0.87 . . . . 0.0 110.925 179.139 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . 0.447 ' HD3' ' H ' ' A' ' 71' ' ' GLY . 16.4 Cg_exo -67.4 147.28 77.33 Favored 'Trans proline' 0 C--N 1.305 -1.728 0 C-N-CA 122.746 2.297 . . . . 0.0 112.124 178.108 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 99.1 mt-10 -76.92 -51.13 11.74 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.546 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.446 ' CD ' ' N ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -140.44 5.59 2.05 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.547 -179.609 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 55.5 t 56.46 91.69 0.07 OUTLIER Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.57 -179.808 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_exo -55.26 122.64 12.08 Favored 'Trans proline' 0 C--N 1.305 -1.732 0 C-N-CA 122.845 2.363 . . . . 0.0 112.146 -179.011 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . 0.401 ' O ' ' N ' ' A' ' 79' ' ' ALA . 98.0 t -86.25 -13.49 10.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.539 -179.536 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 81.0 p -44.01 -23.74 0.11 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.601 -179.587 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . 0.401 ' N ' ' O ' ' A' ' 77' ' ' VAL . . . -55.41 -40.61 71.65 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.61 179.794 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 41.1 t80 -63.02 -38.35 90.83 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.604 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 19.6 m -59.05 -41.86 88.93 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.6 -179.511 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' TYR . . . . . 0.484 ' CE2' ' CD1' ' A' ' 19' ' ' LEU . 13.0 m-85 -59.66 -51.65 68.89 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.533 -179.952 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' TRP . . . . . 0.431 ' O ' ' CB ' ' A' ' 87' ' ' LYS . 80.9 t90 -56.66 -40.25 75.16 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.522 -179.69 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 71.8 m-20 -59.92 -46.37 89.58 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.542 -179.883 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 26.1 tp -71.8 -63.34 1.15 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.57 179.674 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -47.57 -26.77 1.06 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.584 179.11 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . 0.431 ' CB ' ' O ' ' A' ' 83' ' ' TRP . 59.6 tttt -68.03 -49.97 58.22 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.564 -179.536 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . 0.488 ' O ' ' OE1' ' A' ' 88' ' ' GLU . 1.0 OUTLIER -79.74 -19.59 48.39 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.565 -179.924 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.92 -49.15 78.61 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.573 -179.509 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 3.1 mt -63.66 -42.6 96.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.53 179.726 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 65.0 t0 -57.16 -45.87 83.24 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.555 -178.931 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 78.8 mttt -57.12 136.79 56.39 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.568 -179.546 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 58.6 mttp -69.81 -4.34 19.64 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.582 179.857 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -73.4 47.65 0.23 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.573 -179.871 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 21.4 m -121.82 163.98 19.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.581 179.81 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' ASN . . . . . 0.677 ' H ' ' ND2' ' A' ' 96' ' ' ASN . 0.0 OUTLIER -97.31 176.75 1.92 Allowed Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.58 -179.896 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . 0.459 ' CD ' ' CB ' ' A' ' 96' ' ' ASN . 37.9 Cg_exo -59.55 -22.49 66.9 Favored 'Trans proline' 0 C--N 1.305 -1.744 0 C-N-CA 122.839 2.359 . . . . 0.0 112.109 179.688 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . 0.485 ' OE1' ' ND2' ' A' ' 96' ' ' ASN . 5.7 pt20 -45.64 -26.54 0.63 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.579 -179.766 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 69.4 t -62.63 -48.62 87.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.569 179.917 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 98.7 mtp -76.77 -40.29 48.78 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.546 179.588 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -65.26 -25.42 67.65 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.574 -179.088 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -64.62 -14.36 57.63 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.565 -179.689 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 49.9 t -62.67 -21.64 28.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.528 179.752 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -54.65 -26.72 34.93 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.57 -179.953 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 81.9 mt-30 -109.35 49.79 0.81 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.579 179.781 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 98.0 m -63.78 -44.79 92.31 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.573 179.895 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . 0.436 ' OE2' ' O ' ' A' ' 113' ' ' ASN . 90.2 mt-10 -74.95 -178.27 3.69 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.547 -179.813 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . 0.586 ' C ' ' H ' ' A' ' 110' ' ' LEU . 80.7 mm-40 -102.87 128.56 49.6 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.571 179.256 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 40.7 pt -56.37 -0.78 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.613 -179.803 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.586 ' H ' ' C ' ' A' ' 108' ' ' GLU . 94.9 mt -89.33 -2.33 58.4 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.592 179.969 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . 0.406 ' NZ ' ' O ' ' A' ' 116' ' ' THR . 84.6 tttt -141.8 154.44 45.21 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.555 -179.747 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 5.5 p -60.69 173.3 0.76 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.546 -179.791 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' ASN . . . . . 0.436 ' O ' ' OE2' ' A' ' 107' ' ' GLU . 70.6 m-20 -62.45 -38.5 90.01 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.566 -179.628 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' SER . . . . . 0.483 ' O ' ' O ' ' A' ' 115' ' ' GLN . 11.6 m -68.77 138.82 55.14 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.599 -179.705 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' GLN . . . . . 0.483 ' O ' ' O ' ' A' ' 114' ' ' SER . 82.7 mt-30 56.95 148.57 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.556 -179.624 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' THR . . . . . 0.554 ' HG1' ' HE2' ' A' ' 121' ' ' HIS . 21.5 p -84.17 170.59 13.63 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.581 179.472 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . 0.481 ' C ' ' O ' ' A' ' 116' ' ' THR . 58.6 t0 -33.75 -33.94 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.588 179.894 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . 0.508 ' N ' ' O ' ' A' ' 116' ' ' THR . 67.1 mt -102.53 128.46 49.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.555 179.476 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 82.6 tt0 -67.75 -35.83 79.45 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.594 -179.933 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 80.7 m80 -112.67 145.39 40.53 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.566 -179.846 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 121' ' ' HIS . . . . . 0.554 ' HE2' ' HG1' ' A' ' 116' ' ' THR . 69.9 m80 -111.81 142.33 44.31 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.561 179.924 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 94.9 m-70 -63.95 -39.1 93.37 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.551 179.9 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 80.5 m80 -62.52 -45.75 91.56 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.571 179.769 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 124' ' ' HIS . . . . . . . . . . . . . 73.0 m80 -126.15 126.18 43.7 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.571 179.849 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 72.5 m80 . . . . . 0 C--O 1.221 -0.432 0 CA-C-O 117.995 -1.002 . . . . 0.0 110.612 179.994 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 201' ' ' MYR . . . . . 0.625 H131 ' O ' ' A' ' 50' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.632 0 N-CA-C 111.104 -0.798 . . . . 0.0 111.104 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 88.6 mt-30 -58.94 -31.39 68.65 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.874 0.368 . . . . 0.0 110.407 -179.723 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 69.7 mm-40 -65.32 -24.53 67.3 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.681 179.545 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.411 ' N ' ' H22' ' A' ' 201' ' ' MYR . 37.4 tp -43.06 -33.08 0.77 Allowed 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.245 0.545 . . . . 0.0 110.307 -179.553 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 68.1 m -53.67 -41.27 66.69 Favored 'General case' 0 C--N 1.324 -0.526 0 C-N-CA 120.486 -0.486 . . . . 0.0 110.123 179.912 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . 0.467 ' OE1' ' CG ' ' A' ' 97' ' ' PRO . 86.6 mt-30 -61.93 -34.16 75.58 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.827 179.703 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . 0.766 ' HD1' ' H92' ' A' ' 201' ' ' MYR . 73.9 t60 -57.1 -41.81 79.6 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.974 0.416 . . . . 0.0 109.952 -179.982 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 96.2 mt-10 -62.5 -43.38 98.95 Favored 'General case' 0 C--O 1.238 0.482 0 C-N-CA 120.357 -0.537 . . . . 0.0 110.026 179.566 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.446 ' O ' ' CB ' ' A' ' 14' ' ' GLN . 62.6 mtp180 -65.16 -33.18 75.39 Favored 'General case' 0 C--O 1.208 -1.096 0 CA-C-N 116.038 -0.528 . . . . 0.0 109.58 179.668 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.62 ' CE1' H142 ' A' ' 201' ' ' MYR . 0.0 OUTLIER -58.4 -44.6 89.04 Favored 'General case' 0 C--N 1.322 -0.588 0 C-N-CA 120.77 -0.372 . . . . 0.0 110.62 -179.54 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 13.4 t -61.62 -48.83 86.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 C-N-CA 120.433 -0.507 . . . . 0.0 111.892 -179.863 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 70.0 mm-40 -76.02 -41.79 49.89 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.291 0.567 . . . . 0.0 111.428 -179.649 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . 0.446 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 66.6 tp60 -62.07 -50.4 72.11 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.498 -179.189 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -63.97 -49.17 73.58 Favored 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 120.303 -0.559 . . . . 0.0 109.99 179.828 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 94.9 mttt -58.93 -34.44 71.74 Favored 'General case' 0 C--N 1.324 -0.525 0 C-N-CA 120.707 -0.397 . . . . 0.0 110.729 -179.683 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 91.1 mt-30 -78.58 -36.2 44.79 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.864 179.633 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -56.39 -34.63 66.89 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.932 -0.576 . . . . 0.0 109.929 -179.749 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.472 ' O ' ' N ' ' A' ' 22' ' ' ARG . 3.7 mt -85.16 -35.06 21.96 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.156 0.503 . . . . 0.0 110.461 179.231 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 65.1 tttm -45.95 -41.68 11.94 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.478 -178.642 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -75.71 -16.06 60.21 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.747 -179.942 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.472 ' N ' ' O ' ' A' ' 19' ' ' LEU . 86.2 mmt-85 -83.56 13.21 4.74 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 120.828 0.347 . . . . 0.0 110.28 -179.881 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 97.32 4.94 58.24 Favored Glycine 0 CA--C 1.522 0.512 0 N-CA-C 110.915 -0.874 . . . . 0.0 110.915 179.671 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 15.7 t -93.5 169.33 1.38 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 C-N-CA 121.094 -0.242 . . . . 0.0 110.469 -179.798 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -134.41 134.46 41.66 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.24 179.654 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 8.9 m -131.03 129.86 63.53 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.288 0 CA-C-N 116.601 -0.272 . . . . 0.0 110.268 179.812 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 16.0 pttp -110.13 163.59 13.45 Favored 'General case' 0 C--O 1.226 -0.134 0 CA-C-O 120.652 0.263 . . . . 0.0 110.585 179.771 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 98.0 m-85 -56.51 -34.75 67.3 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.021 0.439 . . . . 0.0 110.267 179.858 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -51.93 -23.32 4.8 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.236 179.708 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.487 ' O ' ' CB ' ' A' ' 34' ' ' PHE . 97.3 m-20 -62.2 -49.99 73.59 Favored 'General case' 0 C--O 1.219 -0.531 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.311 -179.547 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.433 ' O ' ' CB ' ' A' ' 35' ' ' PHE . 3.7 mp -63.32 -38.3 90.63 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 121.224 0.535 . . . . 0.0 109.837 179.565 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 42.9 mt -61.1 -51.32 69.63 Favored 'General case' 0 C--N 1.308 -1.199 0 C-N-CA 119.106 -1.038 . . . . 0.0 111.435 -179.068 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.408 ' O ' ' OD1' ' A' ' 36' ' ' ASP . 87.1 tttt -88.07 -54.18 4.35 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 112.864 0.691 . . . . 0.0 112.864 -178.287 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . 0.487 ' CB ' ' O ' ' A' ' 30' ' ' ASP . 9.7 t80 -53.48 -47.75 69.52 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.427 -178.093 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.433 ' CB ' ' O ' ' A' ' 31' ' ' LEU . 1.1 t80 -62.89 -48.88 77.07 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 120.348 -0.541 . . . . 0.0 110.341 179.978 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . 0.408 ' OD1' ' O ' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -62.94 -34.3 77.19 Favored 'General case' 0 C--O 1.234 0.282 0 C-N-CA 119.554 -0.858 . . . . 0.0 111.816 -179.052 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.439 ' O ' ' OG1' ' A' ' 41' ' ' THR . 3.2 t80 -62.15 -47.12 85.94 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.226 -178.734 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.505 ' O ' ' N ' ' A' ' 42' ' ' CYS . 29.8 m -71.17 -26.27 26.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.528 -179.47 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.431 ' O ' ' SG ' ' A' ' 42' ' ' CYS . 24.4 mttt -61.22 -45.55 94.11 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 120.465 -0.494 . . . . 0.0 110.89 -179.584 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 89.3 m-20 -75.88 -50.55 14.74 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 120.549 -0.46 . . . . 0.0 111.41 -179.835 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' THR . . . . . 0.439 ' OG1' ' O ' ' A' ' 37' ' ' PHE . 1.6 p -70.27 -34.74 73.16 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.443 -179.501 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . 0.505 ' N ' ' O ' ' A' ' 38' ' ' VAL . 48.6 m 47.09 53.14 13.36 Favored Pre-proline 0 C--N 1.331 -0.219 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.416 -178.45 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . 0.432 ' HD3' ' N ' ' A' ' 42' ' ' CYS . 68.6 Cg_endo -79.22 -33.21 1.48 Allowed 'Trans proline' 0 N--CA 1.488 1.165 0 C-N-CA 122.507 2.138 . . . . 0.0 112.463 -179.608 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . 0.73 ' CE2' H141 ' A' ' 201' ' ' MYR . 0.0 OUTLIER -87.86 20.12 3.21 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.971 -179.27 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.468 ' C ' ' H ' ' A' ' 47' ' ' GLN . 59.4 m-85 48.21 59.61 16.58 Favored Pre-proline 0 C--N 1.33 -0.277 0 C-N-CA 120.455 -0.498 . . . . 0.0 109.972 179.917 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo -51.82 -7.76 0.25 Allowed 'Trans proline' 0 C--N 1.312 -1.371 0 C-N-CA 122.893 2.395 . . . . 0.0 112.333 179.867 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.468 ' H ' ' C ' ' A' ' 45' ' ' PHE . 87.8 mt-30 -71.32 -54.37 11.04 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.635 -179.849 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.66 ' O ' ' H52' ' A' ' 201' ' ' MYR . 12.5 pt-20 -88.76 -28.59 20.39 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.576 179.254 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . 0.501 ' CA ' ' H91' ' A' ' 201' ' ' MYR . . . 79.12 66.8 1.66 Allowed Glycine 0 CA--C 1.525 0.696 0 N-CA-C 110.661 -0.976 . . . . 0.0 110.661 -179.615 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' THR . . . . . 0.542 ' OG1' ' NE2' ' A' ' 98' ' ' GLN . 15.3 t -127.93 169.13 14.32 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.827 0.346 . . . . 0.0 111.012 -179.361 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.2 mt -98.88 132.08 44.85 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.253 0 CA-C-N 116.094 -0.503 . . . . 0.0 109.901 179.418 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . 0.639 ' H ' ' HE1' ' A' ' 44' ' ' TRP . 5.6 t0 -116.54 119.08 34.46 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.008 179.012 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 17.8 mm -82.98 -25.41 8.13 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.035 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -85.81 -57.18 3.15 Favored 'General case' 0 C--O 1.239 0.523 0 CA-C-O 121.471 0.653 . . . . 0.0 111.442 -179.116 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 95.7 mtt-85 -60.72 -33.27 72.64 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.396 -179.342 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' TRP . . . . . 0.629 ' CE3' ' CH2' ' A' ' 44' ' ' TRP . 34.2 t-105 -57.85 -37.7 74.35 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.114 0.483 . . . . 0.0 110.265 179.96 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 85.0 mtp180 -64.58 -37.94 89.3 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.183 179.79 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 41.2 ttm180 -60.95 -51.62 68.51 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 120.447 -0.501 . . . . 0.0 111.049 -179.551 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 6.9 p -68.85 -38.43 78.69 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.425 0 CA-C-O 120.896 0.379 . . . . 0.0 110.218 179.404 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -64.5 -39.05 96.53 Favored Glycine 0 CA--C 1.525 0.68 0 N-CA-C 111.135 -0.786 . . . . 0.0 111.135 179.689 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . 0.422 ' O ' ' OD1' ' A' ' 61' ' ' ASP . 64.0 t0 -62.64 -38.29 89.69 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.876 0.369 . . . . 0.0 110.326 -179.962 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 75.8 m -61.95 -38.42 88.44 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.447 -179.893 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 5.5 m-85 -62.71 -37.75 87.73 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.358 179.89 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 57.6 tt0 -63.11 -42.1 99.5 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.963 -179.898 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 62.2 t0 -60.22 -52.0 67.17 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.055 0.455 . . . . 0.0 110.456 -179.925 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' TYR . . . . . 0.428 ' O ' ' OG1' ' A' ' 69' ' ' THR . 55.0 m-85 -62.2 -39.52 93.02 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.414 179.811 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 9.8 t80 -62.1 -40.53 96.18 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.291 179.818 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 88.3 m-20 -57.33 -32.72 67.0 Favored 'General case' 0 CA--C 1.518 -0.269 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.046 -179.27 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.428 ' OG1' ' O ' ' A' ' 66' ' ' TYR . 25.0 p -65.64 -20.47 66.31 Favored 'General case' 0 C--N 1.317 -0.816 0 C-N-CA 119.748 -0.781 . . . . 0.0 110.034 179.281 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 69.7 m-85 -107.34 -51.45 2.91 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 116.024 -0.534 . . . . 0.0 112.399 -179.738 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -142.46 78.11 0.28 Allowed Glycine 0 CA--C 1.539 1.54 0 N-CA-C 111.074 -0.811 . . . . 0.0 111.074 -179.292 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -75.98 -16.14 18.26 Favored 'Trans proline' 0 C--N 1.298 -2.093 0 C-N-CA 122.831 2.354 . . . . 0.0 111.735 -179.672 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 77.4 mm-40 -89.47 -38.39 14.09 Favored 'General case' 0 CA--C 1.505 -0.774 0 CA-C-O 121.567 0.699 . . . . 0.0 110.585 179.798 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 51.5 mmtt -65.48 -46.09 81.1 Favored 'General case' 0 C--N 1.308 -1.213 0 CA-C-N 114.82 -1.082 . . . . 0.0 111.123 -178.199 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 54.6 t 38.51 84.06 0.19 Allowed Pre-proline 0 N--CA 1.451 -0.406 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.115 179.492 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_exo -55.41 126.86 23.92 Favored 'Trans proline' 0 C--N 1.311 -1.436 0 C-N-CA 121.925 1.75 . . . . 0.0 111.373 -179.629 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 58.0 t -82.08 -17.17 11.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.513 -179.936 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 22.6 p -48.19 -26.46 1.93 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.176 -179.35 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.27 -41.24 98.3 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.179 0.514 . . . . 0.0 110.583 179.661 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 8.4 m-85 -62.69 -37.31 85.96 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.346 179.829 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 59.9 m -58.58 -40.62 83.68 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.309 179.745 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 5.1 m-85 -59.67 -50.83 72.34 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.722 -179.675 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' TRP . . . . . 0.539 ' CD1' ' N ' ' A' ' 83' ' ' TRP . 6.1 m0 -59.8 -38.26 81.41 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.595 -179.881 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 92.9 m-20 -62.09 -45.28 94.18 Favored 'General case' 0 C--N 1.325 -0.457 0 C-N-CA 120.581 -0.447 . . . . 0.0 110.79 -179.339 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 56.7 tp -71.91 -53.99 11.42 Favored 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 120.341 -0.544 . . . . 0.0 110.5 179.87 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -58.54 -25.16 27.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 C-N-CA 120.766 -0.374 . . . . 0.0 110.483 179.884 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . 0.401 ' CB ' ' O ' ' A' ' 83' ' ' TRP . 67.1 tttt -65.39 -50.24 66.25 Favored 'General case' 0 C--N 1.321 -0.672 0 C-N-CA 120.348 -0.541 . . . . 0.0 110.306 -179.79 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . 0.415 ' O ' ' OE1' ' A' ' 88' ' ' GLU . 1.0 OUTLIER -80.54 -20.84 42.59 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.782 -179.912 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 12.4 tp -62.15 -45.16 94.64 Favored 'General case' 0 N--CA 1.448 -0.57 0 C-N-CA 120.316 -0.554 . . . . 0.0 110.438 -178.686 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . 0.507 ' C ' ' H ' ' A' ' 92' ' ' LYS . 2.9 mt -65.02 -43.63 96.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 C-N-CA 120.334 -0.547 . . . . 0.0 109.955 179.943 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 98.0 m-20 -47.03 -14.06 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.791 -178.199 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . 0.507 ' H ' ' C ' ' A' ' 90' ' ' ILE . 86.4 tttt -68.58 133.9 49.2 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.371 179.92 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -64.46 -41.41 96.53 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.942 -179.939 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 99.1 mt-10 -105.79 55.17 0.68 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.053 -179.664 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.515 ' O ' ' ND2' ' A' ' 96' ' ' ASN . 6.9 t -45.27 -75.48 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.497 -179.476 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' ASN . . . . . 0.515 ' ND2' ' O ' ' A' ' 95' ' ' VAL . 0.9 OUTLIER -153.74 160.54 30.82 Favored Pre-proline 0 C--N 1.326 -0.431 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.738 179.979 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . 0.467 ' CG ' ' OE1' ' A' ' 7' ' ' GLN . 16.3 Cg_endo -56.83 -11.89 8.07 Favored 'Trans proline' 0 N--CA 1.495 1.602 0 C-N-CA 122.959 2.439 . . . . 0.0 112.059 178.751 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . 0.542 ' NE2' ' OG1' ' A' ' 50' ' ' THR . 4.6 pt20 -45.88 -18.63 0.05 OUTLIER 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.999 -179.758 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . 0.445 ' N ' ' C ' ' A' ' 97' ' ' PRO . 64.3 t -61.6 -47.69 92.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 C-N-CA 120.617 -0.433 . . . . 0.0 110.655 -179.904 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 97.6 mmm -80.31 -42.66 22.61 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.809 179.948 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -60.86 -26.1 67.14 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.401 -179.652 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -64.55 -15.46 61.0 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.423 179.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 74.9 t -62.03 -41.21 90.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.37 179.81 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -53.96 -51.38 64.03 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.851 -179.662 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 85.9 mt-30 -133.6 134.76 43.67 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.324 179.877 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' THR . . . . . 0.415 ' O ' ' O ' ' A' ' 107' ' ' GLU . 4.9 t -146.45 157.48 43.76 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.634 -179.86 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . 0.415 ' O ' ' O ' ' A' ' 106' ' ' THR . 75.4 mm-40 44.39 -169.37 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.343 179.856 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . 0.555 ' C ' ' H ' ' A' ' 110' ' ' LEU . 93.0 mt-10 -109.07 122.16 46.67 Favored 'General case' 0 CA--C 1.515 -0.393 0 N-CA-C 109.697 -0.483 . . . . 0.0 109.697 179.387 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 44.0 pt -47.69 -12.43 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.14 179.573 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.555 ' H ' ' C ' ' A' ' 108' ' ' GLU . 31.5 mt -66.25 -41.95 89.25 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.812 179.615 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -66.12 -36.0 81.98 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.479 -179.899 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 45.9 m -57.7 -45.44 85.68 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.684 -179.289 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 29.6 t30 -65.56 -43.33 90.2 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.637 179.676 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 20.8 m -166.06 150.94 8.28 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.559 179.663 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 87.4 mt-30 -91.09 18.8 6.35 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.487 179.715 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 15.3 p -60.16 -47.42 85.99 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.495 -179.809 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 94.8 m-20 -63.86 -42.83 97.46 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.539 179.684 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 36.4 tp -132.95 117.03 17.17 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.27 179.836 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -107.82 142.73 37.42 Favored 'General case' 0 C--N 1.333 -0.114 0 CA-C-O 120.771 0.32 . . . . 0.0 110.329 179.589 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 85.5 t60 -100.13 129.15 46.13 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.431 -179.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 73.0 m80 -108.32 151.4 26.04 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.368 -179.944 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 52.3 m-70 -113.6 138.48 50.11 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.325 -179.826 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 78.2 m80 -117.29 146.51 43.28 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.304 -179.91 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 124' ' ' HIS . . . . . . . . . . . . . 79.9 t60 -111.93 117.42 32.69 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.498 -179.946 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 77.6 m80 . . . . . 0 C--O 1.22 -0.456 0 CA-C-O 117.985 -1.007 . . . . 0.0 110.49 -179.861 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 201' ' ' MYR . . . . . 0.766 ' H92' ' HD1' ' A' ' 8' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.875 0 N-CA-C 111.142 -0.783 . . . . 0.0 111.142 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 87.1 mt-30 -59.3 -27.05 65.51 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.952 0.406 . . . . 0.0 110.389 -179.925 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . 0.479 ' OE1' ' H51' ' A' ' 201' ' ' MYR . 82.2 tt0 -53.9 -21.48 7.9 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.613 179.862 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 34.5 tp -40.19 -29.59 0.08 Allowed 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 120.959 0.409 . . . . 0.0 110.418 -179.321 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 78.3 p -55.38 -38.6 69.07 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 120.586 -0.446 . . . . 0.0 110.078 179.947 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 99.7 mm-40 -62.28 -37.23 84.71 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.585 179.64 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 75.1 t60 -57.24 -42.29 81.21 Favored 'General case' 0 C--N 1.332 -0.169 0 N-CA-C 109.91 -0.404 . . . . 0.0 109.91 -179.854 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 81.2 mm-40 -60.11 -45.63 92.32 Favored 'General case' 0 C--O 1.243 0.726 0 CA-C-O 121.208 0.528 . . . . 0.0 109.873 179.318 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.415 ' O ' ' CB ' ' A' ' 14' ' ' GLN . 70.3 mtp180 -64.87 -33.34 75.78 Favored 'General case' 0 C--O 1.212 -0.912 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 179.327 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 49.0 t80 -59.37 -38.17 79.78 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 120.217 -0.593 . . . . 0.0 110.3 -179.295 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 3.4 t -62.07 -50.01 81.8 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 C-N-CA 119.774 -0.77 . . . . 0.0 111.37 179.974 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 97.3 mt-10 -79.38 -35.86 40.12 Favored 'General case' 0 C--N 1.322 -0.587 0 C-N-CA 120.232 -0.587 . . . . 0.0 112.061 -179.082 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . 0.415 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 66.2 tp60 -68.71 -51.68 39.04 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.527 -179.005 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.35 -46.43 86.62 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.343 -179.518 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -57.76 -31.95 67.0 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 178.838 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 49.2 tt0 -75.24 -39.45 59.92 Favored 'General case' 0 C--O 1.239 0.552 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.198 178.879 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -58.07 -25.06 60.79 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-N 115.933 -0.576 . . . . 0.0 109.725 179.536 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.448 ' O ' ' N ' ' A' ' 22' ' ' ARG . 3.7 mt -85.36 -40.73 16.17 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.199 178.581 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 92.9 mttt -43.24 -45.69 5.86 Favored 'General case' 0 N--CA 1.464 0.273 0 C-N-CA 120.353 -0.539 . . . . 0.0 111.035 -179.2 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' THR . . . . . 0.527 ' C ' ' H ' ' A' ' 23' ' ' GLY . 0.2 OUTLIER -63.62 -31.38 72.53 Favored 'General case' 0 C--N 1.324 -0.535 0 C-N-CA 120.467 -0.493 . . . . 0.0 110.758 -179.812 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.448 ' N ' ' O ' ' A' ' 19' ' ' LEU . 80.1 mmt-85 -69.05 10.24 0.32 Allowed 'General case' 0 C--O 1.232 0.18 0 C-N-CA 120.795 -0.362 . . . . 0.0 110.457 -179.745 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . 0.527 ' H ' ' C ' ' A' ' 21' ' ' THR . . . 91.52 22.49 31.4 Favored Glycine 0 N--CA 1.467 0.736 0 N-CA-C 111.162 -0.775 . . . . 0.0 111.162 179.738 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.453 ' CG1' ' N ' ' A' ' 25' ' ' LYS . 39.8 t -105.27 168.27 2.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-O 120.63 0.253 . . . . 0.0 110.575 -179.882 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.453 ' N ' ' CG1' ' A' ' 24' ' ' VAL . 98.9 mttt -134.96 105.15 6.25 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.171 179.356 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . 0.491 ' CG1' ' OD2' ' A' ' 30' ' ' ASP . 1.7 t -117.92 93.66 2.67 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.443 0 C-N-CA 120.895 -0.322 . . . . 0.0 110.765 -179.656 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 25.5 pttt -81.43 165.22 21.47 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.711 179.619 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 98.0 m-85 -48.21 -31.83 6.33 Favored 'General case' 0 C--O 1.241 0.614 0 CA-C-O 121.254 0.55 . . . . 0.0 110.647 179.895 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -54.43 -23.22 15.05 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.012 179.552 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.491 ' OD2' ' CG1' ' A' ' 26' ' ' VAL . 21.4 t0 -65.11 -42.0 94.4 Favored 'General case' 0 C--O 1.218 -0.567 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.894 -179.54 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.482 ' O ' ' CB ' ' A' ' 35' ' ' PHE . 4.7 mp -65.16 -40.58 94.55 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-O 121.029 0.443 . . . . 0.0 109.856 -179.866 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 40.7 mt -58.91 -46.35 88.11 Favored 'General case' 0 C--N 1.312 -1.064 0 C-N-CA 119.34 -0.944 . . . . 0.0 111.086 -178.216 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.411 ' O ' ' CD1' ' A' ' 37' ' ' PHE . 83.3 tttt -85.67 -49.99 7.54 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.896 -178.889 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . 0.44 ' CB ' ' O ' ' A' ' 30' ' ' ASP . 49.7 t80 -61.51 -50.75 71.44 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.206 -178.742 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.482 ' CB ' ' O ' ' A' ' 31' ' ' LEU . 5.4 t80 -61.6 -46.79 88.33 Favored 'General case' 0 C--N 1.33 -0.264 0 O-C-N 123.325 0.391 . . . . 0.0 110.241 -179.152 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 93.1 m-20 -63.44 -38.31 90.64 Favored 'General case' 0 C--N 1.34 0.167 0 C-N-CA 120.597 -0.441 . . . . 0.0 111.224 -179.431 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.411 ' CD1' ' O ' ' A' ' 33' ' ' LYS . 2.8 m-85 -61.09 -46.49 90.41 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.487 -178.929 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.542 ' O ' ' N ' ' A' ' 42' ' ' CYS . 27.6 m -76.87 -37.29 27.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 C-N-CA 120.307 -0.557 . . . . 0.0 110.425 -179.779 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 61.5 tttm -56.49 -29.25 61.57 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.763 -179.627 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 66.4 t0 -49.73 -62.43 1.56 Allowed 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.748 -0.381 . . . . 0.0 111.138 -179.446 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 17.2 p -115.21 1.1 13.74 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 116.529 -0.305 . . . . 0.0 111.562 -179.84 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . 0.542 ' N ' ' O ' ' A' ' 38' ' ' VAL . 2.2 m 40.49 59.25 7.72 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.434 -178.479 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . 0.47 ' C ' ' H ' ' A' ' 45' ' ' PHE . 9.1 Cg_exo -67.75 -29.65 35.31 Favored 'Trans proline' 0 N--CA 1.496 1.668 0 C-N-CA 122.442 2.094 . . . . 0.0 112.568 -179.415 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . 0.533 ' CE2' H141 ' A' ' 201' ' ' MYR . 0.0 OUTLIER -64.75 0.47 1.14 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.827 -179.272 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.487 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 45.9 t80 45.25 52.25 10.29 Favored Pre-proline 0 C--N 1.327 -0.395 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.078 -179.789 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.487 ' CD ' ' N ' ' A' ' 45' ' ' PHE . 19.8 Cg_endo -59.23 -7.17 4.64 Favored 'Trans proline' 0 C--N 1.307 -1.627 0 C-N-CA 122.965 2.443 . . . . 0.0 112.176 179.804 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 99.3 mm-40 -51.22 -54.38 26.2 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 120.534 -0.466 . . . . 0.0 110.167 -179.491 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.459 ' O ' ' H52' ' A' ' 201' ' ' MYR . 40.6 tt0 -89.65 -13.36 37.21 Favored 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 120.737 -0.385 . . . . 0.0 110.697 179.028 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . 0.617 ' O ' ' H72' ' A' ' 201' ' ' MYR . . . 77.32 71.58 1.19 Allowed Glycine 0 CA--C 1.522 0.53 0 N-CA-C 110.474 -1.051 . . . . 0.0 110.474 -179.318 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 1.7 t -137.22 162.99 31.97 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 121.052 -0.259 . . . . 0.0 110.719 -179.383 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.5 mt -91.6 141.97 13.71 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.101 179.445 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . 0.532 ' H ' ' HE1' ' A' ' 44' ' ' TRP . 9.3 m-20 -113.77 119.21 36.56 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.987 -0.552 . . . . 0.0 111.503 179.835 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.435 HG23 HD13 ' A' ' 53' ' ' ILE . 27.8 mm -95.21 -57.01 4.69 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 C-N-CA 120.768 -0.373 . . . . 0.0 110.963 178.694 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 99.7 mttt -75.81 -46.73 28.98 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-O 121.137 0.494 . . . . 0.0 111.52 -179.784 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 79.7 mtp180 -60.56 -32.4 71.47 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 116.031 -0.531 . . . . 0.0 109.897 -179.668 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 26.9 t-105 -59.67 -36.86 77.3 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 116.039 -0.528 . . . . 0.0 109.759 178.691 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 63.3 ttm-85 -66.75 -38.22 86.19 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.498 179.505 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 82.7 mtp180 -57.22 -48.09 79.69 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 120.577 -0.449 . . . . 0.0 111.318 -179.122 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 4.3 p -66.14 -34.25 68.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 C-N-CA 120.602 -0.439 . . . . 0.0 110.059 179.461 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -66.22 -38.85 94.17 Favored Glycine 0 CA--C 1.526 0.772 0 N-CA-C 111.197 -0.761 . . . . 0.0 111.197 179.545 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 99.9 m-20 -62.46 -46.02 90.41 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.758 0.313 . . . . 0.0 111.07 -179.524 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 88.6 m -65.74 -42.48 90.95 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.173 0.511 . . . . 0.0 110.305 179.941 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 6.8 m-85 -67.47 -30.05 69.66 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.289 179.572 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 59.7 tt0 -62.33 -43.75 98.09 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.228 -179.888 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 31.3 t0 -61.28 -50.74 71.81 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.11 0.481 . . . . 0.0 110.422 179.232 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' TYR . . . . . 0.464 ' O ' ' OG1' ' A' ' 69' ' ' THR . 34.0 m-85 -62.88 -34.91 78.37 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.075 -0.512 . . . . 0.0 109.947 179.318 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . 0.548 ' CE2' ' O ' ' A' ' 71' ' ' GLY . 76.2 t80 -62.43 -36.85 83.68 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.005 -0.543 . . . . 0.0 109.96 179.679 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 23.5 m-20 -62.63 -37.77 87.63 Favored 'General case' 0 CA--C 1.519 -0.217 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.334 179.801 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.464 ' OG1' ' O ' ' A' ' 66' ' ' TYR . 66.5 p -61.27 -19.45 61.73 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 119.812 -0.755 . . . . 0.0 109.16 179.957 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 60.0 m-85 -99.27 -49.99 4.28 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 112.752 0.649 . . . . 0.0 112.752 179.731 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . 0.548 ' O ' ' CE2' ' A' ' 67' ' ' TYR . . . 173.02 92.73 0.08 OUTLIER Glycine 0 CA--C 1.537 1.429 0 N-CA-C 111.024 -0.83 . . . . 0.0 111.024 -178.874 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_endo -84.23 16.06 2.02 Favored 'Trans proline' 0 N--CA 1.487 1.103 0 C-N-CA 124.12 3.214 . . . . 0.0 111.182 179.458 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 92.4 mt-10 -88.24 -49.65 6.85 Favored 'General case' 0 CA--C 1.51 -0.583 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.248 -178.896 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.423 ' O ' ' O ' ' A' ' 75' ' ' VAL . 0.5 OUTLIER -62.14 -44.31 96.9 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.015 -0.993 . . . . 0.0 110.614 179.671 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.423 ' O ' ' O ' ' A' ' 74' ' ' LYS . 78.8 t 36.31 94.16 0.04 OUTLIER Pre-proline 0 N--CA 1.467 0.408 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.395 -179.52 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_exo -57.63 126.21 21.14 Favored 'Trans proline' 0 N--CA 1.493 1.473 0 C-N-CA 121.377 1.385 . . . . 0.0 112.283 -179.672 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 60.6 t -83.83 -25.9 7.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.905 179.144 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 22.0 p -44.73 -24.25 0.19 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.499 -179.112 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -59.86 -40.67 89.41 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.348 179.635 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 35.9 t80 -64.61 -39.47 93.78 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.717 179.872 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 11.6 t -58.66 -46.67 86.66 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.028 -179.409 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 14.6 m-85 -62.7 -49.07 76.55 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.731 -0.388 . . . . 0.0 110.942 179.622 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' TRP . . . . . . . . . . . . . 53.1 t90 -53.82 -39.17 65.29 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.579 -179.576 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 92.8 m-20 -61.64 -47.02 87.27 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 120.473 -0.491 . . . . 0.0 111.167 -179.431 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 36.5 tp -72.63 -54.58 8.68 Favored 'General case' 0 C--O 1.221 -0.444 0 C-N-CA 120.186 -0.606 . . . . 0.0 110.496 179.717 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -55.56 -26.09 18.99 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-O 120.765 0.317 . . . . 0.0 110.507 179.575 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 70.8 tttt -65.66 -51.46 59.33 Favored 'General case' 0 C--N 1.322 -0.613 0 C-N-CA 119.966 -0.693 . . . . 0.0 110.224 179.952 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . 0.401 ' O ' ' OE1' ' A' ' 88' ' ' GLU . 1.1 pp20? -80.07 -19.77 46.74 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.009 -179.498 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 14.6 tp -61.68 -44.37 97.08 Favored 'General case' 0 N--CA 1.446 -0.639 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.901 -179.142 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 3.4 mt -64.02 -43.78 97.65 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.109 0 C-N-CA 120.174 -0.611 . . . . 0.0 109.833 -179.406 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 95.8 m-20 -64.14 -14.84 57.76 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.65 -179.345 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 21.1 tttt -79.48 153.54 29.53 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.519 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -92.74 -9.44 40.65 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.777 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -63.2 -18.26 63.3 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.427 179.961 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 10.9 t -69.3 134.17 30.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.144 -179.732 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' ASN . . . . . 0.564 ' O ' ' N ' ' A' ' 98' ' ' GLN . 0.7 OUTLIER -55.42 161.23 3.04 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.889 -179.579 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_exo -42.61 -12.93 0.04 OUTLIER 'Trans proline' 0 N--CA 1.491 1.346 0 C-N-CA 123.006 2.471 . . . . 0.0 112.23 178.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . 0.564 ' N ' ' O ' ' A' ' 96' ' ' ASN . 2.2 pt20 -46.87 -25.29 0.74 Allowed 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.425 -179.672 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 93.5 t -63.05 -50.23 80.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.019 -179.524 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 97.5 mmm -77.19 -38.1 52.22 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.694 179.708 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . 0.453 ' O ' ' OE2' ' A' ' 48' ' ' GLU . . . -65.58 -34.61 78.65 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.662 -179.934 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -56.86 -16.19 6.23 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.732 -179.901 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 76.3 t -64.08 -24.5 35.89 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 CA-C-N 116.51 -0.313 . . . . 0.0 110.579 179.509 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . 0.525 ' O ' ' N ' ' A' ' 106' ' ' THR . . . -62.38 -39.13 92.2 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.455 -0.339 . . . . 0.0 110.582 -179.958 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 87.4 mt-30 52.08 -85.35 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.616 179.865 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' THR . . . . . 0.525 ' N ' ' O ' ' A' ' 104' ' ' ALA . 58.6 p -83.07 167.55 17.75 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.619 179.984 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 85.1 mt-10 -132.71 167.95 19.2 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.044 -179.741 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . 0.497 ' N ' ' OE1' ' A' ' 108' ' ' GLU . 57.1 mp0 -101.39 121.38 41.81 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.77 -0.456 . . . . 0.0 109.77 179.096 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 45.0 pt -46.34 -17.06 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.202 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.47 ' H ' ' C ' ' A' ' 108' ' ' GLU . 34.1 mt -63.82 -42.12 97.72 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.297 179.685 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . 0.433 ' O ' ' O ' ' A' ' 114' ' ' SER . 88.6 tttt -63.84 -44.28 93.67 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.527 179.437 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' SER . . . . . 0.423 ' O ' ' O ' ' A' ' 111' ' ' LYS . 1.2 p 38.66 -161.44 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.877 179.921 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' ASN . . . . . 0.42 ' N ' ' OG ' ' A' ' 112' ' ' SER . 94.2 m-20 -63.62 -43.12 97.78 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.745 -179.52 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' SER . . . . . 0.433 ' O ' ' O ' ' A' ' 111' ' ' LYS . 6.4 m -93.9 129.05 40.49 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.277 179.96 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 84.9 mt-30 -86.92 34.58 0.67 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.838 0.351 . . . . 0.0 110.309 -179.776 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 64.1 p -65.75 -31.14 71.96 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.409 -179.858 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 97.0 m-20 -84.08 -53.99 5.15 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.527 179.777 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 54.2 tp -63.56 -42.47 98.35 Favored 'General case' 0 N--CA 1.461 0.122 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.801 -179.818 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 63.0 mm-40 56.75 60.16 3.19 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.511 -0.313 . . . . 0.0 110.649 -179.617 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 60.9 t-80 -80.13 139.0 37.02 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.57 179.962 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 75.3 m80 -116.22 143.26 45.75 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.772 179.859 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 97.3 m-70 -110.3 139.27 45.65 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.507 -179.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 74.8 m80 -112.06 141.25 45.96 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.391 179.799 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 124' ' ' HIS . . . . . . . . . . . . . 91.1 m-70 -117.22 146.14 43.45 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.458 -179.92 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 73.9 m-70 . . . . . 0 C--O 1.22 -0.478 0 CA-C-O 117.992 -1.004 . . . . 0.0 110.504 -179.875 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 201' ' ' MYR . . . . . 0.617 ' H72' ' O ' ' A' ' 49' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.675 0 N-CA-C 110.873 -0.891 . . . . 0.0 110.873 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 86.7 mt-30 -63.72 -34.1 77.13 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.807 0.337 . . . . 0.0 110.709 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -46.96 -24.34 0.59 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.677 179.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 34.6 tp -48.99 -34.19 12.57 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-O 121.103 0.478 . . . . 0.0 110.232 -179.55 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 46.5 m -54.66 -37.78 66.13 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.115 179.871 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 97.5 mm-40 -62.79 -32.06 73.16 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.375 179.804 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 59.8 t-80 -60.63 -43.89 96.99 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.933 0.397 . . . . 0.0 110.376 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 81.2 tt0 -60.59 -51.28 70.1 Favored 'General case' 0 C--O 1.244 0.808 0 CA-C-O 121.335 0.588 . . . . 0.0 110.105 179.729 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.413 ' O ' ' CB ' ' A' ' 14' ' ' GLN . 76.3 mtt-85 -62.56 -31.52 72.33 Favored 'General case' 0 C--O 1.211 -0.938 0 CA-C-N 115.897 -0.592 . . . . 0.0 109.458 179.513 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.461 ' OH ' ' CD2' ' A' ' 89' ' ' LEU . 36.5 t80 -60.23 -37.59 80.81 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 120.936 -0.306 . . . . 0.0 110.326 -179.52 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 2.4 t -62.75 -49.69 82.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 C-N-CA 120.056 -0.657 . . . . 0.0 110.914 -179.803 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 95.6 mt-10 -79.25 -35.9 40.77 Favored 'General case' 0 C--N 1.326 -0.436 0 C-N-CA 120.398 -0.521 . . . . 0.0 111.682 -179.302 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . 0.413 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 70.9 tp60 -69.15 -52.39 28.58 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.199 -178.941 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -61.73 -45.64 93.05 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 -179.406 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 63.9 mttm -55.51 -35.94 66.15 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 120.482 -0.487 . . . . 0.0 110.156 179.486 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 77.3 mt-30 -71.87 -42.0 67.36 Favored 'General case' 0 C--O 1.241 0.641 0 CA-C-O 121.264 0.554 . . . . 0.0 110.552 178.64 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -54.23 -45.18 72.25 Favored 'General case' 0 C--O 1.223 -0.31 0 CA-C-N 115.788 -0.642 . . . . 0.0 109.599 179.93 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.503 ' O ' ' N ' ' A' ' 22' ' ' ARG . 4.4 mt -65.62 -37.9 87.88 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.856 0.36 . . . . 0.0 110.511 178.666 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 77.0 tttt -44.07 -36.74 2.69 Favored 'General case' 0 C--N 1.321 -0.637 0 C-N-CA 120.537 -0.465 . . . . 0.0 109.848 -179.44 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' THR . . . . . 0.534 ' C ' ' H ' ' A' ' 23' ' ' GLY . 1.2 t -63.27 -32.06 73.37 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.215 179.318 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.503 ' N ' ' O ' ' A' ' 19' ' ' LEU . 26.3 mmt-85 -73.46 19.53 0.1 Allowed 'General case' 0 N--CA 1.462 0.162 0 CA-C-O 120.959 0.409 . . . . 0.0 110.546 -179.715 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . 0.534 ' H ' ' C ' ' A' ' 21' ' ' THR . . . 81.45 15.34 76.49 Favored Glycine 0 CA--C 1.524 0.609 0 N-CA-C 110.625 -0.99 . . . . 0.0 110.625 179.974 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 3.4 t -92.61 167.53 1.62 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 N-CA-C 110.097 -0.334 . . . . 0.0 110.097 -179.795 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 55.5 mtmt -128.56 133.21 48.31 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 110.143 -0.317 . . . . 0.0 110.143 179.71 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 2.1 m -133.37 110.54 14.98 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.333 0 CA-C-N 116.62 -0.264 . . . . 0.0 110.512 179.854 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 25.7 pttt -108.92 165.15 11.79 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-O 120.615 0.245 . . . . 0.0 110.459 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 76.3 m-85 -48.52 -39.57 23.78 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.043 0.449 . . . . 0.0 110.318 179.941 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -55.69 -23.17 27.07 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.073 179.516 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.428 ' O ' ' CB ' ' A' ' 34' ' ' PHE . 44.7 t0 -62.14 -44.41 96.69 Favored 'General case' 0 C--O 1.221 -0.395 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.641 -179.719 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.483 ' O ' ' CB ' ' A' ' 35' ' ' PHE . 5.2 mp -68.08 -40.06 82.75 Favored 'General case' 0 C--O 1.218 -0.558 0 CA-C-O 121.099 0.476 . . . . 0.0 110.11 179.24 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 46.0 mt -58.84 -44.61 90.98 Favored 'General case' 0 C--N 1.317 -0.84 0 C-N-CA 119.856 -0.738 . . . . 0.0 110.862 -178.634 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.619 ' NZ ' ' CE2' ' A' ' 67' ' ' TYR . 88.3 tttt -85.61 -49.09 8.29 Favored 'General case' 0 C--N 1.321 -0.631 0 C-N-CA 120.741 -0.384 . . . . 0.0 111.704 -179.325 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . 0.428 ' CB ' ' O ' ' A' ' 30' ' ' ASP . 54.1 t80 -61.34 -50.52 72.6 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.927 -178.682 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.483 ' CB ' ' O ' ' A' ' 31' ' ' LEU . 6.1 t80 -61.83 -46.95 87.26 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.339 -179.685 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 90.8 m-20 -64.37 -36.18 83.31 Favored 'General case' 0 C--N 1.341 0.202 0 CA-C-O 120.747 0.308 . . . . 0.0 111.478 -179.617 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 1.8 m-85 -58.33 -45.47 88.02 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.854 -179.176 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.542 ' O ' ' N ' ' A' ' 42' ' ' CYS . 19.7 m -79.48 -39.05 20.26 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.871 179.97 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 85.9 tttt -55.21 -28.45 53.2 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.775 -179.229 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 96.5 m-20 -50.41 -63.28 1.17 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.389 -0.368 . . . . 0.0 111.134 -179.43 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' THR . . . . . 0.51 ' O ' ' SG ' ' A' ' 42' ' ' CYS . 22.9 p -114.51 4.48 15.23 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.983 -179.87 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . 0.542 ' N ' ' O ' ' A' ' 38' ' ' VAL . 19.5 p 41.29 54.68 7.9 Favored Pre-proline 0 C--N 1.331 -0.214 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.679 -179.109 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . 0.478 ' C ' ' H ' ' A' ' 45' ' ' PHE . 57.8 Cg_endo -72.93 -25.16 16.78 Favored 'Trans proline' 0 N--CA 1.491 1.352 0 C-N-CA 122.469 2.113 . . . . 0.0 112.142 -179.996 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . 0.742 ' CE2' H141 ' A' ' 201' ' ' MYR . 1.2 t-105 -61.53 -1.41 0.56 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.526 -179.52 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.478 ' H ' ' C ' ' A' ' 43' ' ' PRO . 4.8 t80 50.02 54.36 15.61 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-O 121.021 0.438 . . . . 0.0 110.087 -179.856 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.461 ' CD ' ' N ' ' A' ' 45' ' ' PHE . 29.5 Cg_endo -65.21 -10.55 26.24 Favored 'Trans proline' 0 C--N 1.308 -1.584 0 C-N-CA 122.863 2.375 . . . . 0.0 112.117 179.948 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 86.9 mt-30 -58.44 -52.39 65.84 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.248 -179.613 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.555 ' O ' ' H41' ' A' ' 201' ' ' MYR . 50.2 tt0 -88.81 -13.76 38.61 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.172 179.472 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . 0.472 ' O ' ' H72' ' A' ' 201' ' ' MYR . . . 72.53 65.58 2.29 Favored Glycine 0 CA--C 1.522 0.528 0 N-CA-C 110.494 -1.042 . . . . 0.0 110.494 -179.3 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' THR . . . . . 0.543 ' OG1' ' NE2' ' A' ' 98' ' ' GLN . 2.4 t -136.76 155.88 49.25 Favored 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 120.998 -0.281 . . . . 0.0 110.775 -179.536 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.5 mt -85.24 140.74 15.53 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-O 121.074 0.464 . . . . 0.0 110.537 179.308 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -110.78 121.47 45.43 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.474 -0.785 . . . . 0.0 110.995 179.378 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.417 HD11 HG23 ' A' ' 53' ' ' ILE . 32.6 mm -94.81 -56.53 5.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.203 179.324 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 68.6 mmtt -74.07 -49.04 25.82 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.359 -179.522 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 78.1 mtp85 -61.07 -35.17 76.23 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.212 -179.742 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 22.8 t-105 -61.94 -38.54 88.83 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.791 179.407 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 61.7 ttt85 -62.86 -39.05 93.23 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.276 -179.901 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -59.23 -50.75 72.82 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 120.89 -0.324 . . . . 0.0 111.103 -179.345 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 6.4 p -73.54 -36.85 48.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-O 120.84 0.352 . . . . 0.0 110.825 179.748 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . 0.428 ' O ' ' CB ' ' A' ' 64' ' ' GLN . . . -64.06 -54.85 27.66 Favored Glycine 0 C--O 1.223 -0.59 0 N-CA-C 111.438 -0.665 . . . . 0.0 111.438 -179.104 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 62.5 m-20 -63.35 -35.86 81.8 Favored 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 120.828 -0.349 . . . . 0.0 110.581 -179.536 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 3.8 m -64.01 -62.57 1.55 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.841 0.353 . . . . 0.0 111.355 -179.509 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 21.1 m-85 -63.5 -41.97 98.52 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.972 -179.701 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . 0.511 ' O ' ' ND2' ' A' ' 68' ' ' ASN . 56.7 tt0 -62.92 -42.21 99.72 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.877 -179.582 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 24.5 t0 -54.7 -56.75 15.85 Favored 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 120.476 -0.49 . . . . 0.0 110.944 -179.61 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 65.2 m-85 -64.46 -41.47 96.49 Favored 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 120.678 -0.409 . . . . 0.0 110.787 179.846 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . 0.619 ' CE2' ' NZ ' ' A' ' 33' ' ' LYS . 65.6 t80 -57.61 -41.0 80.4 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.618 -179.403 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . 0.511 ' ND2' ' O ' ' A' ' 64' ' ' GLN . 3.1 m120 -62.15 -43.82 97.99 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.122 -179.075 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 81.1 p -77.69 -18.64 56.42 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.238 -179.812 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 34.9 m-85 -109.73 16.09 22.32 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.381 179.933 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -160.41 -108.32 0.23 Allowed Glycine 0 CA--C 1.532 1.147 0 C-N-CA 120.539 -0.838 . . . . 0.0 111.213 -179.947 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 65.3 Cg_endo -73.71 141.49 30.84 Favored 'Trans proline' 0 N--CA 1.497 1.715 0 C-N-CA 121.98 1.787 . . . . 0.0 113.211 -179.487 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 81.5 tt0 -86.44 -43.38 12.84 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.548 179.343 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.572 ' CD ' ' H ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -82.75 -26.67 31.67 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 115.892 -0.595 . . . . 0.0 111.326 -179.46 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.54 ' H ' ' HD3' ' A' ' 74' ' ' LYS . 87.5 t 57.38 115.57 0.02 OUTLIER Pre-proline 0 N--CA 1.45 -0.436 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.683 -179.554 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_exo -53.73 127.84 27.1 Favored 'Trans proline' 0 N--CA 1.495 1.576 0 C-N-CA 121.473 1.449 . . . . 0.0 111.697 179.74 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 61.1 t -82.65 -7.42 10.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.98 179.827 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 68.2 p -48.95 -22.02 0.77 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.549 -179.455 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.06 -27.06 68.63 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.532 179.722 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 34.6 t80 -60.95 -40.44 93.34 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.147 -179.815 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 20.9 m -57.98 -42.08 84.35 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.527 -179.687 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 13.5 m-85 -57.35 -53.8 54.03 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.772 -0.371 . . . . 0.0 110.621 -179.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' TRP . . . . . 0.484 ' C ' ' CD1' ' A' ' 83' ' ' TRP . 9.0 t-105 -56.39 -40.55 74.81 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.499 -179.983 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 83.8 m-20 -61.27 -45.41 94.61 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 120.484 -0.486 . . . . 0.0 111.111 -179.01 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 42.4 tp -72.83 -57.62 3.94 Favored 'General case' 0 C--O 1.218 -0.567 0 C-N-CA 120.337 -0.545 . . . . 0.0 110.574 179.84 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -53.75 -26.41 13.68 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 C-N-CA 120.733 -0.387 . . . . 0.0 110.379 179.452 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . 0.415 ' CB ' ' O ' ' A' ' 83' ' ' TRP . 64.2 tttt -65.44 -50.93 63.56 Favored 'General case' 0 C--N 1.322 -0.608 0 C-N-CA 120.404 -0.519 . . . . 0.0 110.393 179.938 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . 0.434 ' O ' ' OD1' ' A' ' 91' ' ' ASP . 1.1 pp20? -80.75 -19.71 44.33 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.774 179.954 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.461 ' CD2' ' OH ' ' A' ' 11' ' ' TYR . 12.6 tp -62.17 -43.76 98.12 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.322 -178.746 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 3.1 mt -63.69 -45.47 97.33 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 C-N-CA 120.271 -0.572 . . . . 0.0 110.847 -178.783 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . 0.434 ' OD1' ' O ' ' A' ' 88' ' ' GLU . 4.4 p30 -81.64 -4.92 57.45 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.433 -0.348 . . . . 0.0 111.075 -178.757 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . 0.471 ' O ' ' CB ' ' A' ' 93' ' ' LYS . 86.4 tttt -57.24 -15.71 6.59 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.633 -179.904 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . 0.471 ' CB ' ' O ' ' A' ' 92' ' ' LYS . 59.4 tttt 79.63 -68.11 0.13 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.731 179.805 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 70.3 tt0 -73.94 54.7 0.52 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.057 0.456 . . . . 0.0 110.005 -179.741 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.441 ' O ' ' O ' ' A' ' 96' ' ' ASN . 1.9 t -87.46 164.76 2.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.4 -179.636 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' ASN . . . . . 0.601 ' O ' ' N ' ' A' ' 98' ' ' GLN . 0.0 OUTLIER -42.19 167.04 0.07 OUTLIER Pre-proline 0 C--N 1.327 -0.395 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.353 179.731 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 77.0 Cg_exo -40.38 -14.01 0.03 OUTLIER 'Trans proline' 0 C--N 1.312 -1.386 0 C-N-CA 122.844 2.363 . . . . 0.0 112.485 179.174 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . 0.601 ' N ' ' O ' ' A' ' 96' ' ' ASN . 12.1 tt0 -46.14 -33.19 3.38 Favored 'General case' 0 C--N 1.322 -0.629 0 C-N-CA 120.799 -0.361 . . . . 0.0 110.174 179.17 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 96.7 t -62.16 -49.72 82.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 C-N-CA 120.453 -0.499 . . . . 0.0 110.927 -178.877 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 98.6 mtp -80.41 -43.57 20.78 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.279 -0.418 . . . . 0.0 111.049 179.845 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -61.85 -27.25 68.65 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.406 -179.572 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . 0.401 ' CB ' ' O ' ' A' ' 98' ' ' GLN . . . -63.5 -15.54 58.15 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.379 -179.991 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 71.5 t -63.73 -18.43 22.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.781 -179.925 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -54.42 -41.59 69.51 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.66 -179.632 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 99.4 mm-40 -40.43 114.97 0.5 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.559 179.84 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 45.3 p -67.37 -32.76 73.89 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.698 179.945 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 46.4 mm-40 -74.93 155.02 37.88 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.605 -179.836 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . 0.592 ' C ' ' H ' ' A' ' 110' ' ' LEU . 99.3 mt-10 -89.85 135.11 33.83 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.177 179.536 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 47.3 pt -59.14 0.77 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 115.965 -0.562 . . . . 0.0 110.201 179.564 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.592 ' H ' ' C ' ' A' ' 108' ' ' GLU . 96.6 mt -100.73 -9.43 21.8 Favored 'General case' 0 C--N 1.334 -0.097 0 C-N-CA 120.592 -0.443 . . . . 0.0 110.507 -179.857 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . 0.454 ' O ' ' O ' ' A' ' 114' ' ' SER . 86.3 tttt -71.3 -13.38 61.87 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.676 179.927 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 11.7 t -58.93 -45.38 90.53 Favored 'General case' 0 C--N 1.326 -0.45 0 C-N-CA 120.724 -0.391 . . . . 0.0 110.613 -179.895 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 13.4 m120 -64.54 -41.89 96.07 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.867 -179.785 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' SER . . . . . 0.454 ' O ' ' O ' ' A' ' 111' ' ' LYS . 35.5 t -158.5 177.99 10.63 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.468 -179.815 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 95.5 mt-30 -53.5 -41.52 66.37 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.945 0.402 . . . . 0.0 110.467 -179.812 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' THR . . . . . 0.629 ' HG1' ' H ' ' A' ' 119' ' ' GLU . 62.8 p -146.75 162.88 37.63 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.571 179.749 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -62.05 -45.08 95.1 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 120.92 -0.312 . . . . 0.0 110.517 179.452 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . 0.431 ' O ' ' O ' ' A' ' 119' ' ' GLU . 58.9 tp -64.07 -43.37 95.66 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.35 -0.387 . . . . 0.0 110.247 179.739 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . 0.629 ' H ' ' HG1' ' A' ' 116' ' ' THR . 78.8 tt0 58.94 148.76 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.19 -179.63 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 58.1 m80 -125.24 140.41 52.87 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.54 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 95.4 m-70 -107.71 130.6 54.92 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.424 -179.938 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 96.5 m-70 -116.41 145.88 42.93 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.971 -0.558 . . . . 0.0 110.548 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 88.8 m-70 -109.02 131.73 54.79 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.539 179.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 124' ' ' HIS . . . . . . . . . . . . . 89.0 m-70 -126.85 138.28 53.3 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.523 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 93.5 m-70 . . . . . 0 C--O 1.22 -0.449 0 CA-C-O 117.936 -1.031 . . . . 0.0 110.606 179.942 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 201' ' ' MYR . . . . . 0.742 H141 ' CE2' ' A' ' 44' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.695 0 N-CA-C 111.134 -0.787 . . . . 0.0 111.134 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 99.3 mm-40 -56.92 -28.43 62.01 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.819 0.342 . . . . 0.0 110.34 -179.799 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . 0.541 ' HB2' ' H22' ' A' ' 201' ' ' MYR . 91.0 mt-10 -57.67 -21.54 40.74 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.563 179.853 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 49.9 tp -40.46 -30.3 0.11 Allowed 'General case' 0 C--O 1.234 0.279 0 CA-C-O 121.004 0.431 . . . . 0.0 110.358 -179.31 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 16.3 t -59.88 -42.43 93.74 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 120.693 -0.403 . . . . 0.0 109.924 179.42 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . 0.499 ' N ' ' O ' ' A' ' 4' ' ' GLU . 87.0 mt-30 -61.39 -35.42 77.43 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.666 179.689 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 63.3 t60 -57.33 -44.1 83.95 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.059 -179.822 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 81.0 mm-40 -61.33 -45.22 95.35 Favored 'General case' 0 C--O 1.241 0.651 0 CA-C-O 121.061 0.457 . . . . 0.0 110.007 179.648 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.427 ' O ' ' CB ' ' A' ' 14' ' ' GLN . 64.5 mtp85 -64.41 -33.25 75.43 Favored 'General case' 0 C--O 1.212 -0.871 0 N-CA-C 109.22 -0.659 . . . . 0.0 109.22 179.636 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 53.4 t80 -60.09 -37.77 80.93 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 120.554 -0.458 . . . . 0.0 110.365 -179.52 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 4.5 t -61.62 -49.44 84.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 C-N-CA 120.056 -0.658 . . . . 0.0 111.048 179.935 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 80.9 mm-40 -80.72 -43.05 20.89 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 120.33 -0.548 . . . . 0.0 111.659 -179.33 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . 0.427 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 69.1 tp60 -61.36 -52.75 63.34 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.881 -0.6 . . . . 0.0 111.325 -178.977 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.21 -45.27 92.45 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 120.649 -0.42 . . . . 0.0 110.086 -179.613 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 92.0 mttt -58.16 -33.57 69.36 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 120.674 -0.411 . . . . 0.0 110.527 179.236 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 76.8 mt-30 -71.95 -41.68 67.48 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.178 0.513 . . . . 0.0 110.446 178.664 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -55.12 -42.98 73.68 Favored 'General case' 0 C--O 1.222 -0.368 0 CA-C-N 116.074 -0.512 . . . . 0.0 109.69 179.843 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.454 ' O ' ' N ' ' A' ' 22' ' ' ARG . 5.0 mt -66.62 -37.96 85.94 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.995 0.426 . . . . 0.0 110.703 178.579 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 61.6 tttm -45.61 -37.36 5.52 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 -179.62 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' THR . . . . . 0.523 ' C ' ' H ' ' A' ' 23' ' ' GLY . 1.0 OUTLIER -61.14 -33.18 73.0 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.01 179.392 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.454 ' N ' ' O ' ' A' ' 19' ' ' LEU . 10.3 mmm180 -72.93 15.63 0.19 Allowed 'General case' 0 N--CA 1.464 0.266 0 CA-C-O 120.868 0.366 . . . . 0.0 110.41 -179.633 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . 0.523 ' H ' ' C ' ' A' ' 21' ' ' THR . . . 84.41 13.67 72.94 Favored Glycine 0 CA--C 1.525 0.696 0 N-CA-C 110.561 -1.016 . . . . 0.0 110.561 -179.872 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 11.7 t -88.01 167.65 1.69 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 N-CA-C 110.314 -0.254 . . . . 0.0 110.314 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -130.0 129.85 44.25 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.214 179.616 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 3.6 m -128.15 108.56 17.99 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.307 0 CA-C-N 116.503 -0.317 . . . . 0.0 110.543 -179.884 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.511 ' HD3' ' H ' ' A' ' 29' ' ' ALA . 12.5 tmtt? -109.49 165.22 11.82 Favored 'General case' 0 CA--C 1.527 0.074 0 N-CA-C 109.959 -0.385 . . . . 0.0 109.959 -179.824 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 89.8 m-85 -47.06 -35.94 7.5 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.923 0.392 . . . . 0.0 110.246 -179.973 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.511 ' H ' ' HD3' ' A' ' 27' ' ' LYS . . . -57.95 -24.03 56.25 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 121.185 0.517 . . . . 0.0 110.042 179.452 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.417 ' N ' ' O ' ' A' ' 27' ' ' LYS . 65.9 t0 -60.66 -48.36 82.14 Favored 'General case' 0 C--O 1.222 -0.367 0 CA-C-N 115.606 -0.724 . . . . 0.0 110.594 -179.697 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.504 ' O ' ' CB ' ' A' ' 35' ' ' PHE . 5.4 mp -63.72 -42.09 97.98 Favored 'General case' 0 C--O 1.217 -0.631 0 CA-C-O 121.048 0.452 . . . . 0.0 110.155 179.448 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 30.4 mt -59.29 -44.95 92.45 Favored 'General case' 0 C--N 1.31 -1.119 0 C-N-CA 119.332 -0.947 . . . . 0.0 110.423 -178.892 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.465 ' O ' ' CD1' ' A' ' 37' ' ' PHE . 99.7 mttt -73.96 -41.68 61.62 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.075 -0.511 . . . . 0.0 112.366 -179.189 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 5.1 m-85 -83.07 -61.59 1.82 Allowed 'General case' 0 CA--C 1.511 -0.534 0 C-N-CA 120.738 -0.385 . . . . 0.0 111.214 -178.664 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.504 ' CB ' ' O ' ' A' ' 31' ' ' LEU . 17.1 t80 -41.98 -45.91 3.97 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.198 -179.322 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 80.1 m-20 -72.74 -41.49 65.08 Favored 'General case' 0 CA--C 1.529 0.164 0 C-N-CA 120.291 -0.564 . . . . 0.0 111.809 -179.44 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.465 ' CD1' ' O ' ' A' ' 33' ' ' LYS . 3.5 m-30 -63.34 -51.13 67.26 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 111.975 0.361 . . . . 0.0 111.975 -178.037 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.536 ' O ' ' N ' ' A' ' 42' ' ' CYS . 6.5 m -67.68 -42.65 86.64 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.716 -179.563 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.424 ' H ' HG22 ' A' ' 38' ' ' VAL . 88.4 tttt -65.47 -30.57 71.37 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.137 179.982 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 57.2 t0 -54.21 -49.23 69.88 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 120.84 -0.344 . . . . 0.0 110.544 -179.233 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 9.5 p -109.2 -8.67 15.09 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.037 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . 0.536 ' N ' ' O ' ' A' ' 38' ' ' VAL . 16.9 m 42.43 55.9 10.3 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.498 -179.526 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . 0.566 ' C ' ' H ' ' A' ' 45' ' ' PHE . 74.3 Cg_endo -78.33 -26.63 5.99 Favored 'Trans proline' 0 N--CA 1.491 1.361 0 C-N-CA 122.491 2.127 . . . . 0.0 112.997 -179.358 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . 0.413 ' CH2' ' CE3' ' A' ' 56' ' ' TRP . 0.0 OUTLIER -71.78 22.49 0.05 OUTLIER 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.968 -179.624 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.566 ' H ' ' C ' ' A' ' 43' ' ' PRO . 33.6 t80 40.03 61.63 6.16 Favored Pre-proline 0 C--N 1.326 -0.423 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.214 -179.091 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.451 ' HD3' ' N ' ' A' ' 45' ' ' PHE . 32.4 Cg_exo -60.39 -12.1 19.11 Favored 'Trans proline' 0 N--CA 1.496 1.657 0 C-N-CA 122.654 2.236 . . . . 0.0 112.257 -179.68 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 88.6 mt-30 -53.31 -53.96 43.32 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 120.534 -0.466 . . . . 0.0 110.45 -179.01 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.415 ' O ' ' H52' ' A' ' 201' ' ' MYR . 34.0 tp10 -88.93 -29.46 19.55 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.886 -0.413 . . . . 0.0 109.886 178.819 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . 0.411 ' HA3' ' H81' ' A' ' 201' ' ' MYR . . . 83.9 61.77 1.82 Allowed Glycine 0 CA--C 1.528 0.847 0 N-CA-C 110.01 -1.236 . . . . 0.0 110.01 -178.33 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 13.8 t -131.2 169.91 15.29 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-O 120.664 0.269 . . . . 0.0 110.524 -179.115 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.1 mt -87.02 132.14 33.21 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.314 0 C-N-CA 120.709 -0.397 . . . . 0.0 110.228 178.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -118.37 121.0 39.29 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.221 179.54 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 16.8 mm -91.74 -47.07 14.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.195 -179.578 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -64.11 -48.93 74.22 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-O 121.01 0.433 . . . . 0.0 111.152 -179.398 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 78.6 mmt-85 -64.7 -33.58 76.29 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.116 -179.745 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' TRP . . . . . 0.413 ' CE3' ' CH2' ' A' ' 44' ' ' TRP . 37.5 t-105 -59.81 -39.87 86.46 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-O 120.955 0.407 . . . . 0.0 110.269 -179.803 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 87.7 mtm180 -64.67 -38.34 90.67 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.453 -179.922 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 68.4 mmt-85 -60.59 -51.69 68.34 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.824 -0.35 . . . . 0.0 111.218 -179.643 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 3.5 p -66.16 -35.52 75.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.329 179.707 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -66.96 -45.03 87.07 Favored Glycine 0 CA--C 1.526 0.733 0 N-CA-C 111.246 -0.742 . . . . 0.0 111.246 179.867 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 99.8 m-20 -63.34 -43.84 96.57 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.718 0.294 . . . . 0.0 111.28 -179.577 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 74.8 m -64.14 -47.42 80.01 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.012 0.434 . . . . 0.0 110.557 -179.738 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 8.0 m-85 -66.4 -33.85 76.63 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.534 179.55 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 70.4 tp60 -57.69 -43.07 84.84 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.843 0.354 . . . . 0.0 110.295 -179.831 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -62.92 -52.8 61.65 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.922 0.391 . . . . 0.0 110.542 179.612 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' TYR . . . . . 0.442 ' O ' ' OG1' ' A' ' 69' ' ' THR . 38.7 m-85 -65.03 -25.23 67.75 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.476 179.399 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 61.5 t80 -65.5 -45.13 84.78 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.424 -179.912 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 88.6 m-20 -64.4 -39.45 93.87 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.592 -179.523 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.442 ' OG1' ' O ' ' A' ' 66' ' ' TYR . 82.2 p -49.77 -35.62 23.06 Favored 'General case' 0 C--N 1.324 -0.53 0 C-N-CA 120.578 -0.449 . . . . 0.0 111.159 -179.039 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 14.9 m-85 -67.36 -46.56 73.01 Favored 'General case' 0 C--N 1.321 -0.653 0 C-N-CA 119.888 -0.725 . . . . 0.0 111.056 -179.09 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . 0.416 ' H ' ' HD3' ' A' ' 72' ' ' PRO . . . 112.6 71.91 0.6 Allowed Glycine 0 N--CA 1.471 1.003 0 N-CA-C 110.952 -0.859 . . . . 0.0 110.952 -179.933 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . 0.416 ' HD3' ' H ' ' A' ' 71' ' ' GLY . 25.1 Cg_exo -62.02 143.69 95.36 Favored 'Trans proline' 0 N--CA 1.498 1.766 0 C-N-CA 123.247 2.631 . . . . 0.0 111.379 179.809 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 83.5 tt0 -74.93 -49.79 18.99 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-O 120.874 0.368 . . . . 0.0 110.544 -179.728 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.44 ' CD ' ' N ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -138.46 4.42 2.4 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.594 -179.547 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 63.8 t 57.42 92.97 0.06 OUTLIER Pre-proline 0 CA--C 1.534 0.331 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.068 -178.632 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_exo -54.15 125.71 19.71 Favored 'Trans proline' 0 N--CA 1.491 1.348 0 C-N-CA 121.722 1.615 . . . . 0.0 112.303 -178.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . 0.427 ' O ' ' N ' ' A' ' 80' ' ' PHE . 43.6 t -84.67 -20.22 8.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.773 179.313 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' THR . . . . . 0.448 ' O ' ' OG ' ' A' ' 81' ' ' SER . 57.9 p -41.54 -27.49 0.1 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.585 -179.031 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . 0.409 ' N ' ' O ' ' A' ' 77' ' ' VAL . . . -62.39 -39.91 94.78 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.12 0.486 . . . . 0.0 110.64 179.839 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . 0.427 ' N ' ' O ' ' A' ' 77' ' ' VAL . 3.3 m-85 -62.19 -35.89 80.22 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.428 179.907 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' SER . . . . . 0.448 ' OG ' ' O ' ' A' ' 78' ' ' THR . 54.2 p -60.22 -40.04 88.74 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.244 -179.969 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 13.7 m-85 -60.6 -53.4 57.95 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 120.696 -0.402 . . . . 0.0 110.707 179.816 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' TRP . . . . . . . . . . . . . 31.0 t90 -58.25 -38.68 77.4 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.738 179.806 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 82.3 m-20 -62.01 -45.7 92.43 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 120.684 -0.406 . . . . 0.0 110.957 -179.536 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 43.5 tp -71.45 -54.0 12.11 Favored 'General case' 0 C--O 1.218 -0.561 0 C-N-CA 120.439 -0.505 . . . . 0.0 110.466 179.606 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -57.23 -26.36 25.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-O 120.794 0.33 . . . . 0.0 110.61 179.622 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 66.4 tttt -65.59 -50.84 63.59 Favored 'General case' 0 C--N 1.32 -0.692 0 C-N-CA 120.32 -0.552 . . . . 0.0 110.107 -179.839 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . 0.438 ' O ' ' OE1' ' A' ' 88' ' ' GLU . 1.0 OUTLIER -80.38 -20.03 45.0 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.84 -179.815 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 14.1 tp -61.42 -44.42 97.17 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.47 -179.245 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 3.2 mt -63.52 -43.47 98.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 C-N-CA 120.25 -0.58 . . . . 0.0 109.841 -179.66 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 68.0 t0 -53.0 -43.46 66.49 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.751 -178.739 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 68.2 mmtt -62.5 134.91 57.07 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.954 0.406 . . . . 0.0 110.413 -179.779 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . 0.475 ' C ' ' H ' ' A' ' 95' ' ' VAL . 98.6 mttt -72.52 -9.87 59.09 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.539 -179.921 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 80.3 mm-40 -72.34 43.56 0.11 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.561 179.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.475 ' H ' ' C ' ' A' ' 93' ' ' LYS . 5.7 m -120.03 132.43 69.73 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.19 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.42 179.874 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -49.21 158.82 0.68 Allowed Pre-proline 0 C--N 1.327 -0.389 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.493 -179.628 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -60.55 -12.64 21.79 Favored 'Trans proline' 0 N--CA 1.495 1.59 0 C-N-CA 122.829 2.353 . . . . 0.0 112.061 179.543 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . 0.609 ' OE1' ' H72' ' A' ' 201' ' ' MYR . 8.6 pt20 -47.79 -31.49 4.95 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.785 -179.711 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 81.0 t -62.52 -48.59 87.52 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.928 -179.579 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 91.7 mmm -67.84 -40.38 83.72 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.854 -179.87 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -62.42 -25.31 67.88 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.69 -179.732 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -65.18 -15.8 62.83 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.189 179.798 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.445 ' O ' ' O ' ' A' ' 106' ' ' THR . 71.0 t -63.39 -20.25 25.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.132 179.534 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -49.93 -23.11 1.79 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.654 -179.859 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 69.1 tp60 -63.1 -39.62 95.23 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.411 -179.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' THR . . . . . 0.445 ' O ' ' O ' ' A' ' 103' ' ' VAL . 75.2 p -130.78 152.35 50.23 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.905 0.383 . . . . 0.0 110.762 -179.999 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . 0.525 ' N ' ' OE1' ' A' ' 107' ' ' GLU . 44.3 mp0 -139.71 167.26 22.5 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.349 -179.752 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . 0.473 ' C ' ' H ' ' A' ' 110' ' ' LEU . 81.2 mm-40 -94.21 128.86 40.91 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.071 179.49 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 45.4 pt -47.23 -15.85 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.187 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.473 ' H ' ' C ' ' A' ' 108' ' ' GLU . 34.8 mt -64.01 -42.86 97.01 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.367 179.767 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -70.52 -32.33 69.75 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.542 179.692 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 14.2 t -58.91 -45.77 89.51 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.908 -178.973 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 32.0 t30 -66.37 -46.59 76.17 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.871 0.367 . . . . 0.0 110.858 179.801 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 31.2 p -162.28 158.81 24.78 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.61 179.785 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' GLN . . . . . 0.406 ' O ' ' O ' ' A' ' 118' ' ' LEU . 84.4 mt-30 -99.06 13.04 34.22 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.79 0.329 . . . . 0.0 110.382 179.769 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 14.8 m -59.23 -47.59 84.8 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.147 -179.751 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 99.4 m-20 -65.06 -43.75 91.22 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.568 179.543 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . 0.406 ' O ' ' O ' ' A' ' 115' ' ' GLN . 94.5 mt -128.65 129.95 46.56 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.5 -179.939 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 99.3 mt-10 -118.7 137.22 53.48 Favored 'General case' 0 C--O 1.231 0.094 0 CA-C-N 116.632 -0.258 . . . . 0.0 110.354 179.925 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 79.4 m80 -124.42 139.73 53.62 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.43 -179.932 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 96.1 m-70 -125.49 153.76 43.09 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.471 -179.873 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 42.3 m170 -59.32 -42.88 92.44 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.537 -179.892 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 95.7 m-70 -101.92 130.59 48.46 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.546 179.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 124' ' ' HIS . . . . . . . . . . . . . 69.7 m80 -66.3 -39.08 89.1 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.501 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 85.1 t60 . . . . . 0 C--O 1.22 -0.46 0 CA-C-O 117.97 -1.014 . . . . 0.0 110.611 -179.896 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 201' ' ' MYR . . . . . 0.609 ' H72' ' OE1' ' A' ' 98' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.682 0 N-CA-C 111.033 -0.827 . . . . 0.0 111.033 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 87.6 mt-30 -61.78 -23.22 66.05 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.902 0.382 . . . . 0.0 110.315 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 34.1 tp10 -51.92 -21.68 3.21 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.519 179.898 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.48 ' O ' ' OE1' ' A' ' 9' ' ' GLU . 33.6 tp -41.07 -39.59 1.27 Allowed 'General case' 0 C--O 1.235 0.312 0 CA-C-O 121.026 0.441 . . . . 0.0 110.284 -179.348 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' SER . . . . . 0.418 ' HG ' ' N ' ' A' ' 7' ' ' GLN . 89.9 p -47.53 -36.76 10.9 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 120.758 -0.377 . . . . 0.0 110.244 179.929 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . 0.418 ' N ' ' HG ' ' A' ' 6' ' ' SER . 72.3 tp60 -63.77 -32.46 73.97 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.467 179.608 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . 0.408 ' N ' ' O ' ' A' ' 5' ' ' LEU . 53.9 t60 -59.24 -44.8 92.35 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 120.664 -0.414 . . . . 0.0 110.235 -179.932 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.48 ' OE1' ' O ' ' A' ' 5' ' ' LEU . 56.5 mp0 -61.73 -49.19 77.44 Favored 'General case' 0 C--O 1.244 0.77 0 C-N-CA 120.36 -0.536 . . . . 0.0 110.342 179.707 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.442 ' O ' ' CB ' ' A' ' 14' ' ' GLN . 75.3 mtm-85 -63.8 -31.73 73.0 Favored 'General case' 0 C--O 1.211 -0.968 0 C-N-CA 120.19 -0.604 . . . . 0.0 109.429 179.485 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.49 ' CE1' H143 ' A' ' 201' ' ' MYR . 31.5 t80 -59.86 -36.69 77.4 Favored 'General case' 0 C--N 1.323 -0.575 0 C-N-CA 120.889 -0.324 . . . . 0.0 110.315 -179.664 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 4.0 t -63.78 -49.34 82.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 C-N-CA 120.077 -0.649 . . . . 0.0 111.196 179.924 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -81.22 -34.28 32.3 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 120.438 -0.505 . . . . 0.0 111.874 -179.265 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . 0.442 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 70.5 tp60 -70.39 -52.98 18.51 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.049 -178.93 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.7 -47.01 85.49 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 109.988 -0.375 . . . . 0.0 109.988 -179.501 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -57.32 -32.73 66.99 Favored 'General case' 0 C--N 1.33 -0.257 0 C-N-CA 120.667 -0.413 . . . . 0.0 110.143 179.355 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 56.1 tt0 -71.05 -37.6 72.53 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.98 0.419 . . . . 0.0 110.467 179.304 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -58.14 -36.97 73.75 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.184 -179.858 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.4 mt -82.16 -27.04 32.91 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.01 0.433 . . . . 0.0 110.48 179.376 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -55.77 -37.73 68.93 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.072 -179.783 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 1.3 t -76.56 -20.82 56.44 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.633 179.817 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 61.0 mmt-85 -73.7 -3.31 27.52 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 120.769 0.318 . . . . 0.0 110.308 179.67 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 107.0 19.67 9.37 Favored Glycine 0 CA--C 1.526 0.747 0 N-CA-C 110.728 -0.949 . . . . 0.0 110.728 -179.601 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.415 ' CG1' ' N ' ' A' ' 25' ' ' LYS . 26.2 t -105.35 167.43 3.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 N-CA-C 110.327 -0.249 . . . . 0.0 110.327 -179.934 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.415 ' N ' ' CG1' ' A' ' 24' ' ' VAL . 99.6 mttt -125.86 131.99 52.28 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.348 179.359 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . 0.499 ' CG1' ' HH ' ' A' ' 82' ' ' TYR . 1.7 m -134.79 108.94 11.09 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.289 0 CA-C-N 116.506 -0.315 . . . . 0.0 110.355 179.838 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.552 ' HD3' ' H ' ' A' ' 29' ' ' ALA . 14.5 tmtt? -109.25 161.72 14.97 Favored 'General case' 0 C--O 1.221 -0.398 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 179.976 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 58.0 t80 -40.58 -29.58 0.09 Allowed 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.095 0.474 . . . . 0.0 110.966 179.588 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.552 ' H ' ' HD3' ' A' ' 27' ' ' LYS . . . -60.65 -24.44 65.56 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.835 -179.797 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.84 -45.77 91.05 Favored 'General case' 0 C--O 1.221 -0.426 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.406 -179.335 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.485 ' O ' ' CB ' ' A' ' 35' ' ' PHE . 5.5 mp -64.77 -41.03 96.17 Favored 'General case' 0 C--O 1.216 -0.693 0 CA-C-O 120.989 0.423 . . . . 0.0 110.156 179.591 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 56.2 mt -55.34 -46.1 76.4 Favored 'General case' 0 C--N 1.316 -0.869 0 C-N-CA 119.453 -0.899 . . . . 0.0 111.118 -178.765 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.422 ' NZ ' ' CZ ' ' A' ' 37' ' ' PHE . 63.9 tttm -84.68 -50.45 7.63 Favored 'General case' 0 C--N 1.32 -0.676 0 C-N-CA 120.496 -0.482 . . . . 0.0 111.771 -179.25 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 74.9 t80 -61.16 -50.42 73.25 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.312 -178.786 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.485 ' CB ' ' O ' ' A' ' 31' ' ' LEU . 17.7 t80 -60.75 -46.12 91.66 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.29 -179.36 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 91.7 m-20 -70.17 -25.27 63.36 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 120.601 -0.44 . . . . 0.0 111.339 -179.541 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.422 ' CZ ' ' NZ ' ' A' ' 33' ' ' LYS . 0.9 OUTLIER -65.03 -53.43 46.05 Favored 'General case' 0 N--CA 1.462 0.143 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.593 -179.074 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.505 ' O ' ' N ' ' A' ' 42' ' ' CYS . 2.6 m -72.86 -39.46 58.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 C-N-CA 120.481 -0.488 . . . . 0.0 111.037 -179.579 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 25.1 mmtt -57.93 -25.82 61.4 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.724 -179.528 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 85.3 m-20 -49.84 -63.6 1.06 Allowed 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 120.684 -0.406 . . . . 0.0 111.004 179.933 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' THR . . . . . 0.4 ' C ' ' SG ' ' A' ' 42' ' ' CYS . 1.6 p -114.59 -11.01 12.45 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.538 -0.301 . . . . 0.0 111.319 -179.939 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . 0.505 ' N ' ' O ' ' A' ' 38' ' ' VAL . 1.5 m 63.72 47.35 0.77 Allowed Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.697 -179.385 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . 0.523 ' C ' ' H ' ' A' ' 45' ' ' PHE . 57.9 Cg_endo -72.23 -30.45 13.03 Favored 'Trans proline' 0 N--CA 1.493 1.458 0 C-N-CA 122.699 2.266 . . . . 0.0 112.432 179.928 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . 0.603 ' CE2' H141 ' A' ' 201' ' ' MYR . 2.0 t-105 -58.32 -3.41 0.27 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.433 -179.643 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.523 ' H ' ' C ' ' A' ' 43' ' ' PRO . 2.9 t80 50.45 53.45 14.06 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.168 0.508 . . . . 0.0 110.16 -179.837 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.477 ' CD ' ' N ' ' A' ' 45' ' ' PHE . 38.3 Cg_endo -67.94 -12.35 35.01 Favored 'Trans proline' 0 C--N 1.308 -1.602 0 C-N-CA 122.835 2.357 . . . . 0.0 112.065 179.846 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 52.9 tt0 -59.11 -46.43 88.35 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.194 -179.688 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.463 ' O ' ' H41' ' A' ' 201' ' ' MYR . 44.9 tt0 -89.27 -18.03 27.82 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.029 0.443 . . . . 0.0 110.332 179.584 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . 0.702 ' O ' ' H72' ' A' ' 201' ' ' MYR . . . 77.11 66.56 1.79 Allowed Glycine 0 CA--C 1.525 0.696 0 N-CA-C 110.247 -1.141 . . . . 0.0 110.247 -178.921 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' THR . . . . . 0.506 ' OG1' ' NE2' ' A' ' 98' ' ' GLN . 2.9 t -138.0 155.67 48.61 Favored 'General case' 0 C--N 1.33 -0.282 0 C-N-CA 121.043 -0.263 . . . . 0.0 110.658 -179.548 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.4 ' HA ' ' HE1' ' A' ' 44' ' ' TRP . 1.5 mt -87.7 140.6 15.54 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.2 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.305 179.3 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . 0.432 ' OD2' ' O ' ' A' ' 43' ' ' PRO . 69.8 m-20 -111.14 120.12 41.25 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.191 179.631 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 24.9 mm -94.78 -56.07 5.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.893 179.215 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -78.0 -49.41 14.12 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.561 -179.464 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.549 ' CG ' HH21 ' A' ' 58' ' ' ARG . 83.8 mtt85 -59.95 -32.59 70.95 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.132 -0.486 . . . . 0.0 109.958 -179.708 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' TRP . . . . . 0.691 ' HE1' ' HE1' ' A' ' 83' ' ' TRP . 18.2 t-105 -62.89 -39.9 95.91 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.52 179.359 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 83.6 mtp180 -63.48 -35.24 79.8 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.444 -179.794 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . 0.549 HH21 ' CG ' ' A' ' 55' ' ' ARG . 43.6 mtm-85 -60.16 -50.92 71.77 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 120.509 -0.476 . . . . 0.0 111.006 -179.96 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 7.4 p -73.96 -39.48 51.39 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.377 0 C-N-CA 120.861 -0.335 . . . . 0.0 110.644 179.581 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . 0.433 ' O ' ' CB ' ' A' ' 64' ' ' GLN . . . -63.07 -49.21 73.67 Favored Glycine 0 C--O 1.222 -0.634 0 N-CA-C 111.353 -0.699 . . . . 0.0 111.353 -179.225 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 66.2 t0 -61.82 -44.87 95.99 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 120.625 0.25 . . . . 0.0 111.156 -179.497 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' CYS . . . . . 0.465 ' SG ' ' O ' ' A' ' 58' ' ' ARG . 73.3 m -62.9 -55.83 22.57 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.207 -179.227 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 12.6 m-85 -64.22 -43.23 95.63 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.1 -179.821 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . 0.433 ' CB ' ' O ' ' A' ' 60' ' ' GLY . 61.3 tt0 -62.37 -39.82 94.43 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.651 -179.45 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -57.01 -54.07 50.93 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 120.765 -0.374 . . . . 0.0 110.849 -179.865 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 66.4 m-85 -67.86 -39.77 83.72 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.706 179.764 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . 0.523 ' O ' ' N ' ' A' ' 71' ' ' GLY . 57.1 t80 -58.75 -41.88 87.52 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.427 -179.501 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . 0.409 ' CG ' ' O ' ' A' ' 64' ' ' GLN . 4.4 m120 -62.79 -45.29 93.35 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.331 -178.964 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 24.6 p -74.98 -20.12 59.8 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 120.608 -0.437 . . . . 0.0 109.985 -179.433 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 47.6 m-85 -114.11 16.28 18.14 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.401 179.945 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . 0.523 ' N ' ' O ' ' A' ' 67' ' ' TYR . . . -154.18 -111.03 0.41 Allowed Glycine 0 CA--C 1.534 1.239 0 N-CA-C 111.06 -0.816 . . . . 0.0 111.06 -179.984 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -73.06 140.1 30.78 Favored 'Trans proline' 0 N--CA 1.494 1.548 0 C-N-CA 121.989 1.793 . . . . 0.0 113.177 -179.34 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 80.7 mm-40 -86.28 -42.84 13.41 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.487 179.326 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.605 ' CD ' ' H ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -80.78 -24.63 38.48 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.027 179.933 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.505 ' H ' ' HD3' ' A' ' 74' ' ' LYS . 75.2 t 53.91 101.04 0.03 OUTLIER Pre-proline 0 N--CA 1.449 -0.481 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.189 -179.719 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 44.5 Cg_exo -55.05 129.28 34.44 Favored 'Trans proline' 0 N--CA 1.492 1.413 0 C-N-CA 121.666 1.578 . . . . 0.0 111.758 179.845 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . 0.407 ' C ' ' N ' ' A' ' 79' ' ' ALA . 48.3 t -82.31 -6.81 10.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.835 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 43.2 p -44.26 -23.23 0.09 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.64 -179.817 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . 0.407 ' N ' ' C ' ' A' ' 77' ' ' VAL . . . -57.62 -28.91 64.09 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.079 0.466 . . . . 0.0 110.431 179.73 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 48.8 t80 -61.19 -39.63 90.9 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.153 179.529 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 66.9 m -56.14 -40.14 73.36 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.391 -179.9 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' TYR . . . . . 0.499 ' HH ' ' CG1' ' A' ' 26' ' ' VAL . 14.2 m-85 -60.99 -48.94 79.49 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 120.737 -0.385 . . . . 0.0 110.792 179.65 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' TRP . . . . . 0.691 ' HE1' ' HE1' ' A' ' 56' ' ' TRP . 40.5 m0 -57.72 -36.11 71.58 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.57 -179.652 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 78.7 m-20 -62.77 -47.47 83.37 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 120.388 -0.525 . . . . 0.0 110.899 -179.863 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 36.7 tp -71.25 -52.47 18.84 Favored 'General case' 0 C--O 1.219 -0.524 0 C-N-CA 120.333 -0.547 . . . . 0.0 110.588 179.611 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -58.42 -26.68 31.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 C-N-CA 120.804 -0.358 . . . . 0.0 110.552 -179.889 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . 0.405 ' CB ' ' O ' ' A' ' 83' ' ' TRP . 63.4 tttt -65.97 -49.65 67.12 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.634 179.884 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.1 pp20? -80.07 -20.72 44.53 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.007 -179.665 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.49 -47.12 87.11 Favored 'General case' 0 N--CA 1.443 -0.793 0 C-N-CA 120.172 -0.611 . . . . 0.0 110.322 -179.111 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 3.4 mt -64.4 -44.4 97.11 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.156 0 C-N-CA 120.174 -0.611 . . . . 0.0 109.775 -179.815 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . 0.458 ' OD1' ' O ' ' A' ' 91' ' ' ASP . 64.6 t0 -62.19 -37.22 84.46 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.063 -179.16 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 26.6 tttm -42.12 145.57 0.36 Allowed 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.929 0.395 . . . . 0.0 110.363 -179.58 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 57.5 mttp -79.43 -17.09 55.01 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.669 -179.637 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 71.1 mm-40 -109.64 53.14 0.7 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.642 -179.777 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.443 ' O ' ' O ' ' A' ' 96' ' ' ASN . 44.9 t -73.09 148.08 9.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-O 120.911 0.386 . . . . 0.0 110.431 179.696 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' ASN . . . . . 0.614 ' O ' ' N ' ' A' ' 98' ' ' GLN . 0.0 OUTLIER -41.91 166.81 0.07 OUTLIER Pre-proline 0 C--N 1.327 -0.402 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.291 179.971 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_exo -39.59 -13.16 0.02 OUTLIER 'Trans proline' 0 N--CA 1.493 1.471 0 C-N-CA 123.079 2.52 . . . . 0.0 112.713 178.868 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . 0.614 ' N ' ' O ' ' A' ' 96' ' ' ASN . 8.8 tt0 -45.4 -31.65 1.77 Allowed 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.101 179.197 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 50.1 t -61.82 -56.43 17.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 C-N-CA 120.333 -0.547 . . . . 0.0 110.503 -178.909 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 88.9 mtp -72.15 -41.37 67.18 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.247 179.564 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -63.36 -28.4 69.97 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.769 -179.192 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -65.63 -15.52 62.84 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.507 -179.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 76.7 t -60.01 -18.64 16.07 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.487 179.83 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -61.81 -25.98 67.83 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.678 179.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 98.6 mm-40 -49.71 103.06 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.938 0.399 . . . . 0.0 110.532 179.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 11.0 m -61.66 -43.22 99.26 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.329 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 94.4 mt-10 -117.54 141.33 48.49 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.498 -179.794 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . 0.607 ' C ' ' H ' ' A' ' 110' ' ' LEU . 95.2 mt-10 -66.45 133.12 49.78 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 120.644 -0.423 . . . . 0.0 110.132 179.325 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 42.2 pt -55.39 -2.14 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.19 179.466 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.607 ' H ' ' C ' ' A' ' 108' ' ' GLU . 95.6 mt -96.45 5.96 49.75 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-O 120.806 0.336 . . . . 0.0 110.463 -179.762 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -114.45 129.68 56.67 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.385 179.904 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 30.2 p -136.86 -119.94 0.15 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.273 179.884 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' ASN . . . . . 0.416 ' C ' ' OD1' ' A' ' 113' ' ' ASN . 43.4 t-20 -64.39 -41.39 96.7 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.371 179.8 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 68.6 m -134.27 154.8 51.08 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.61 -179.848 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' GLN . . . . . 0.446 ' O ' ' O ' ' A' ' 118' ' ' LEU . 87.4 mt-30 -87.08 85.42 7.23 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.391 179.9 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 7.3 m -63.58 -45.26 91.23 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.63 -179.771 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 72.7 m-20 -61.53 -45.12 95.52 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.763 -179.397 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . 0.446 ' O ' ' O ' ' A' ' 115' ' ' GLN . 91.1 mt -116.49 123.91 48.64 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.435 179.877 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 88.9 mt-10 -110.45 124.01 50.96 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-O 120.655 0.264 . . . . 0.0 110.425 179.954 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 41.7 m80 -115.75 147.45 40.92 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.465 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 96.9 m-70 -111.43 143.93 41.46 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.455 -179.824 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 67.2 m80 -66.12 -40.6 90.81 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.631 -179.929 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 32.7 m170 -122.22 135.28 54.74 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.54 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 124' ' ' HIS . . . . . . . . . . . . . 44.7 t60 -60.67 -45.36 94.41 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.552 -179.881 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 60.5 t-80 . . . . . 0 C--O 1.22 -0.453 0 CA-C-O 117.967 -1.016 . . . . 0.0 110.573 179.948 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 201' ' ' MYR . . . . . 0.702 ' H72' ' O ' ' A' ' 49' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . 0.526 ' O ' ' N ' ' A' ' 6' ' ' SER . . . . . . . . 0 CA--C 1.523 0.592 0 N-CA-C 110.464 -1.054 . . . . 0.0 110.464 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 20.6 pt20 -43.09 -24.94 0.09 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.847 0.356 . . . . 0.0 110.658 -179.679 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . 0.415 ' N ' ' O ' ' A' ' 2' ' ' GLY . 98.0 mt-10 -73.8 -64.69 0.95 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.69 -179.862 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.45 ' CD1' ' N ' ' A' ' 6' ' ' SER . 4.0 pp -83.83 -41.07 17.9 Favored 'General case' 0 C--O 1.223 -0.32 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.246 -179.944 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' SER . . . . . 0.526 ' N ' ' O ' ' A' ' 2' ' ' GLY . 16.5 m -49.95 -45.91 51.77 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 120.823 -0.351 . . . . 0.0 110.695 -178.7 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . 0.433 ' OE1' ' O ' ' A' ' 46' ' ' PRO . 84.8 mt-30 -62.14 -29.18 70.16 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 120.751 -0.38 . . . . 0.0 110.536 179.483 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 33.3 m170 -80.15 -53.41 6.71 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.807 0.336 . . . . 0.0 111.616 -179.408 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 80.4 mm-40 -65.78 -43.7 87.98 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.282 -179.096 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.536 ' O ' ' N ' ' A' ' 14' ' ' GLN . 96.1 mtt-85 -68.98 -55.24 11.52 Favored 'General case' 0 C--O 1.216 -0.668 0 C-N-CA 120.531 -0.468 . . . . 0.0 110.582 -179.369 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 46.3 t80 -46.68 -38.7 10.18 Favored 'General case' 0 C--N 1.319 -0.759 0 C-N-CA 119.793 -0.763 . . . . 0.0 110.903 -179.215 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 73.9 t -71.41 -60.15 2.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 N-CA-C 112.337 0.495 . . . . 0.0 112.337 -179.389 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.477 ' O ' ' CB ' ' A' ' 17' ' ' GLN . 95.3 mt-10 -80.16 -47.68 14.34 Favored 'General case' 0 C--O 1.213 -0.861 0 C-N-CA 120.804 -0.359 . . . . 0.0 111.431 -178.77 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . 0.536 ' N ' ' O ' ' A' ' 10' ' ' ARG . 51.5 tp60 -50.9 -44.16 59.94 Favored 'General case' 0 C--N 1.317 -0.83 0 C-N-CA 120.794 -0.363 . . . . 0.0 110.577 -179.192 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -78.01 -59.15 2.9 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 120.123 -0.631 . . . . 0.0 111.896 -179.041 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -56.8 -35.49 68.8 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.882 -178.54 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . 0.477 ' CB ' ' O ' ' A' ' 13' ' ' GLU . 60.3 tt0 -71.61 -40.24 69.95 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.499 179.885 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -55.64 -32.8 63.48 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 -179.783 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.4 ' CD1' ' CE2' ' A' ' 82' ' ' TYR . 3.5 mt -86.09 -31.81 21.7 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.151 179.132 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -51.62 -43.97 62.73 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.933 -178.696 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.96 -30.45 71.44 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.577 179.91 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 78.5 mmt-85 -67.7 -7.56 28.01 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.318 -179.772 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 107.17 19.52 9.4 Favored Glycine 0 CA--C 1.525 0.683 0 N-CA-C 111.121 -0.792 . . . . 0.0 111.121 179.696 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.43 ' CG1' ' N ' ' A' ' 25' ' ' LYS . 38.8 t -101.82 167.95 2.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 N-CA-C 110.212 -0.292 . . . . 0.0 110.212 179.897 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.43 ' N ' ' CG1' ' A' ' 24' ' ' VAL . 99.0 mttt -132.74 144.63 50.41 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.399 179.57 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 30.0 m -132.12 130.55 60.93 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.354 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.699 179.91 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 14.3 pttp -109.81 163.78 13.2 Favored 'General case' 0 C--O 1.228 -0.056 0 CA-C-O 120.741 0.305 . . . . 0.0 110.499 179.66 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 93.6 m-85 -49.77 -32.13 13.14 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.959 0.409 . . . . 0.0 110.519 179.999 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -55.12 -24.35 25.6 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.39 179.84 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.46 ' O ' ' CB ' ' A' ' 34' ' ' PHE . 99.0 m-20 -64.44 -46.1 84.62 Favored 'General case' 0 C--O 1.22 -0.492 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.808 -179.987 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.478 ' O ' ' CB ' ' A' ' 35' ' ' PHE . 5.3 mp -63.53 -40.42 96.99 Favored 'General case' 0 C--N 1.315 -0.902 0 C-N-CA 120.23 -0.588 . . . . 0.0 110.407 -179.747 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 30.8 mt -58.8 -49.78 76.39 Favored 'General case' 0 C--N 1.313 -0.98 0 C-N-CA 119.634 -0.826 . . . . 0.0 111.549 -178.179 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -87.75 -51.19 6.0 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 112.591 0.589 . . . . 0.0 112.591 -178.58 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . 0.46 ' CB ' ' O ' ' A' ' 30' ' ' ASP . 9.7 t80 -59.68 -50.25 74.56 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.805 -178.344 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.478 ' CB ' ' O ' ' A' ' 31' ' ' LEU . 10.0 t80 -63.47 -47.91 79.82 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.499 -0.48 . . . . 0.0 110.666 -179.966 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 55.1 t0 -67.69 -29.19 68.39 Favored 'General case' 0 N--CA 1.456 -0.145 0 C-N-CA 120.426 -0.51 . . . . 0.0 111.176 -179.418 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 9.9 t80 -66.34 -51.53 56.25 Favored 'General case' 0 C--N 1.332 -0.173 0 C-N-CA 120.642 -0.423 . . . . 0.0 111.611 -178.255 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.522 ' O ' ' N ' ' A' ' 42' ' ' CYS . 9.1 m -76.47 -39.14 33.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.95 -179.708 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -62.74 -26.78 68.86 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.596 -179.555 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 40.5 t0 -52.97 -52.95 56.43 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.856 -179.299 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 12.0 p -114.07 -6.65 13.1 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.143 179.947 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . 0.522 ' N ' ' O ' ' A' ' 38' ' ' VAL . 3.3 m 43.44 56.52 12.22 Favored Pre-proline 0 CA--C 1.532 0.267 0 CA-C-O 120.885 0.374 . . . . 0.0 110.28 -178.967 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . 0.572 ' C ' ' H ' ' A' ' 45' ' ' PHE . 61.2 Cg_endo -79.34 -15.19 12.76 Favored 'Trans proline' 0 C--N 1.313 -1.304 0 C-N-CA 122.378 2.052 . . . . 0.0 112.428 -179.795 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . 0.61 ' NE1' H141 ' A' ' 201' ' ' MYR . 0.0 OUTLIER -69.71 22.06 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.474 -179.238 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.572 ' H ' ' C ' ' A' ' 43' ' ' PRO . 18.1 t80 36.25 68.86 1.33 Allowed Pre-proline 0 C--O 1.233 0.191 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.343 179.981 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.433 ' O ' ' OE1' ' A' ' 7' ' ' GLN . 48.9 Cg_endo -75.18 -0.45 10.04 Favored 'Trans proline' 0 C--N 1.305 -1.751 0 C-N-CA 122.69 2.26 . . . . 0.0 112.189 -179.252 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 86.9 mt-30 -60.31 -52.83 63.6 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 120.604 -0.438 . . . . 0.0 110.538 -179.797 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 58.9 tt0 -89.23 -14.49 35.83 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.778 0.323 . . . . 0.0 110.448 179.717 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . 0.471 ' O ' ' CB ' ' A' ' 98' ' ' GLN . . . 72.94 58.02 5.0 Favored Glycine 0 CA--C 1.524 0.63 0 N-CA-C 110.336 -1.106 . . . . 0.0 110.336 -178.929 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' THR . . . . . 0.438 ' HG1' ' NE2' ' A' ' 98' ' ' GLN . 2.6 t -132.54 169.2 16.94 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.886 0.374 . . . . 0.0 110.79 -179.331 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.4 mt -85.02 142.17 13.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.434 179.345 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 80.0 m-20 -111.25 121.54 45.53 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.648 -0.705 . . . . 0.0 111.246 179.468 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.415 HG21 HD13 ' A' ' 53' ' ' ILE . 31.1 mm -94.11 -55.0 6.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.28 179.231 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -71.96 -55.23 7.83 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-O 120.873 0.368 . . . . 0.0 111.796 -178.708 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 86.5 mtm-85 -57.51 -30.49 65.18 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.178 -0.465 . . . . 0.0 109.999 -179.607 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' TRP . . . . . 0.503 ' CE3' ' CZ3' ' A' ' 44' ' ' TRP . 12.5 t-105 -62.73 -41.36 99.13 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.727 178.856 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 96.5 mtt-85 -63.24 -33.57 75.77 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.453 -179.835 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . 0.493 ' O ' ' SG ' ' A' ' 62' ' ' CYS . 96.7 mtt180 -63.14 -51.77 65.15 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.552 -0.459 . . . . 0.0 111.285 -179.384 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 3.3 p -66.24 -35.52 75.17 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.333 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.678 179.84 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -73.22 -48.87 17.74 Favored Glycine 0 CA--C 1.528 0.861 0 C-N-CA 120.911 -0.662 . . . . 0.0 111.778 -179.674 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 95.8 m-20 -62.92 -44.51 95.88 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.669 0.271 . . . . 0.0 111.473 -179.074 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' CYS . . . . . 0.493 ' SG ' ' O ' ' A' ' 58' ' ' ARG . 74.6 m -60.73 -58.93 6.36 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.877 0.37 . . . . 0.0 110.877 -179.356 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 24.7 m-85 -61.64 -41.0 96.88 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.81 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 53.9 tt0 -60.59 -39.29 87.56 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.5 -0.318 . . . . 0.0 111.055 -179.873 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.472 ' O ' ' OD1' ' A' ' 68' ' ' ASN . 20.2 t0 -58.25 -52.1 67.01 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 120.943 0.402 . . . . 0.0 110.68 -179.704 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 83.6 m-85 -73.18 -41.14 64.18 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 120.473 -0.491 . . . . 0.0 111.309 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 62.6 t80 -57.55 -47.39 82.16 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.803 -178.78 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . 0.472 ' OD1' ' O ' ' A' ' 65' ' ' ASP . 0.2 OUTLIER -62.8 -41.65 99.37 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.676 -179.853 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.468 ' N ' ' ND2' ' A' ' 68' ' ' ASN . 40.8 p -66.43 -17.97 65.09 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.268 179.972 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 7.9 m-85 -98.8 14.87 27.28 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.547 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 166.22 -87.71 0.1 OUTLIER Glycine 0 CA--C 1.535 1.328 0 C-N-CA 120.764 -0.731 . . . . 0.0 111.734 179.53 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . 0.423 ' O ' ' O ' ' A' ' 68' ' ' ASN . 33.7 Cg_exo -51.13 126.59 19.38 Favored 'Trans proline' 0 N--CA 1.496 1.624 0 C-N-CA 121.866 1.711 . . . . 0.0 112.592 179.938 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.521 ' N ' ' OE1' ' A' ' 73' ' ' GLU . 58.4 mp0 -86.82 -43.93 12.11 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.905 -0.588 . . . . 0.0 110.506 179.286 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.532 ' CD ' ' H ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -104.26 -7.57 19.95 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.108 -179.695 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.422 ' N ' ' HD3' ' A' ' 74' ' ' LYS . 30.2 t 59.41 133.38 0.03 OUTLIER Pre-proline 0 N--CA 1.448 -0.551 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.718 -178.978 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -53.43 129.21 32.58 Favored 'Trans proline' 0 N--CA 1.493 1.459 0 C-N-CA 121.535 1.49 . . . . 0.0 111.238 178.043 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . 0.425 ' O ' ' N ' ' A' ' 80' ' ' PHE . 59.6 t -80.85 -16.54 12.47 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.687 179.891 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' THR . . . . . 0.434 ' O ' ' OG ' ' A' ' 81' ' ' SER . 65.7 p -45.94 -22.82 0.23 Allowed 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.945 0.402 . . . . 0.0 110.072 -179.931 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -67.6 -34.8 77.74 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.68 179.403 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . 0.425 ' N ' ' O ' ' A' ' 77' ' ' VAL . 10.2 m-85 -57.74 -35.38 70.63 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.33 -179.633 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' SER . . . . . 0.434 ' OG ' ' O ' ' A' ' 78' ' ' THR . 94.9 p -60.36 -40.29 90.22 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.355 179.87 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' TYR . . . . . 0.4 ' CE2' ' CD1' ' A' ' 19' ' ' LEU . 13.8 m-85 -60.17 -49.39 77.81 Favored 'General case' 0 C--O 1.223 -0.29 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.797 179.81 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' TRP . . . . . 0.519 ' CD1' ' N ' ' A' ' 83' ' ' TRP . 9.6 m0 -59.12 -40.39 85.24 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.311 179.956 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 78.0 m-20 -62.68 -43.23 99.33 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 120.691 -0.404 . . . . 0.0 110.572 -179.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -70.25 -55.43 9.29 Favored 'General case' 0 C--O 1.221 -0.416 0 N-CA-C 110.215 -0.291 . . . . 0.0 110.215 179.409 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -60.88 -25.52 35.95 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.884 0 C-N-CA 120.959 -0.296 . . . . 0.0 110.717 -179.66 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . 0.426 ' CB ' ' O ' ' A' ' 83' ' ' TRP . 42.2 tttp -65.26 -50.16 66.83 Favored 'General case' 0 C--N 1.317 -0.807 0 C-N-CA 120.467 -0.493 . . . . 0.0 110.555 179.716 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.1 pp20? -80.34 -19.69 45.91 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.679 -179.891 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 14.5 tp -61.5 -45.02 96.0 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.354 -179.015 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 3.6 mt -65.04 -43.86 95.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 C-N-CA 120.293 -0.563 . . . . 0.0 109.956 -179.778 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 94.1 m-20 -65.16 -8.02 15.15 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.841 -178.938 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 84.7 tttt -66.9 146.13 54.73 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.42 179.91 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -61.7 -41.64 97.87 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.661 -179.843 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . 0.46 ' O ' ' C ' ' A' ' 95' ' ' VAL . 97.9 mt-10 -77.66 6.94 6.34 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.828 -179.82 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.46 ' C ' ' O ' ' A' ' 94' ' ' GLU . 2.7 m 30.72 -110.62 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.283 0 O-C-N 123.692 0.62 . . . . 0.0 110.707 -179.806 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' ASN . . . . . 0.531 ' O ' ' N ' ' A' ' 98' ' ' GLN . 1.3 m120 -153.32 160.86 30.43 Favored Pre-proline 0 N--CA 1.45 -0.438 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.568 179.356 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . 0.482 ' O ' ' N ' ' A' ' 99' ' ' VAL . 53.7 Cg_exo -44.5 -12.23 0.05 OUTLIER 'Trans proline' 0 C--N 1.31 -1.473 0 C-N-CA 122.689 2.259 . . . . 0.0 112.146 178.974 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . 0.531 ' N ' ' O ' ' A' ' 96' ' ' ASN . 6.0 pt20 -46.27 -15.39 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.896 -179.861 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . 0.482 ' N ' ' O ' ' A' ' 97' ' ' PRO . 74.9 t -60.83 -49.37 84.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 C-N-CA 120.834 -0.347 . . . . 0.0 111.017 -179.442 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 97.9 mmm -73.01 -43.15 62.48 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.922 0.391 . . . . 0.0 111.056 -179.748 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . 0.489 ' CB ' ' H52' ' A' ' 201' ' ' MYR . . . -63.95 -21.65 66.58 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.482 -179.737 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -55.99 -15.32 3.34 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.656 -179.906 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 51.6 t -63.63 -21.26 28.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.414 179.516 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -55.69 -46.69 77.58 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.611 -179.864 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 88.0 mt-30 -86.04 110.41 19.49 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.317 -0.402 . . . . 0.0 110.576 179.899 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 24.1 p -66.98 -31.95 72.86 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.623 179.912 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 85.4 mt-10 -56.99 142.52 41.62 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.385 -179.587 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . 0.601 ' C ' ' H ' ' A' ' 110' ' ' LEU . 92.2 mt-10 -65.4 136.25 56.26 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.768 -0.373 . . . . 0.0 110.201 179.626 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 45.3 pt -61.14 4.14 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.364 179.622 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.601 ' H ' ' C ' ' A' ' 108' ' ' GLU . 96.4 mt -101.73 -5.98 24.26 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.892 0.377 . . . . 0.0 110.538 -179.735 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 63.2 tttm -102.37 128.77 48.81 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.683 -179.969 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' SER . . . . . 0.532 ' OG ' ' N ' ' A' ' 113' ' ' ASN . 3.1 p -87.57 -147.13 0.14 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.463 -179.875 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' ASN . . . . . 0.532 ' N ' ' OG ' ' A' ' 112' ' ' SER . 90.5 m-20 -62.09 -42.32 99.09 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.385 -179.442 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 92.9 p -153.86 -5.74 0.17 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.582 179.941 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' GLN . . . . . 0.437 ' H ' ' HG ' ' A' ' 112' ' ' SER . 94.9 mm-40 -70.82 150.3 45.96 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.422 -179.695 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 73.1 p -72.8 169.73 16.14 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.405 -179.873 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 88.8 m-20 -62.62 -17.44 60.29 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.47 -179.69 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 82.2 mt -63.47 -40.66 97.69 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.403 179.503 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 55.49 78.57 0.18 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.539 -179.921 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . 0.531 ' HD1' ' CE1' ' A' ' 121' ' ' HIS . 58.1 t-80 -61.66 -44.92 96.05 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.558 -179.752 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 121' ' ' HIS . . . . . 0.531 ' CE1' ' HD1' ' A' ' 120' ' ' HIS . 78.7 m80 -99.5 123.53 43.85 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.38 179.973 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 122' ' ' HIS . . . . . 0.526 ' HD1' ' CD2' ' A' ' 123' ' ' HIS . 58.0 t-80 -60.51 -42.46 96.45 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.591 -179.909 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . 0.526 ' CD2' ' HD1' ' A' ' 122' ' ' HIS . 98.5 m-70 -109.02 143.38 38.4 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.456 -179.945 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 124' ' ' HIS . . . . . . . . . . . . . 76.2 m80 -61.07 -42.52 98.65 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.458 -179.78 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 79.3 m80 . . . . . 0 C--O 1.22 -0.478 0 CA-C-O 117.99 -1.005 . . . . 0.0 110.581 -179.959 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 201' ' ' MYR . . . . . 0.61 H141 ' NE1' ' A' ' 44' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.752 0 N-CA-C 110.984 -0.846 . . . . 0.0 110.984 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 88.1 mt-30 -64.24 -38.97 92.95 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.779 0.323 . . . . 0.0 110.733 179.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . 0.57 ' OE1' ' H51' ' A' ' 201' ' ' MYR . 90.4 mt-10 -47.96 -22.95 0.66 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.509 -179.969 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 51.8 tp -41.97 -34.57 0.71 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.26 -179.55 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 42.6 m -55.09 -42.05 72.34 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.077 0.465 . . . . 0.0 110.327 -179.899 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . 0.412 ' N ' ' O ' ' A' ' 4' ' ' GLU . 95.2 mt-30 -61.1 -30.8 70.57 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.883 -0.598 . . . . 0.0 110.689 179.614 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 59.4 t-80 -62.1 -41.72 98.5 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.023 0.439 . . . . 0.0 110.117 179.72 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 80.1 mm-40 -60.27 -46.65 89.07 Favored 'General case' 0 C--O 1.245 0.819 0 CA-C-O 121.562 0.696 . . . . 0.0 110.026 179.937 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.41 ' O ' ' CB ' ' A' ' 14' ' ' GLN . 24.5 mtm180 -63.48 -29.02 70.37 Favored 'General case' 0 C--O 1.217 -0.608 0 C-N-CA 120.241 -0.583 . . . . 0.0 109.799 179.506 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 37.8 t80 -62.86 -36.71 84.16 Favored 'General case' 0 C--N 1.328 -0.327 0 O-C-N 123.562 0.539 . . . . 0.0 109.888 179.902 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 3.7 t -62.66 -48.32 88.71 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 C-N-CA 119.837 -0.745 . . . . 0.0 110.834 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 79.8 mm-40 -80.87 -38.9 27.31 Favored 'General case' 0 C--N 1.322 -0.595 0 C-N-CA 119.935 -0.706 . . . . 0.0 111.767 -179.173 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . 0.41 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 63.9 tp60 -65.38 -53.05 48.92 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.538 -0.755 . . . . 0.0 110.865 -179.171 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -63.12 -45.86 90.02 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.453 -0.499 . . . . 0.0 109.917 -179.126 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 53.8 mttp -54.82 -32.5 60.48 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 120.204 -0.599 . . . . 0.0 110.503 179.79 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 59.9 tt0 -67.16 -41.32 86.19 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.556 179.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -57.58 -30.35 65.2 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.617 -0.72 . . . . 0.0 109.763 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.2 mt -86.44 -28.82 23.28 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.253 0.549 . . . . 0.0 110.651 178.848 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -51.12 -43.02 61.06 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.779 -178.784 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.73 -28.87 69.89 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.55 179.762 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 82.8 mmt-85 -71.01 -6.34 38.21 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.353 -179.831 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 108.04 20.12 8.57 Favored Glycine 0 CA--C 1.524 0.65 0 N-CA-C 111.16 -0.776 . . . . 0.0 111.16 179.93 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.4 ' CG1' ' H ' ' A' ' 25' ' ' LYS . 18.3 t -102.29 169.38 1.88 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 N-CA-C 110.345 -0.243 . . . . 0.0 110.345 179.857 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.4 ' H ' ' CG1' ' A' ' 24' ' ' VAL . 99.4 mttt -115.43 146.69 41.38 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.368 179.803 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 2.3 m -115.31 23.4 5.34 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.272 0 CA-C-O 120.996 0.427 . . . . 0.0 110.662 -179.584 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.517 ' N ' ' OD2' ' A' ' 30' ' ' ASP . 33.5 pttt -51.97 163.58 0.34 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.219 -179.712 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 75.8 m-85 -58.15 -35.83 72.12 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.819 -0.352 . . . . 0.0 110.654 -179.727 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -53.84 -23.8 13.6 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.691 -179.953 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.517 ' OD2' ' N ' ' A' ' 27' ' ' LYS . 59.3 m-20 -63.5 -46.68 84.97 Favored 'General case' 0 C--O 1.223 -0.335 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.685 -179.509 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.482 ' O ' ' CB ' ' A' ' 35' ' ' PHE . 5.4 mp -67.28 -41.09 86.03 Favored 'General case' 0 C--O 1.221 -0.446 0 CA-C-O 121.251 0.548 . . . . 0.0 110.487 179.575 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 55.7 mt -56.73 -44.84 82.06 Favored 'General case' 0 C--N 1.314 -0.948 0 C-N-CA 119.546 -0.862 . . . . 0.0 111.057 -178.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 86.5 tttt -86.09 -49.38 7.82 Favored 'General case' 0 C--N 1.32 -0.714 0 C-N-CA 120.475 -0.49 . . . . 0.0 111.421 -178.922 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 58.0 t80 -61.93 -49.88 74.36 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.237 -178.687 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.482 ' CB ' ' O ' ' A' ' 31' ' ' LEU . 7.9 t80 -62.96 -46.9 85.57 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.189 -179.827 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 94.4 m-20 -65.31 -34.32 78.07 Favored 'General case' 0 C--N 1.347 0.477 0 CA-C-O 120.721 0.296 . . . . 0.0 111.167 -179.432 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.458 ' CE2' ' CD2' ' A' ' 63' ' ' PHE . 1.9 m-85 -60.53 -47.85 84.35 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.919 0.39 . . . . 0.0 111.111 -179.053 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.535 ' O ' ' N ' ' A' ' 42' ' ' CYS . 27.8 m -77.82 -40.2 26.98 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.592 -179.704 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -56.59 -26.93 56.78 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.635 -179.847 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 93.2 m-20 -54.4 -62.38 1.69 Allowed 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 120.748 -0.381 . . . . 0.0 111.292 -179.043 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' THR . . . . . 0.494 ' O ' ' SG ' ' A' ' 42' ' ' CYS . 45.8 p -114.0 5.53 16.14 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.101 -179.506 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . 0.535 ' N ' ' O ' ' A' ' 38' ' ' VAL . 28.1 p 37.5 57.97 4.28 Favored Pre-proline 0 N--CA 1.465 0.288 0 CA-C-O 120.772 0.32 . . . . 0.0 110.341 -179.235 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 69.3 Cg_endo -75.79 -11.92 20.04 Favored 'Trans proline' 0 C--N 1.312 -1.343 0 C-N-CA 122.779 2.32 . . . . 0.0 112.339 -179.312 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . 0.598 ' NE1' H141 ' A' ' 201' ' ' MYR . 0.0 OUTLIER -82.5 12.48 4.51 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.024 -179.569 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.454 ' CE1' ' OE1' ' A' ' 47' ' ' GLN . 21.3 t80 39.85 54.59 5.99 Favored Pre-proline 0 C--N 1.331 -0.206 0 CA-C-O 120.864 0.364 . . . . 0.0 110.227 179.882 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.438 ' CD ' ' N ' ' A' ' 45' ' ' PHE . 19.1 Cg_endo -58.88 -2.62 1.18 Allowed 'Trans proline' 0 C--N 1.308 -1.598 0 C-N-CA 122.898 2.399 . . . . 0.0 112.256 -179.522 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.454 ' OE1' ' CE1' ' A' ' 45' ' ' PHE . 88.2 mt-30 -60.73 -52.62 64.33 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.238 179.933 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 76.9 tt0 -89.09 -21.92 23.15 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-O 121.053 0.454 . . . . 0.0 110.397 179.104 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . 0.439 ' O ' ' H72' ' A' ' 201' ' ' MYR . . . 78.89 63.24 2.11 Favored Glycine 0 CA--C 1.523 0.554 0 N-CA-C 110.534 -1.026 . . . . 0.0 110.534 -179.486 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' THR . . . . . 0.427 ' OG1' ' NE2' ' A' ' 98' ' ' GLN . 11.2 t -137.19 160.8 37.96 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.836 0.351 . . . . 0.0 110.748 -179.411 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.3 mt -83.53 133.53 28.95 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.425 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.521 179.603 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -116.95 120.83 39.64 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.373 -0.83 . . . . 0.0 110.345 179.298 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 20.3 mm -91.43 -48.13 13.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.922 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -63.17 -44.98 93.91 Favored 'General case' 0 C--O 1.238 0.46 0 CA-C-O 121.255 0.55 . . . . 0.0 110.66 -179.399 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 85.0 mtt85 -64.14 -34.36 77.89 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.115 -0.493 . . . . 0.0 109.903 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 29.4 t-105 -59.39 -39.13 82.38 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-O 121.125 0.488 . . . . 0.0 110.4 -179.466 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 83.7 mtp180 -64.12 -39.08 93.26 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.347 179.949 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . 0.442 ' O ' ' OD2' ' A' ' 61' ' ' ASP . 83.9 mtt85 -60.88 -52.06 66.64 Favored 'General case' 0 C--N 1.331 -0.228 0 C-N-CA 120.715 -0.394 . . . . 0.0 111.209 -179.972 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 5.9 p -69.01 -31.05 48.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.13 179.179 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -67.71 -44.58 80.61 Favored Glycine 0 CA--C 1.526 0.74 0 N-CA-C 111.344 -0.703 . . . . 0.0 111.344 -179.819 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . 0.442 ' OD2' ' O ' ' A' ' 58' ' ' ARG . 0.5 OUTLIER -65.87 -38.01 87.66 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.779 0.323 . . . . 0.0 110.609 -179.42 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 76.1 m -64.98 -49.57 69.78 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.04 0.448 . . . . 0.0 110.678 -179.45 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . 0.458 ' CD2' ' CE2' ' A' ' 37' ' ' PHE . 12.0 m-85 -67.29 -28.94 68.43 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.282 179.626 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 56.9 tt0 -61.48 -45.42 94.32 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 120.658 -0.417 . . . . 0.0 110.967 -179.872 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 24.4 t0 -62.97 -51.83 65.37 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.005 0.431 . . . . 0.0 110.595 179.699 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' TYR . . . . . 0.481 ' O ' ' OG1' ' A' ' 69' ' ' THR . 54.1 m-85 -62.34 -32.81 73.64 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.037 -0.528 . . . . 0.0 110.234 179.819 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . 0.416 ' OH ' ' CD ' ' A' ' 76' ' ' PRO . 58.2 t80 -61.83 -40.2 94.46 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.312 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 88.6 m-20 -63.96 -39.92 95.23 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.343 -179.626 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.481 ' OG1' ' O ' ' A' ' 66' ' ' TYR . 61.4 p -49.3 -34.3 15.17 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.693 -179.31 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 69.1 m-85 -65.58 -47.0 77.25 Favored 'General case' 0 C--N 1.322 -0.609 0 C-N-CA 120.075 -0.65 . . . . 0.0 111.134 -179.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 110.91 71.48 0.64 Allowed Glycine 0 N--CA 1.472 1.036 0 N-CA-C 110.853 -0.899 . . . . 0.0 110.853 -179.545 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_exo -62.78 142.06 87.46 Favored 'Trans proline' 0 C--N 1.305 -1.74 0 C-N-CA 123.241 2.628 . . . . 0.0 111.891 -179.861 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 97.6 mt-10 -83.2 -46.29 12.88 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-O 121.047 0.451 . . . . 0.0 110.206 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.426 ' CD ' ' N ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -137.14 3.87 2.66 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.573 -0.739 . . . . 0.0 111.861 -179.72 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 54.1 t 57.1 100.11 0.04 OUTLIER Pre-proline 0 C--N 1.325 -0.486 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.485 -178.248 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . 0.416 ' CD ' ' OH ' ' A' ' 67' ' ' TYR . 48.6 Cg_exo -53.38 126.8 22.84 Favored 'Trans proline' 0 N--CA 1.494 1.556 0 C-N-CA 122.032 1.821 . . . . 0.0 112.176 -179.647 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . 0.477 ' O ' ' N ' ' A' ' 79' ' ' ALA . 45.3 t -84.01 -20.81 8.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.875 179.497 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' THR . . . . . 0.441 ' O ' ' OG ' ' A' ' 81' ' ' SER . 71.5 p -40.75 -24.99 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.464 -179.262 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . 0.477 ' N ' ' O ' ' A' ' 77' ' ' VAL . . . -65.5 -41.83 92.79 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.144 0.497 . . . . 0.0 110.868 179.597 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . 0.454 ' N ' ' O ' ' A' ' 77' ' ' VAL . 2.4 m-85 -62.77 -39.37 93.96 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.644 179.853 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' SER . . . . . 0.441 ' OG ' ' O ' ' A' ' 78' ' ' THR . 73.4 p -54.17 -42.39 69.58 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.355 -179.725 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 9.5 m-85 -61.05 -54.24 47.22 Favored 'General case' 0 CA--C 1.52 -0.208 0 C-N-CA 120.847 -0.341 . . . . 0.0 110.659 179.832 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' TRP . . . . . . . . . . . . . 37.7 t90 -56.78 -36.7 70.15 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.543 179.724 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 92.6 m-20 -62.86 -48.54 78.56 Favored 'General case' 0 C--O 1.235 0.327 0 C-N-CA 120.775 -0.37 . . . . 0.0 111.155 -179.409 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 33.1 tp -70.41 -51.53 28.86 Favored 'General case' 0 N--CA 1.447 -0.62 0 C-N-CA 120.532 -0.467 . . . . 0.0 110.376 179.676 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -58.22 -27.35 32.1 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 C-N-CA 120.511 -0.475 . . . . 0.0 110.513 -179.766 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 64.5 tttt -65.11 -48.9 72.0 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.666 -178.898 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.2 pp20? -80.48 -21.33 42.11 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.739 -179.876 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.11 -43.09 99.59 Favored 'General case' 0 N--CA 1.447 -0.625 0 C-N-CA 120.046 -0.662 . . . . 0.0 110.113 -178.68 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 2.2 mt -63.33 -43.12 98.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 C-N-CA 119.949 -0.7 . . . . 0.0 110.052 -179.618 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 -55.57 -17.1 4.81 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.764 -178.478 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 75.3 tttt -61.52 134.28 56.68 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.315 179.635 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -62.37 -41.22 98.46 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.683 -179.806 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . 0.448 ' O ' ' C ' ' A' ' 95' ' ' VAL . 81.0 mm-40 -74.85 -2.22 25.78 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.971 -179.603 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.448 ' C ' ' O ' ' A' ' 94' ' ' GLU . 1.9 m 30.55 -106.71 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.29 0 O-C-N 123.831 0.707 . . . . 0.0 110.442 179.939 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' ASN . . . . . 0.442 ' C ' ' H ' ' A' ' 98' ' ' GLN . 0.8 OUTLIER -152.63 164.43 20.33 Favored Pre-proline 0 C--N 1.322 -0.596 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.658 179.047 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -46.07 -13.28 0.09 OUTLIER 'Trans proline' 0 N--CA 1.494 1.52 0 C-N-CA 122.797 2.332 . . . . 0.0 112.464 179.079 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . 0.442 ' H ' ' C ' ' A' ' 96' ' ' ASN . 3.5 pt20 -54.11 -15.88 1.71 Allowed 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.856 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 71.8 t -61.87 -50.19 81.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 C-N-CA 120.82 -0.352 . . . . 0.0 111.108 -179.152 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 90.9 mmm -73.61 -42.2 61.81 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.988 0.423 . . . . 0.0 111.059 179.948 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . 0.466 ' HB3' ' H31' ' A' ' 201' ' ' MYR . . . -63.43 -26.88 68.94 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.679 -179.737 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -51.43 -15.55 0.43 Allowed 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.686 -179.922 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 74.0 t -65.49 -17.45 22.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.392 179.439 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -58.92 -39.36 81.32 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.601 -179.722 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 97.9 mt-30 51.98 176.33 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.68 179.826 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 19.4 m -61.73 -44.46 96.86 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.691 -179.891 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 93.8 mt-10 -125.18 163.28 22.8 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.485 -179.709 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . 0.536 ' N ' ' OE1' ' A' ' 108' ' ' GLU . 54.5 mp0 -90.41 120.19 31.32 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.061 -0.518 . . . . 0.0 109.937 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 42.4 pt -43.1 -19.15 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.491 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.514 ' N ' ' O ' ' A' ' 108' ' ' GLU . 35.1 mt -63.61 -42.04 98.25 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.429 -179.821 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 66.4 tttm -67.57 -38.34 83.92 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.449 179.895 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 51.2 m -59.47 -47.29 86.05 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.79 -179.211 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 90.1 m-20 -65.82 -42.51 90.54 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.633 179.823 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 23.1 t -158.23 139.12 13.04 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.526 179.78 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 75.2 mt-30 -89.44 20.72 3.72 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.805 179.824 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 41.3 p -63.37 -32.51 73.96 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.44 179.873 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 65.6 t0 -65.68 -47.24 76.1 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.677 179.832 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 92.8 mt -125.99 76.61 1.61 Allowed 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.546 -179.878 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 83.4 tt0 -65.46 -40.47 93.24 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.393 179.856 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 39.5 p-80 -154.15 167.34 30.2 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.568 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 63.2 m80 -119.79 144.19 47.43 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.326 179.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 54.7 m-70 -113.25 138.67 49.66 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.507 179.939 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 85.5 t60 -62.47 -40.92 98.2 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.458 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 124' ' ' HIS . . . . . . . . . . . . . 29.4 m80 -60.98 -43.32 99.0 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.597 179.973 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 97.9 m-70 . . . . . 0 C--O 1.22 -0.472 0 CA-C-O 118.013 -0.994 . . . . 0.0 110.591 179.956 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 201' ' ' MYR . . . . . 0.598 H141 ' NE1' ' A' ' 44' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.71 0 N-CA-C 110.887 -0.885 . . . . 0.0 110.887 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 99.2 mm-40 -61.81 -39.79 92.99 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.825 0.345 . . . . 0.0 110.573 179.803 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . 0.43 ' O ' ' N ' ' A' ' 7' ' ' GLN . 96.4 mt-10 -55.52 -22.4 21.15 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.517 179.765 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.498 ' HB2' ' H22' ' A' ' 201' ' ' MYR . 51.2 tp -42.31 -34.14 0.74 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.564 -179.999 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 56.2 m -54.21 -37.48 64.6 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.568 179.362 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . 0.43 ' N ' ' O ' ' A' ' 4' ' ' GLU . 97.8 mm-40 -62.49 -37.3 85.48 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.588 179.741 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 59.1 t-80 -56.03 -43.93 78.28 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.585 179.689 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 81.9 tt0 -59.85 -53.16 61.18 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.563 179.114 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.479 ' O ' ' N ' ' A' ' 14' ' ' GLN . 86.8 mtt180 -60.61 -31.65 70.82 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.597 179.085 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.483 ' O ' ' HB2' ' A' ' 15' ' ' LEU . 51.1 t80 -60.66 -36.47 78.77 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.563 -179.601 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 3.0 t -63.24 -48.66 86.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.604 -179.198 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -83.49 -41.97 17.41 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.629 -179.571 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . 0.479 ' N ' ' O ' ' A' ' 10' ' ' ARG . 67.6 tp60 -61.39 -52.87 62.83 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.602 -179.119 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.483 ' HB2' ' O ' ' A' ' 11' ' ' TYR . 0.3 OUTLIER -61.25 -47.43 86.08 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.575 -179.976 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 87.0 mttt -56.29 -35.28 67.32 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.59 179.487 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 80.0 mt-30 -72.94 -36.08 67.13 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.622 178.636 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -57.22 -32.59 66.68 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.58 179.512 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.654 ' CD2' ' HG ' ' A' ' 81' ' ' SER . 3.1 mt -85.59 -33.34 21.71 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.576 177.997 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -46.97 -42.37 17.79 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.529 -179.541 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' THR . . . . . 0.543 ' C ' ' H ' ' A' ' 23' ' ' GLY . 0.2 OUTLIER -71.43 -25.75 62.45 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.581 -179.578 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 82.6 mmt-85 -72.88 19.52 0.09 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.562 179.674 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . 0.543 ' H ' ' C ' ' A' ' 21' ' ' THR . . . 86.31 18.26 59.3 Favored Glycine 0 CA--C 1.524 0.627 0 N-CA-C 110.934 -0.866 . . . . 0.0 110.934 -179.604 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.428 ' CG1' ' N ' ' A' ' 25' ' ' LYS . 22.8 t -105.39 168.85 2.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 120.787 0.327 . . . . 0.0 110.622 -179.927 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.428 ' N ' ' CG1' ' A' ' 24' ' ' VAL . 63.1 mttp -131.01 136.43 48.5 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.524 179.305 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 4.8 m -134.37 108.3 10.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.545 -179.459 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.546 ' O ' ' N ' ' A' ' 30' ' ' ASP . 13.0 ttmt -107.4 158.78 16.9 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.541 178.867 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . 0.458 ' H ' ' HG2' ' A' ' 27' ' ' LYS . 97.9 m-85 -39.01 -34.22 0.15 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.534 179.39 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -60.19 -25.48 65.61 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.575 -179.706 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.546 ' N ' ' O ' ' A' ' 27' ' ' LYS . 1.0 OUTLIER -60.06 -46.3 90.01 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.614 -179.028 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.521 ' O ' ' CB ' ' A' ' 35' ' ' PHE . 5.8 mp -63.68 -42.68 97.99 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.493 -179.959 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 36.8 mt -58.49 -46.11 87.34 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.588 -178.465 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.535 ' NZ ' ' CZ ' ' A' ' 37' ' ' PHE . 65.3 tttm -87.53 -49.22 7.33 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.52 -177.038 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . 0.487 ' CB ' ' O ' ' A' ' 30' ' ' ASP . 43.0 t80 -60.9 -50.25 74.16 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.53 -178.182 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.521 ' CB ' ' O ' ' A' ' 31' ' ' LEU . 7.1 t80 -61.84 -46.09 90.98 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.614 -178.938 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 86.1 m-20 -65.39 -35.2 80.23 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.574 -179.248 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.544 ' CE2' ' CD2' ' A' ' 63' ' ' PHE . 1.9 m-85 -60.89 -46.74 89.44 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.569 -179.191 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.622 ' O ' ' N ' ' A' ' 42' ' ' CYS . 25.8 m -76.52 -37.46 30.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.532 -178.825 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -62.56 -29.67 70.75 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.584 -179.633 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 81.3 m-20 -59.14 -44.84 92.09 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.557 -178.588 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' THR . . . . . 0.524 ' C ' ' SG ' ' A' ' 42' ' ' CYS . 41.6 p -115.06 -3.25 12.63 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.58 -178.849 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . 0.622 ' N ' ' O ' ' A' ' 38' ' ' VAL . 1.8 p 36.19 60.48 3.15 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.572 -179.608 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -77.7 -40.22 0.43 Allowed 'Trans proline' 0 C--N 1.305 -1.717 0 C-N-CA 122.796 2.331 . . . . 0.0 112.115 -179.334 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . 0.78 ' HE1' ' H ' ' A' ' 52' ' ' ASP . 0.0 OUTLIER -73.43 3.44 6.02 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.552 -179.633 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.558 ' O ' ' N ' ' A' ' 47' ' ' GLN . 64.0 m-85 54.91 50.49 6.34 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.577 -179.527 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.528 ' CD ' ' N ' ' A' ' 45' ' ' PHE . 52.9 Cg_exo -40.1 -16.77 0.04 OUTLIER 'Trans proline' 0 C--N 1.305 -1.747 0 C-N-CA 122.835 2.357 . . . . 0.0 112.165 179.116 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.558 ' N ' ' O ' ' A' ' 45' ' ' PHE . 71.9 tp60 -63.84 -48.5 76.52 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.542 -179.532 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 51.6 tp10 -89.41 -45.22 9.62 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.636 179.867 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . 0.486 ' O ' ' NE2' ' A' ' 98' ' ' GLN . . . 96.61 68.45 0.98 Allowed Glycine 0 CA--C 1.524 0.616 0 N-CA-C 110.956 -0.857 . . . . 0.0 110.956 -179.306 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' THR . . . . . 0.608 ' O ' H131 ' A' ' 201' ' ' MYR . 7.0 t -130.03 170.2 14.3 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.842 0.353 . . . . 0.0 110.556 -179.333 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.3 mt -103.75 132.14 50.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.665 178.814 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . 0.78 ' H ' ' HE1' ' A' ' 44' ' ' TRP . 96.3 m-20 -118.51 121.42 40.23 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.549 179.04 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 22.0 mm -91.51 -53.86 8.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.584 -179.167 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 88.9 tttt -64.17 -48.27 76.61 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.564 -179.78 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 22.9 ttm-85 -61.53 -40.67 95.49 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.627 -179.611 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' TRP . . . . . 0.598 ' CE3' ' CH2' ' A' ' 44' ' ' TRP . 36.0 t-105 -51.74 -37.28 50.47 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.577 179.706 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -66.61 -38.92 87.97 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.596 -179.959 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 94.2 mtt-85 -61.53 -52.5 64.21 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.586 -179.857 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 2.8 p -63.34 -43.62 98.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.628 179.879 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -64.53 -33.46 87.29 Favored Glycine 0 CA--C 1.525 0.697 0 N-CA-C 110.938 -0.865 . . . . 0.0 110.938 -179.709 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 10.9 m-20 -66.1 -37.01 84.7 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.788 0.327 . . . . 0.0 110.615 -179.701 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 84.0 m -63.45 -53.67 48.48 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.572 -179.82 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . 0.544 ' CD2' ' CE2' ' A' ' 37' ' ' PHE . 56.2 m-85 -67.66 -30.37 69.9 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.572 -179.608 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 60.0 tt0 -60.72 -42.26 96.92 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.579 179.382 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 29.5 t0 -63.18 -53.8 47.53 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.525 179.581 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' TYR . . . . . 0.504 ' O ' ' OG1' ' A' ' 69' ' ' THR . 60.6 m-85 -63.17 -35.55 80.68 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.518 179.615 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 62.5 t80 -57.9 -38.36 75.7 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.61 179.788 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 98.8 m-20 -66.66 -38.82 87.63 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.553 -179.896 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.504 ' OG1' ' O ' ' A' ' 66' ' ' TYR . 58.1 p -61.38 -29.74 70.1 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.618 -179.337 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -65.81 -40.94 92.33 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.572 -179.718 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . 0.423 ' H ' ' HD3' ' A' ' 72' ' ' PRO . . . 104.38 71.75 0.85 Allowed Glycine 0 CA--C 1.525 0.705 0 N-CA-C 110.937 -0.865 . . . . 0.0 110.937 179.665 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . 0.423 ' HD3' ' H ' ' A' ' 71' ' ' GLY . 19.3 Cg_exo -65.37 144.49 80.34 Favored 'Trans proline' 0 C--N 1.305 -1.721 0 C-N-CA 122.788 2.325 . . . . 0.0 112.173 179.326 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -76.29 -50.32 14.66 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.572 -179.806 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.469 ' CD ' ' N ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -138.88 6.08 2.4 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.56 -179.495 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 52.0 t 56.06 94.32 0.05 OUTLIER Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.612 -179.775 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -52.38 124.22 14.53 Favored 'Trans proline' 0 C--N 1.304 -1.767 0 C-N-CA 122.796 2.331 . . . . 0.0 112.143 -179.755 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . 0.412 ' O ' ' N ' ' A' ' 80' ' ' PHE . 41.7 t -84.18 -15.43 11.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.565 -179.467 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 69.0 p -42.17 -27.18 0.12 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.546 179.927 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.87 -41.67 98.14 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.596 179.613 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . 0.412 ' N ' ' O ' ' A' ' 77' ' ' VAL . 2.3 m-85 -66.4 -33.28 75.35 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.547 -179.984 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' SER . . . . . 0.654 ' HG ' ' CD2' ' A' ' 19' ' ' LEU . 41.8 t -60.56 -42.52 96.78 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.568 179.802 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 7.6 m-85 -59.92 -52.23 66.3 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.553 179.445 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' TRP . . . . . 0.4 ' O ' ' CB ' ' A' ' 87' ' ' LYS . 41.1 t90 -59.03 -36.49 75.08 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.612 179.855 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 78.2 m-20 -62.02 -46.99 86.74 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.576 -179.559 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 30.9 tp -70.64 -56.96 5.27 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.609 179.506 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -54.93 -24.97 15.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.563 179.547 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . 0.4 ' CB ' ' O ' ' A' ' 83' ' ' TRP . 55.0 tttt -68.89 -47.6 65.46 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.581 -179.825 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . 0.463 ' O ' ' OE1' ' A' ' 88' ' ' GLU . 1.3 pp20? -82.71 -18.71 39.88 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.569 -179.802 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.99 -46.15 90.51 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.526 179.504 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 2.7 mt -62.73 -40.68 89.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.606 179.561 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 51.3 t0 -50.72 -42.56 57.41 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.59 -179.943 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 97.2 mttt -68.03 143.63 55.46 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.604 179.888 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -75.5 9.02 2.4 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.622 -179.818 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 40.4 tp10 -59.34 -33.72 71.48 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.499 179.859 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 8.3 m -67.18 133.26 31.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.501 179.826 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' ASN . . . . . 0.541 ' O ' ' N ' ' A' ' 98' ' ' GLN . 1.1 m-20 -85.54 162.82 46.84 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.588 -179.624 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_exo -42.64 -13.45 0.04 OUTLIER 'Trans proline' 0 C--N 1.305 -1.763 0 C-N-CA 122.896 2.397 . . . . 0.0 112.101 179.271 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . 0.542 ' NE2' ' H92' ' A' ' 201' ' ' MYR . 5.0 pt20 -46.24 -25.42 0.61 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.573 -179.81 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 98.4 t -63.22 -50.6 78.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.557 -179.926 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 47.6 ttp -66.77 -41.25 88.02 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.538 -179.729 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -60.72 -25.31 66.34 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.585 -179.238 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -63.13 -17.08 61.95 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.542 179.998 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 55.8 t -60.46 -19.53 18.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.591 179.413 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -58.3 -38.94 78.04 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.579 179.894 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 98.8 mm-40 -74.04 -38.18 64.08 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.595 -179.913 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 82.0 p -65.58 -20.41 66.31 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.619 179.992 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 92.2 mt-10 54.26 -164.18 0.11 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.508 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . 0.598 ' C ' ' H ' ' A' ' 110' ' ' LEU . 72.7 mm-40 -90.04 125.85 35.55 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.589 179.22 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 44.0 pt -58.86 2.26 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.577 -179.976 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.598 ' H ' ' C ' ' A' ' 108' ' ' GLU . 91.6 mt -95.18 -5.65 43.47 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.628 179.871 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 86.5 tttt -121.48 127.13 50.74 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.594 179.948 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' SER . . . . . 0.469 ' HG ' ' H ' ' A' ' 113' ' ' ASN . 95.4 p -148.52 -113.02 0.07 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.563 -179.962 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' ASN . . . . . 0.469 ' H ' ' HG ' ' A' ' 112' ' ' SER . 77.4 m-20 -62.17 -34.79 77.09 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.618 179.617 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 62.4 p -153.07 160.2 42.92 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.53 179.735 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 86.4 mt-30 -90.15 129.65 36.4 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.581 179.993 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 116' ' ' THR . . . . . 0.406 ' OG1' ' N ' ' A' ' 117' ' ' ASP . 67.5 p -108.68 -74.46 0.66 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.602 179.874 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . 0.406 ' N ' ' OG1' ' A' ' 116' ' ' THR . 92.5 m-20 -62.36 -44.46 96.41 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.616 179.827 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.54 -44.69 93.48 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.517 179.869 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 80.4 tt0 -60.39 132.64 54.54 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.568 -179.91 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . 0.664 ' HE2' ' HE2' ' A' ' 122' ' ' HIS . 15.3 p-80 -147.31 156.85 43.29 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.644 179.932 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 80.7 m80 -112.2 154.96 24.76 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.569 -179.979 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 122' ' ' HIS . . . . . 0.664 ' HE2' ' HE2' ' A' ' 120' ' ' HIS . 97.6 m-70 -117.11 160.57 20.8 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.613 179.962 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 94.7 m-70 -65.78 -42.41 90.82 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.538 -179.94 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 124' ' ' HIS . . . . . . . . . . . . . 71.5 m80 -60.63 -41.3 94.62 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.498 -179.982 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 81.3 t60 . . . . . 0 C--O 1.22 -0.474 0 CA-C-O 118.064 -0.97 . . . . 0.0 110.535 -179.979 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 201' ' ' MYR . . . . . 0.608 H131 ' O ' ' A' ' 50' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.717 0 N-CA-C 110.95 -0.86 . . . . 0.0 110.95 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 99.4 mm-40 -62.61 -36.9 84.23 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.955 0.407 . . . . 0.0 110.369 -179.987 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 93.7 mt-10 -51.21 -21.75 2.24 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.483 179.846 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 41.5 tp -42.98 -34.86 1.06 Allowed 'General case' 0 C--O 1.236 0.348 0 CA-C-O 120.998 0.427 . . . . 0.0 110.429 -179.625 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' SER . . . . . 0.569 ' CB ' HH12 ' A' ' 10' ' ' ARG . 50.2 m -54.15 -35.18 61.96 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 120.493 -0.483 . . . . 0.0 109.958 179.789 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 71.3 tp60 -64.71 -33.24 75.5 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.96 -0.563 . . . . 0.0 110.44 179.504 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . 0.638 ' HD1' ' H92' ' A' ' 201' ' ' MYR . 86.3 t60 -59.16 -45.11 91.84 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-O 120.95 0.405 . . . . 0.0 110.069 -179.947 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -60.51 -43.38 97.13 Favored 'General case' 0 C--O 1.241 0.649 0 CA-C-N 116.034 -0.53 . . . . 0.0 109.874 179.478 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.569 HH12 ' CB ' ' A' ' 6' ' ' SER . 80.2 mtt85 -66.22 -37.31 85.24 Favored 'General case' 0 C--O 1.21 -0.974 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 179.61 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.453 ' CD1' H121 ' A' ' 201' ' ' MYR . 0.1 OUTLIER -53.28 -38.76 63.38 Favored 'General case' 0 C--N 1.319 -0.753 0 C-N-CA 120.445 -0.502 . . . . 0.0 110.172 -179.967 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 2.3 t -65.67 -52.93 44.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 C-N-CA 119.932 -0.707 . . . . 0.0 111.497 -179.868 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 77.0 tt0 -80.49 -48.64 12.5 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 120.403 -0.519 . . . . 0.0 112.004 -178.73 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . 0.501 ' N ' ' O ' ' A' ' 10' ' ' ARG . 60.9 tp60 -53.64 -53.0 58.12 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.909 -178.848 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -63.26 -49.29 74.7 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.35 -0.54 . . . . 0.0 110.121 -179.589 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 62.8 mttm -53.25 -33.81 54.55 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 120.499 -0.48 . . . . 0.0 110.268 179.319 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 89.3 mm-40 -75.42 -35.66 60.94 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.566 179.183 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -57.06 -34.44 68.25 Favored 'General case' 0 C--O 1.223 -0.296 0 CA-C-N 116.044 -0.526 . . . . 0.0 109.956 -179.931 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.9 mt -85.42 -33.48 21.93 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.096 0.474 . . . . 0.0 110.564 179.243 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -47.46 -43.28 24.05 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.541 -179.129 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' THR . . . . . 0.535 ' C ' ' H ' ' A' ' 23' ' ' GLY . 0.1 OUTLIER -72.02 -24.07 61.5 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.555 -179.908 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 71.8 mmt-85 -74.69 24.08 0.09 Allowed 'General case' 0 C--O 1.233 0.187 0 CA-C-O 120.945 0.402 . . . . 0.0 110.435 179.906 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . 0.535 ' H ' ' C ' ' A' ' 21' ' ' THR . . . 82.49 17.96 67.43 Favored Glycine 0 CA--C 1.526 0.724 0 N-CA-C 110.89 -0.884 . . . . 0.0 110.89 179.876 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 21.9 t -105.42 167.12 3.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 N-CA-C 110.294 -0.261 . . . . 0.0 110.294 -179.901 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 69.9 mmtt -129.43 132.26 46.94 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.26 179.518 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . 0.439 ' O ' ' CG2' ' A' ' 26' ' ' VAL . 30.8 m -127.83 105.22 13.26 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.252 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.239 -179.956 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.423 ' N ' ' OD1' ' A' ' 30' ' ' ASP . 8.3 pttm -104.89 163.39 12.56 Favored 'General case' 0 C--O 1.218 -0.579 0 N-CA-C 109.806 -0.442 . . . . 0.0 109.806 179.812 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 84.2 m-85 -42.86 -34.89 1.03 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.961 0.41 . . . . 0.0 110.782 179.981 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -56.85 -23.27 42.91 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.819 179.839 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.423 ' OD1' ' N ' ' A' ' 27' ' ' LYS . 1.1 m-20 -61.91 -46.97 87.04 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.613 -179.159 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.5 ' O ' ' CB ' ' A' ' 35' ' ' PHE . 5.8 mp -67.24 -41.56 85.42 Favored 'General case' 0 C--O 1.215 -0.73 0 CA-C-O 120.943 0.401 . . . . 0.0 110.393 179.738 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 42.3 mt -57.27 -45.86 83.64 Favored 'General case' 0 C--N 1.314 -0.973 0 C-N-CA 119.419 -0.913 . . . . 0.0 111.03 -178.359 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -84.32 -50.17 8.07 Favored 'General case' 0 C--N 1.32 -0.696 0 C-N-CA 120.472 -0.491 . . . . 0.0 111.909 -179.089 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . 0.414 ' CB ' ' O ' ' A' ' 30' ' ' ASP . 42.0 t80 -62.47 -49.56 74.92 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.461 -178.531 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.5 ' CB ' ' O ' ' A' ' 31' ' ' LEU . 22.4 t80 -61.22 -44.56 97.08 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.103 -179.567 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -69.37 -40.56 77.39 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 120.275 -0.57 . . . . 0.0 111.663 179.975 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.573 ' CE2' ' CE1' ' A' ' 63' ' ' PHE . 3.0 m-85 -62.08 -48.66 79.22 Favored 'General case' 0 CA--C 1.518 -0.278 0 CA-C-O 120.858 0.361 . . . . 0.0 111.887 -178.281 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.554 ' O ' ' N ' ' A' ' 42' ' ' CYS . 17.1 m -70.03 -41.62 79.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.467 -179.745 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -63.04 -31.7 72.89 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.506 -0.316 . . . . 0.0 110.95 -179.732 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 98.8 m-20 -56.66 -49.71 74.24 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 120.906 -0.317 . . . . 0.0 111.113 -179.169 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' THR . . . . . 0.495 ' O ' ' SG ' ' A' ' 42' ' ' CYS . 15.4 p -106.64 -7.61 17.29 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.545 -0.298 . . . . 0.0 110.954 -179.741 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . 0.554 ' N ' ' O ' ' A' ' 38' ' ' VAL . 28.6 p 38.04 57.52 4.8 Favored Pre-proline 0 N--CA 1.463 0.186 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.303 -179.234 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -75.95 -31.42 5.06 Favored 'Trans proline' 0 C--N 1.314 -1.257 0 C-N-CA 122.551 2.167 . . . . 0.0 112.582 -179.4 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . 0.631 ' CH2' ' CE3' ' A' ' 56' ' ' TRP . 0.0 OUTLIER -77.76 13.75 1.25 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.89 -179.646 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.532 ' CD2' ' OD2' ' A' ' 52' ' ' ASP . 6.1 m-85 39.56 53.58 5.06 Favored Pre-proline 0 C--O 1.232 0.142 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.076 -179.874 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.444 ' CD ' ' N ' ' A' ' 45' ' ' PHE . 11.1 Cg_endo -53.38 -5.7 0.28 Allowed 'Trans proline' 0 C--N 1.31 -1.488 0 C-N-CA 122.714 2.276 . . . . 0.0 112.004 -179.688 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.497 ' H ' ' C ' ' A' ' 45' ' ' PHE . 64.1 tp60 -64.17 -48.79 74.6 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.333 -179.448 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.423 ' O ' ' H52' ' A' ' 201' ' ' MYR . 1.2 tp10 -89.42 -30.24 18.47 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-O 120.908 0.385 . . . . 0.0 110.531 179.155 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . 0.58 ' CA ' ' H91' ' A' ' 201' ' ' MYR . . . 87.65 75.19 1.28 Allowed Glycine 0 CA--C 1.523 0.573 0 N-CA-C 110.844 -0.902 . . . . 0.0 110.844 -179.445 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 13.6 t -144.11 165.22 28.43 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.623 0.249 . . . . 0.0 110.653 -179.792 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.1 mt -98.96 133.85 40.05 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.265 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 179.283 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . 0.568 ' H ' ' HE1' ' A' ' 44' ' ' TRP . 73.7 m-20 -117.91 121.17 40.0 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.276 179.083 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 18.5 mm -87.32 -46.49 16.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.825 179.998 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -66.22 -45.84 79.29 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-O 121.108 0.48 . . . . 0.0 111.283 -179.775 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 77.3 mmt-85 -63.72 -33.97 76.84 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.908 -0.587 . . . . 0.0 109.909 -179.507 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' TRP . . . . . 0.631 ' CE3' ' CH2' ' A' ' 44' ' ' TRP . 50.3 t-105 -59.29 -36.79 76.21 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-O 121.3 0.572 . . . . 0.0 110.049 179.994 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 44.0 ttm180 -65.21 -41.33 94.58 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.308 179.55 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 95.2 mtt-85 -61.75 -53.07 61.01 Favored 'General case' 0 N--CA 1.466 0.334 0 C-N-CA 120.793 -0.363 . . . . 0.0 111.562 -179.491 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 4.8 p -63.16 -45.93 97.26 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.391 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.198 179.632 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -63.04 -36.72 93.85 Favored Glycine 0 CA--C 1.524 0.615 0 N-CA-C 111.05 -0.82 . . . . 0.0 111.05 179.903 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 53.9 m-20 -65.24 -35.74 82.0 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.652 0.263 . . . . 0.0 110.692 -179.479 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 80.9 m -64.29 -55.33 22.09 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.821 0.344 . . . . 0.0 110.718 -179.93 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . 0.573 ' CE1' ' CE2' ' A' ' 37' ' ' PHE . 59.4 m-85 -64.47 -33.99 77.17 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.427 179.47 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 57.9 tt0 -60.0 -42.89 95.26 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 120.891 -0.324 . . . . 0.0 110.614 -179.88 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 20.8 t0 -61.1 -51.71 68.0 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.825 179.834 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' TYR . . . . . 0.41 ' O ' ' OG1' ' A' ' 69' ' ' THR . 41.3 m-85 -65.97 -35.03 79.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.739 179.735 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 56.9 t80 -59.57 -44.41 93.31 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.291 -179.424 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 39.6 t30 -64.37 -40.33 95.62 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.579 179.941 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.41 ' OG1' ' O ' ' A' ' 66' ' ' TYR . 41.0 p -66.1 -22.5 66.4 Favored 'General case' 0 CA--C 1.516 -0.332 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.342 179.933 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -70.04 -46.85 64.14 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 120.009 -0.676 . . . . 0.0 110.995 179.911 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . 0.414 ' H ' ' HD3' ' A' ' 72' ' ' PRO . . . 113.29 70.73 0.55 Allowed Glycine 0 CA--C 1.532 1.101 0 N-CA-C 110.698 -0.961 . . . . 0.0 110.698 -179.494 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . 0.414 ' HD3' ' H ' ' A' ' 71' ' ' GLY . 23.6 Cg_exo -63.93 147.34 92.01 Favored 'Trans proline' 0 N--CA 1.499 1.822 0 C-N-CA 123.029 2.486 . . . . 0.0 112.068 179.979 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -80.8 -49.52 11.0 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-O 120.953 0.406 . . . . 0.0 110.338 179.63 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.419 ' CD ' ' N ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -137.46 2.62 2.49 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.654 -179.481 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 68.8 t 57.7 93.5 0.05 OUTLIER Pre-proline 0 C--N 1.325 -0.48 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.211 -178.805 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -53.58 126.66 22.5 Favored 'Trans proline' 0 N--CA 1.495 1.59 0 C-N-CA 121.805 1.67 . . . . 0.0 111.786 -179.583 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . 0.466 ' O ' ' N ' ' A' ' 80' ' ' PHE . 40.8 t -83.25 -20.53 9.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.679 179.822 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 63.6 p -41.55 -26.34 0.07 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.265 -179.27 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . 0.433 ' N ' ' O ' ' A' ' 77' ' ' VAL . . . -64.02 -42.69 97.04 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.546 179.654 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . 0.466 ' N ' ' O ' ' A' ' 77' ' ' VAL . 10.8 m-85 -64.5 -35.45 80.98 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.143 179.694 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 37.3 m -59.89 -42.09 93.01 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.353 179.814 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 4.1 m-85 -60.17 -51.36 69.91 Favored 'General case' 0 C--N 1.331 -0.215 0 C-N-CA 120.88 -0.328 . . . . 0.0 110.609 -179.951 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' TRP . . . . . . . . . . . . . 47.2 t90 -59.23 -39.01 81.39 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.645 179.66 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 12.4 m120 -61.86 -44.14 97.43 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.562 -179.651 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 25.0 tp -72.14 -59.32 2.8 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 120.358 -0.537 . . . . 0.0 110.135 179.359 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -50.74 -28.79 6.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-O 120.895 0.379 . . . . 0.0 110.395 179.709 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 66.0 tttt -65.26 -50.99 63.67 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.9 -179.293 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.1 pp20? -79.96 -20.1 46.35 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.801 -179.683 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.85 -46.24 90.31 Favored 'General case' 0 N--CA 1.443 -0.815 0 C-N-CA 120.158 -0.617 . . . . 0.0 110.486 -178.771 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 3.2 mt -63.67 -44.21 98.37 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 C-N-CA 119.891 -0.723 . . . . 0.0 109.937 -179.605 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 -64.88 -12.29 47.2 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.785 -178.988 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 68.1 tttt -74.04 139.83 44.98 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.377 179.736 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -74.86 -10.22 59.29 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.84 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 80.3 mm-40 -86.47 52.31 2.46 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.562 179.857 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 27.1 m -115.89 131.71 67.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.485 179.915 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' ASN . . . . . 0.456 ' OD1' ' N ' ' A' ' 96' ' ' ASN . 0.0 OUTLIER -58.76 161.88 7.73 Favored Pre-proline 0 C--N 1.324 -0.528 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.474 179.777 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -58.98 -13.22 17.86 Favored 'Trans proline' 0 N--CA 1.495 1.597 0 C-N-CA 122.821 2.347 . . . . 0.0 112.153 179.682 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . 0.837 HE22 ' H82' ' A' ' 201' ' ' MYR . 0.9 OUTLIER -48.47 -23.08 0.84 Allowed 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.557 179.818 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 77.4 t -63.0 -51.65 69.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 C-N-CA 120.56 -0.456 . . . . 0.0 110.743 -179.692 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 89.0 mmm -71.29 -40.13 71.08 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.578 179.741 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -64.25 -24.01 67.51 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.551 -179.618 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -67.89 -14.95 63.38 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.482 179.896 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.448 ' O ' ' O ' ' A' ' 106' ' ' THR . 55.7 t -63.84 -19.59 24.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.328 179.531 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -60.76 -36.54 79.2 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.718 -179.885 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . 0.426 ' OE1' ' CD2' ' A' ' 45' ' ' PHE . 53.9 tt0 -64.79 -42.12 95.3 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.055 -179.652 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' THR . . . . . 0.448 ' O ' ' O ' ' A' ' 103' ' ' VAL . 28.3 m -105.67 125.21 50.73 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.704 -179.762 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -130.31 179.51 5.87 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.57 -179.97 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . 0.536 ' C ' ' H ' ' A' ' 110' ' ' LEU . 98.7 mt-10 -108.64 122.82 47.9 Favored 'General case' 0 CA--C 1.513 -0.445 0 CA-C-N 115.943 -0.571 . . . . 0.0 109.895 179.132 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 38.3 pt -49.45 -11.63 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.036 179.779 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.536 ' H ' ' C ' ' A' ' 108' ' ' GLU . 36.3 mt -68.16 -40.88 82.25 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.725 179.779 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -68.47 -39.98 81.16 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.357 -179.921 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 16.2 t -62.52 -44.42 96.4 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.856 -179.549 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 10.3 m120 -63.03 -40.82 98.86 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.539 -179.941 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 35.6 p -158.04 160.92 37.93 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.593 179.872 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 115' ' ' GLN . . . . . 0.43 ' O ' ' O ' ' A' ' 118' ' ' LEU . 14.8 pt20 -100.88 7.66 43.54 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.377 179.89 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 11.4 m -60.75 -44.63 96.46 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.395 -179.676 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 59.7 t0 -61.49 -49.45 76.74 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.842 -179.962 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . 0.43 ' O ' ' O ' ' A' ' 115' ' ' GLN . 86.0 mt -122.46 132.53 54.39 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.583 -179.857 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 22.4 pt-20 -136.22 161.38 35.93 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.555 -0.293 . . . . 0.0 110.293 -179.93 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 70.3 m80 -115.85 150.24 37.32 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.243 -179.965 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 88.4 m-70 -129.82 157.23 42.78 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.424 -179.933 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 36.0 m80 -120.4 143.75 48.29 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.6 -179.925 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 98.3 m-70 -65.44 -38.55 90.22 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.412 -179.928 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 124' ' ' HIS . . . . . . . . . . . . . 78.1 m80 -117.63 143.43 46.15 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.625 179.908 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 71.7 t60 . . . . . 0 C--O 1.22 -0.464 0 CA-C-O 118.004 -0.998 . . . . 0.0 110.517 179.9 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 201' ' ' MYR . . . . . 0.837 ' H82' HE22 ' A' ' 98' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.646 0 N-CA-C 110.987 -0.845 . . . . 0.0 110.987 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . 0.489 ' O ' ' N ' ' A' ' 5' ' ' LEU . 89.3 mt-30 -65.37 -22.08 66.76 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.819 0.342 . . . . 0.0 110.576 -179.828 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . 0.496 ' O ' ' N ' ' A' ' 7' ' ' GLN . 91.2 mt-10 -43.09 -20.52 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.558 179.912 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.489 ' N ' ' O ' ' A' ' 3' ' ' GLN . 59.6 tp -41.42 -37.47 1.05 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.602 179.671 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 96.3 p -59.09 -37.0 76.07 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.611 179.675 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . 0.496 ' N ' ' O ' ' A' ' 4' ' ' GLU . 58.3 tt0 -65.11 -37.01 86.1 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.552 179.05 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . 0.52 ' CE1' H111 ' A' ' 201' ' ' MYR . 78.8 t60 -53.83 -45.81 70.99 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.519 179.636 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -60.77 -46.24 91.22 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.553 179.688 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.517 ' O ' ' N ' ' A' ' 14' ' ' GLN . 88.5 mtt-85 -64.91 -32.28 73.91 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.566 179.496 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.49 ' O ' ' HB2' ' A' ' 15' ' ' LEU . 48.1 t80 -59.72 -35.19 74.03 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.529 179.854 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 4.2 t -65.21 -48.27 84.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.53 -178.935 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -83.79 -32.71 25.22 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.563 -179.82 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . 0.517 ' N ' ' O ' ' A' ' 10' ' ' ARG . 60.8 tp60 -73.58 -50.27 22.11 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.562 -178.186 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.49 ' HB2' ' O ' ' A' ' 11' ' ' TYR . 0.3 OUTLIER -63.45 -47.6 81.2 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.521 179.761 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 92.7 mttt -57.33 -32.76 67.04 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.582 179.086 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 60.1 tt0 -73.12 -37.52 66.64 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.598 178.461 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -56.76 -32.98 66.13 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.533 179.442 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.416 ' O ' ' N ' ' A' ' 22' ' ' ARG . 2.8 mt -85.73 -33.13 21.55 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.597 178.569 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 63.9 tttm -44.44 -42.65 7.18 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.559 -179.928 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' THR . . . . . 0.609 ' C ' ' H ' ' A' ' 23' ' ' GLY . 0.2 OUTLIER -75.39 -27.7 59.19 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.516 -179.706 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.416 ' N ' ' O ' ' A' ' 19' ' ' LEU . 77.8 mmt-85 -68.9 21.64 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.536 -179.874 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . 0.609 ' H ' ' C ' ' A' ' 21' ' ' THR . . . 87.56 14.11 64.1 Favored Glycine 0 CA--C 1.525 0.7 0 N-CA-C 110.887 -0.885 . . . . 0.0 110.887 -179.567 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 11.3 t -104.89 167.19 2.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-O 120.871 0.367 . . . . 0.0 110.538 179.726 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -135.23 120.95 19.53 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.534 179.62 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 17.2 m -120.53 116.12 49.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.551 -179.769 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 29.9 pttt -108.67 166.93 10.43 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.541 179.953 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 98.4 m-85 -47.29 -40.01 15.86 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.551 179.384 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -57.99 -23.38 53.7 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.609 179.547 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 54.9 t0 -62.08 -43.79 98.08 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.548 -179.647 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.525 ' O ' ' CB ' ' A' ' 35' ' ' PHE . 5.6 mp -66.48 -43.45 85.38 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.588 179.545 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.431 ' O ' ' OD2' ' A' ' 36' ' ' ASP . 35.4 mt -58.4 -42.44 87.18 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.508 -177.852 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 85.3 tttt -86.33 -51.69 6.08 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.577 -178.229 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 57.6 t80 -61.7 -49.53 76.11 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.543 -177.669 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.525 ' CB ' ' O ' ' A' ' 31' ' ' LEU . 6.7 t80 -62.26 -44.83 95.66 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.593 -178.398 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . 0.431 ' OD2' ' O ' ' A' ' 32' ' ' LEU . 98.4 m-20 -66.95 -35.45 80.0 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.45 -179.644 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 2.3 m-85 -61.18 -52.56 64.29 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.558 -178.642 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.561 ' O ' ' N ' ' A' ' 42' ' ' CYS . 23.0 m -68.06 -38.89 80.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.623 -178.442 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -61.62 -25.94 67.67 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.517 -179.067 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 67.3 t0 -55.61 -55.3 33.69 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.49 -178.693 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' THR . . . . . 0.515 ' O ' ' SG ' ' A' ' 42' ' ' CYS . 15.5 p -115.35 -2.65 12.58 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.561 -178.517 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . 0.561 ' N ' ' O ' ' A' ' 38' ' ' VAL . 23.1 p 38.25 59.25 5.05 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.558 -179.418 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . 0.453 ' C ' ' H ' ' A' ' 45' ' ' PHE . 64.8 Cg_endo -77.12 -23.97 9.99 Favored 'Trans proline' 0 C--N 1.305 -1.72 0 C-N-CA 122.871 2.38 . . . . 0.0 112.142 -179.57 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . 0.534 ' CZ3' ' CE3' ' A' ' 56' ' ' TRP . 0.0 OUTLIER -69.36 5.1 1.41 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.569 -179.477 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.453 ' H ' ' C ' ' A' ' 43' ' ' PRO . 38.4 t80 48.2 57.56 17.97 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.572 179.79 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 23.2 Cg_endo -61.0 -7.09 7.18 Favored 'Trans proline' 0 C--N 1.305 -1.74 0 C-N-CA 122.758 2.305 . . . . 0.0 112.16 -178.777 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 82.6 mt-30 -54.7 -52.91 60.95 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.541 -179.796 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.458 ' O ' ' H52' ' A' ' 201' ' ' MYR . 43.8 tp10 -89.68 -27.69 19.95 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.619 179.317 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . 0.437 ' O ' ' H72' ' A' ' 201' ' ' MYR . . . 85.73 66.04 1.43 Allowed Glycine 0 CA--C 1.525 0.671 0 N-CA-C 110.978 -0.849 . . . . 0.0 110.978 -178.847 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' THR . . . . . 0.592 ' HG1' ' H ' ' A' ' 51' ' ' ILE . 10.7 t -132.77 170.2 15.61 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.788 0.327 . . . . 0.0 110.584 -179.449 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.592 ' H ' ' HG1' ' A' ' 50' ' ' THR . 1.8 mt -93.66 141.55 14.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.549 179.532 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . 0.494 ' H ' ' HE1' ' A' ' 44' ' ' TRP . 1.2 m-20 -114.51 122.76 47.56 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.542 179.784 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 25.2 mm -96.16 -55.75 5.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.648 179.648 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 67.8 mttm -73.34 -49.26 28.29 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.569 -178.978 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -62.16 -32.01 72.58 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.561 -178.555 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' TRP . . . . . 0.534 ' CE3' ' CZ3' ' A' ' 44' ' ' TRP . 13.0 t-105 -62.86 -38.28 90.2 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.557 179.304 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -64.31 -36.4 83.98 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.523 -179.728 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 94.6 mtt180 -60.54 -53.4 57.93 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.591 -179.294 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . 0.411 HG11 ' N ' ' A' ' 60' ' ' GLY . 2.6 p -66.96 -42.72 89.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.629 -179.862 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . 0.411 ' N ' HG11 ' A' ' 59' ' ' VAL . . . -62.72 -37.77 95.37 Favored Glycine 0 CA--C 1.525 0.707 0 N-CA-C 110.915 -0.874 . . . . 0.0 110.915 179.695 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 95.4 m-20 -65.88 -40.37 91.55 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.878 0.371 . . . . 0.0 110.602 -179.238 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 76.7 m -63.34 -57.18 11.2 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.568 -178.927 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 37.8 m-85 -64.4 -42.67 95.96 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.62 -179.153 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 55.8 tt0 -63.92 -34.43 77.95 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.558 -179.345 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 41.2 t0 -60.33 -53.44 57.62 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.597 -179.945 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 65.7 m-85 -69.81 -39.19 76.67 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.507 179.962 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 69.5 t80 -60.55 -41.07 93.77 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.586 -179.844 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . 0.452 ' OD1' ' O ' ' A' ' 72' ' ' PRO . 51.2 t-20 -65.36 -45.52 83.83 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.536 -179.387 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 80.4 p -68.87 -16.78 63.86 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.594 -179.185 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 2.3 m-85 -76.02 -5.66 47.45 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.596 -179.325 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . 0.493 ' O ' ' N ' ' A' ' 73' ' ' GLU . . . 153.94 -67.14 0.31 Allowed Glycine 0 CA--C 1.525 0.715 0 N-CA-C 110.912 -0.875 . . . . 0.0 110.912 179.535 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . 0.452 ' O ' ' OD1' ' A' ' 68' ' ' ASN . 38.6 Cg_exo -39.69 88.12 0.01 OUTLIER 'Trans proline' 0 C--N 1.304 -1.812 0 C-N-CA 122.815 2.344 . . . . 0.0 112.114 -176.874 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.493 ' N ' ' O ' ' A' ' 71' ' ' GLY . 83.2 tt0 -66.24 -34.65 78.49 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.576 179.589 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.608 ' CD ' ' H ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -97.0 -16.72 20.46 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.549 179.9 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.511 ' O ' ' O ' ' A' ' 74' ' ' LYS . 19.8 t 57.4 132.04 0.02 OUTLIER Pre-proline 0 C--N 1.329 -0.323 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.526 179.447 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 41.1 Cg_exo -50.44 123.65 11.68 Favored 'Trans proline' 0 C--N 1.305 -1.737 0 C-N-CA 122.864 2.376 . . . . 0.0 112.101 178.352 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . 0.417 ' O ' ' N ' ' A' ' 80' ' ' PHE . 40.6 t -81.79 -20.33 10.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.531 -179.795 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' THR . . . . . 0.478 ' O ' ' OG ' ' A' ' 81' ' ' SER . 22.7 p -43.1 -24.8 0.09 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.585 178.815 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.91 -37.74 86.88 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.534 179.92 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . 0.417 ' N ' ' O ' ' A' ' 77' ' ' VAL . 2.5 m-85 -63.1 -37.17 86.16 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.601 -179.263 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' SER . . . . . 0.518 ' HG ' ' N ' ' A' ' 82' ' ' TYR . 93.3 p -58.62 -39.6 80.94 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.574 -179.727 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' TYR . . . . . 0.518 ' N ' ' HG ' ' A' ' 81' ' ' SER . 11.2 m-85 -61.17 -47.73 84.82 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.601 179.688 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' TRP . . . . . 0.422 ' O ' ' CB ' ' A' ' 87' ' ' LYS . 40.0 t90 -59.19 -37.82 78.35 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.568 -179.528 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 97.5 m-20 -61.24 -47.04 87.87 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.549 -178.598 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 25.4 tp -72.27 -55.44 7.17 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.563 179.782 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -56.11 -25.37 19.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.567 179.506 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . 0.422 ' CB ' ' O ' ' A' ' 83' ' ' TRP . 57.1 tttt -67.56 -50.78 56.89 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.61 179.467 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . 0.469 ' C ' ' CD ' ' A' ' 88' ' ' GLU . 0.9 OUTLIER -78.96 -20.17 49.89 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.551 -179.873 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.29 -49.42 77.66 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.535 179.845 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 3.3 mt -63.79 -41.09 91.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.56 179.21 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 97.5 m-20 -69.18 -16.43 63.62 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.572 -179.409 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 70.4 tttt -68.4 140.97 55.83 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.561 -179.886 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -70.9 -4.56 25.05 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.488 -179.522 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 27.5 tp10 -84.57 46.78 1.27 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.562 -179.579 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 34.1 m -125.83 132.91 70.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.519 -179.807 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' ASN . . . . . 0.587 ' O ' ' N ' ' A' ' 98' ' ' GLN . 10.1 m-20 -87.18 157.58 53.54 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.548 -179.249 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_exo -41.35 -13.24 0.03 OUTLIER 'Trans proline' 0 C--N 1.305 -1.733 0 C-N-CA 122.812 2.341 . . . . 0.0 112.147 178.785 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . 0.587 ' N ' ' O ' ' A' ' 96' ' ' ASN . 6.9 pt20 -51.75 -34.45 39.36 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.554 179.951 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 90.4 t -64.52 -51.12 71.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.58 179.348 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 81.5 mtp -68.68 -38.35 80.28 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.563 179.907 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -59.36 -27.7 66.18 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.587 -179.854 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -61.72 -16.11 46.4 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.604 179.732 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 83.1 t -64.77 -19.09 24.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.525 179.719 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -55.64 -38.76 69.95 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.502 -179.934 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 77.0 mt-30 45.55 -115.36 0.51 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.559 -179.714 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 28.9 m -64.49 133.26 52.07 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.556 -179.89 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 86.9 mt-10 -124.19 -175.61 3.29 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.519 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . 0.56 ' C ' ' H ' ' A' ' 110' ' ' LEU . 73.8 mm-40 -106.58 122.45 46.34 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.553 179.373 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . 0.429 ' O ' ' OG ' ' A' ' 112' ' ' SER . 43.8 pt -45.49 -12.87 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.595 179.869 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.56 ' H ' ' C ' ' A' ' 108' ' ' GLU . 25.6 mt -67.11 -44.94 78.68 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.509 179.843 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 62.4 tttm -65.34 -33.86 76.96 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.566 -179.605 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' SER . . . . . 0.429 ' OG ' ' O ' ' A' ' 109' ' ' ILE . 97.0 p -63.57 -46.83 84.09 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.551 -179.813 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 31.7 t30 -65.57 -42.45 91.79 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.588 179.608 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' SER . . . . . 0.481 ' C ' ' H ' ' A' ' 116' ' ' THR . 22.8 t -164.51 132.57 3.38 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.552 179.994 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 86.6 mt-30 -77.94 27.65 0.18 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.54 179.984 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 116' ' ' THR . . . . . 0.481 ' H ' ' C ' ' A' ' 114' ' ' SER . 7.8 m -61.22 -41.3 96.62 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.557 179.914 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 95.0 m-20 -59.93 -44.96 94.02 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.592 179.656 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 10.8 mp -106.38 29.46 6.82 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.626 -179.708 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 72.0 tt0 -46.32 131.26 10.65 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.565 179.949 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 94.8 m-70 -112.4 139.07 48.28 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.538 -179.84 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 121' ' ' HIS . . . . . 0.443 ' O ' ' NE2' ' A' ' 124' ' ' HIS . 96.4 m-70 -107.7 141.08 39.78 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.572 179.284 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 75.1 m80 -65.08 -37.04 86.22 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.543 179.701 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 62.6 t60 -119.88 122.48 41.37 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.524 -179.904 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 124' ' ' HIS . . . . . 0.443 ' NE2' ' O ' ' A' ' 121' ' ' HIS . 96.1 m-70 -107.96 134.13 51.3 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.534 179.723 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 89.1 m-70 . . . . . 0 C--O 1.219 -0.512 0 CA-C-O 117.999 -1.0 . . . . 0.0 110.571 179.981 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 201' ' ' MYR . . . . . 0.53 H141 ' NE1' ' A' ' 44' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.704 0 N-CA-C 110.941 -0.864 . . . . 0.0 110.941 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 52.3 tt0 -63.14 -29.38 70.75 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.871 0.367 . . . . 0.0 110.444 -179.827 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 95.2 mt-10 -55.97 -22.98 29.52 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.651 179.811 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 43.2 tp -44.23 -35.3 2.2 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.511 -179.525 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 78.2 p -55.03 -35.14 64.13 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.641 -0.423 . . . . 0.0 109.92 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 68.2 tp60 -64.11 -35.57 81.17 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.181 179.561 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . 0.516 ' HD1' ' H82' ' A' ' 201' ' ' MYR . 83.2 t60 -60.28 -44.62 95.18 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.257 179.988 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -58.78 -46.53 87.3 Favored 'General case' 0 C--O 1.241 0.613 0 C-N-CA 120.522 -0.471 . . . . 0.0 110.183 -179.923 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.447 ' O ' ' N ' ' A' ' 14' ' ' GLN . 87.2 mtt-85 -67.21 -36.53 81.92 Favored 'General case' 0 C--O 1.21 -1.008 0 N-CA-C 109.322 -0.622 . . . . 0.0 109.322 179.607 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.437 ' HH ' ' CD1' ' A' ' 51' ' ' ILE . 20.3 t80 -57.87 -27.9 63.67 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 120.878 -0.329 . . . . 0.0 110.313 -179.433 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 6.7 t -73.8 -51.16 25.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 C-N-CA 120.241 -0.584 . . . . 0.0 111.109 179.69 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -81.49 -23.72 37.17 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.084 0.469 . . . . 0.0 111.635 -179.329 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . 0.447 ' N ' ' O ' ' A' ' 10' ' ' ARG . 66.5 tp60 -77.49 -53.57 7.47 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.978 -179.117 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.47 -45.4 90.98 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-O 120.896 0.379 . . . . 0.0 110.062 -179.907 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -59.99 -36.22 76.7 Favored 'General case' 0 C--O 1.232 0.145 0 C-N-CA 120.617 -0.433 . . . . 0.0 109.953 179.568 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 73.9 mt-30 -72.94 -40.33 65.48 Favored 'General case' 0 C--O 1.238 0.453 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.632 178.738 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -57.33 -26.57 61.14 Favored 'General case' 0 CA--C 1.518 -0.256 0 CA-C-N 115.918 -0.583 . . . . 0.0 109.97 179.935 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 4.2 mt -84.71 -40.96 16.71 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.846 -0.342 . . . . 0.0 110.452 178.949 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 28.8 mtmt -45.45 -44.2 12.04 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.124 -178.885 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -58.5 -34.33 70.82 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 120.422 -0.511 . . . . 0.0 110.425 -179.5 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 84.2 mmt-85 -66.56 -7.09 17.72 Favored 'General case' 0 C--N 1.332 -0.195 0 C-N-CA 120.656 -0.418 . . . . 0.0 110.295 -179.881 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 107.22 23.7 6.87 Favored Glycine 0 CA--C 1.526 0.778 0 N-CA-C 111.021 -0.832 . . . . 0.0 111.021 -179.721 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.457 ' CG1' ' N ' ' A' ' 25' ' ' LYS . 38.6 t -102.89 169.32 1.96 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 N-CA-C 110.337 -0.246 . . . . 0.0 110.337 -179.991 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.457 ' N ' ' CG1' ' A' ' 24' ' ' VAL . 99.0 mttt -134.65 131.82 38.22 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.985 -0.376 . . . . 0.0 109.985 179.268 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 28.4 m -122.88 129.23 75.26 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.285 0 N-CA-C 109.989 -0.374 . . . . 0.0 109.989 179.887 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.423 ' HG2' ' H ' ' A' ' 28' ' ' TYR . 23.7 ttmt -109.53 159.99 16.61 Favored 'General case' 0 N--CA 1.463 0.18 0 N-CA-C 110.065 -0.346 . . . . 0.0 110.065 179.585 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . 0.423 ' H ' ' HG2' ' A' ' 27' ' ' LYS . 96.6 m-85 -50.61 -31.77 16.93 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.001 0.429 . . . . 0.0 109.867 179.341 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -55.34 -23.31 23.29 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.225 179.414 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.423 ' O ' ' CB ' ' A' ' 34' ' ' PHE . 86.0 m-20 -61.2 -48.15 82.84 Favored 'General case' 0 C--O 1.219 -0.512 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.56 -179.525 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.495 ' O ' ' CB ' ' A' ' 35' ' ' PHE . 5.3 mp -66.07 -41.45 90.74 Favored 'General case' 0 C--O 1.216 -0.708 0 C-N-CA 120.571 -0.452 . . . . 0.0 110.385 179.469 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 37.8 mt -58.97 -46.3 88.45 Favored 'General case' 0 C--N 1.313 -0.99 0 C-N-CA 119.468 -0.893 . . . . 0.0 111.176 -178.013 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.441 ' O ' ' CB ' ' A' ' 37' ' ' PHE . 87.9 tttt -85.49 -48.17 9.22 Favored 'General case' 0 C--N 1.319 -0.754 0 C-N-CA 120.553 -0.459 . . . . 0.0 112.091 -178.692 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . 0.423 ' CB ' ' O ' ' A' ' 30' ' ' ASP . 44.0 t80 -63.54 -48.07 79.04 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.376 -178.993 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.495 ' CB ' ' O ' ' A' ' 31' ' ' LEU . 18.4 t80 -61.85 -48.41 80.68 Favored 'General case' 0 C--N 1.33 -0.242 0 C-N-CA 120.475 -0.49 . . . . 0.0 110.363 -179.146 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 65.8 t0 -72.96 -34.8 66.72 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 120.474 -0.49 . . . . 0.0 111.462 -179.803 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.441 ' CB ' ' O ' ' A' ' 33' ' ' LYS . 4.3 t80 -60.99 -48.5 81.55 Favored 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 120.984 -0.286 . . . . 0.0 111.635 -178.296 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.548 ' O ' ' N ' ' A' ' 42' ' ' CYS . 15.4 m -74.6 -36.93 42.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 C-N-CA 120.408 -0.517 . . . . 0.0 110.688 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -55.7 -29.79 60.02 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.867 -179.813 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 68.0 t0 -47.03 -61.49 1.85 Allowed 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 120.646 -0.421 . . . . 0.0 110.745 -179.744 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 13.9 p -114.8 2.01 14.27 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.345 -0.388 . . . . 0.0 111.049 179.822 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . 0.548 ' N ' ' O ' ' A' ' 38' ' ' VAL . 1.9 m 38.07 58.59 4.9 Favored Pre-proline 0 CA--C 1.534 0.364 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.831 -178.706 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . 0.527 ' C ' ' H ' ' A' ' 45' ' ' PHE . 26.9 Cg_exo -63.39 -36.97 52.32 Favored 'Trans proline' 0 N--CA 1.5 1.885 0 C-N-CA 122.617 2.211 . . . . 0.0 112.857 -179.069 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . 0.757 ' HE1' ' H ' ' A' ' 52' ' ' ASP . 0.0 OUTLIER -66.45 6.19 0.48 Allowed 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.62 -179.281 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.528 ' C ' ' H ' ' A' ' 47' ' ' GLN . 19.8 m-85 44.25 56.48 13.51 Favored Pre-proline 0 C--N 1.33 -0.24 0 N-CA-C 109.887 -0.412 . . . . 0.0 109.887 -179.832 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.426 ' O ' ' H41' ' A' ' 201' ' ' MYR . 10.2 Cg_endo -51.27 -6.34 0.12 Allowed 'Trans proline' 0 N--CA 1.493 1.445 0 C-N-CA 122.773 2.316 . . . . 0.0 111.917 179.929 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.528 ' H ' ' C ' ' A' ' 45' ' ' PHE . 95.9 mm-40 -62.72 -52.04 64.82 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.128 -179.913 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.482 ' N ' ' CD ' ' A' ' 48' ' ' GLU . 0.0 OUTLIER -88.0 -31.82 19.14 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-O 121.04 0.448 . . . . 0.0 110.169 178.973 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 85.7 66.18 1.42 Allowed Glycine 0 CA--C 1.523 0.554 0 N-CA-C 110.616 -0.994 . . . . 0.0 110.616 -178.731 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 14.8 t -125.98 170.24 11.91 Favored 'General case' 0 CA--C 1.517 -0.305 0 CA-C-O 120.679 0.276 . . . . 0.0 110.772 -179.502 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.437 ' CD1' ' HH ' ' A' ' 11' ' ' TYR . 1.3 mt -102.36 138.88 25.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.198 179.814 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . 0.757 ' H ' ' HE1' ' A' ' 44' ' ' TRP . 84.2 m-20 -114.28 122.15 45.84 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.726 179.644 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.404 HG22 HD12 ' A' ' 53' ' ' ILE . 29.9 mm -94.63 -55.86 5.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.506 179.735 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -78.01 -50.48 12.02 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-O 121.032 0.444 . . . . 0.0 111.707 -179.06 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 93.1 mtt-85 -59.47 -32.01 69.85 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.082 -0.508 . . . . 0.0 109.863 -179.64 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' TRP . . . . . 0.573 ' CE3' ' CH2' ' A' ' 44' ' ' TRP . 23.2 t-105 -60.7 -40.81 93.64 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.449 179.098 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 92.5 mtm-85 -63.28 -33.63 75.93 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 120.291 -0.564 . . . . 0.0 109.831 179.92 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . 0.442 ' O ' ' SG ' ' A' ' 62' ' ' CYS . 74.0 ttt180 -60.41 -52.47 65.1 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 120.315 -0.554 . . . . 0.0 110.853 -179.571 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 4.3 p -69.0 -42.8 82.26 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.571 0 CA-C-O 120.71 0.29 . . . . 0.0 110.567 179.48 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . 0.435 ' O ' ' CB ' ' A' ' 64' ' ' GLN . . . -65.27 -47.58 78.72 Favored Glycine 0 CA--C 1.525 0.688 0 CA-C-N 116.297 -0.41 . . . . 0.0 112.337 -178.945 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 96.9 m-20 -60.98 -40.76 94.65 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.784 0.292 . . . . 0.0 111.296 -178.552 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' CYS . . . . . 0.442 ' SG ' ' O ' ' A' ' 58' ' ' ARG . 70.7 m -61.72 -59.92 4.45 Favored 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 120.708 -0.397 . . . . 0.0 111.467 -179.299 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 15.4 m-85 -65.72 -42.71 90.75 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.342 -179.805 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . 0.435 ' CB ' ' O ' ' A' ' 60' ' ' GLY . 58.2 tt0 -61.17 -41.31 96.57 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.388 -179.458 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 24.8 t0 -55.46 -56.78 16.19 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.872 0.368 . . . . 0.0 110.906 -179.757 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 50.5 m-85 -64.57 -43.31 94.3 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 120.57 -0.452 . . . . 0.0 110.421 179.664 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 64.7 t80 -52.65 -42.33 64.58 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.596 -179.351 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . 0.423 HD22 ' HG2' ' A' ' 64' ' ' GLN . 19.3 m-20 -62.77 -42.51 99.72 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.421 -179.298 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 25.0 p -71.67 -16.46 62.25 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.495 -179.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -87.35 12.83 11.04 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.769 -179.632 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 152.06 -79.17 0.2 Allowed Glycine 0 CA--C 1.53 0.98 0 C-N-CA 120.384 -0.912 . . . . 0.0 112.322 179.039 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_exo -40.59 100.84 0.03 OUTLIER 'Trans proline' 0 C--N 1.307 -1.642 0 C-N-CA 122.712 2.275 . . . . 0.0 112.06 -178.514 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 80.2 mm-40 -73.47 -42.76 61.51 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.655 -0.702 . . . . 0.0 109.928 179.19 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.575 ' CD ' ' H ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -94.95 -13.39 25.38 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.091 179.779 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.485 ' O ' ' O ' ' A' ' 74' ' ' LYS . 36.4 t 56.22 123.77 0.01 OUTLIER Pre-proline 0 CA--C 1.544 0.715 0 O-C-N 123.143 0.277 . . . . 0.0 111.416 -179.938 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_exo -53.24 128.04 27.56 Favored 'Trans proline' 0 N--CA 1.495 1.616 0 C-N-CA 121.166 1.244 . . . . 0.0 112.251 179.232 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . 0.453 ' O ' ' N ' ' A' ' 80' ' ' PHE . 59.8 t -82.84 -18.42 10.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 115.38 -0.827 . . . . 0.0 110.65 179.211 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 62.7 p -42.98 -24.23 0.06 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.924 0.392 . . . . 0.0 110.433 -179.621 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . 0.436 ' N ' ' O ' ' A' ' 77' ' ' VAL . . . -64.88 -37.88 89.09 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.784 179.642 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . 0.453 ' N ' ' O ' ' A' ' 77' ' ' VAL . 3.7 m-85 -58.94 -33.14 70.25 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.418 -179.744 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 39.0 t -60.3 -42.94 96.59 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.115 179.708 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 -59.69 -49.91 75.92 Favored 'General case' 0 CA--C 1.517 -0.311 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.586 179.722 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' TRP . . . . . 0.471 ' C ' ' CD1' ' A' ' 83' ' ' TRP . 8.3 t-105 -54.51 -40.38 68.51 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.733 -179.826 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 87.6 m-20 -61.98 -44.84 95.9 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 120.461 -0.496 . . . . 0.0 111.153 -179.404 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 29.9 tp -73.29 -55.08 6.9 Favored 'General case' 0 C--O 1.222 -0.377 0 C-N-CA 120.31 -0.556 . . . . 0.0 110.565 179.569 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -55.58 -25.77 18.54 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 C-N-CA 120.591 -0.444 . . . . 0.0 110.406 179.921 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 67.4 tttt -67.4 -50.68 58.49 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.656 179.648 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . 0.413 ' O ' ' OE1' ' A' ' 88' ' ' GLU . 1.1 pp20? -79.76 -20.02 47.3 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.745 -0.661 . . . . 0.0 111.113 -179.077 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.05 -46.3 89.76 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 120.66 -0.416 . . . . 0.0 110.227 -179.446 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 3.8 mt -64.69 -43.05 96.61 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.215 0 C-N-CA 120.184 -0.606 . . . . 0.0 109.85 -179.662 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -54.92 -42.83 72.7 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.974 -178.758 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 58.9 mmtt -48.32 131.13 16.71 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 120.668 -0.413 . . . . 0.0 110.4 -179.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -63.57 -37.43 87.29 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.603 179.854 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 70.5 tt0 -69.92 54.98 0.13 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.347 -179.625 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 35.5 m -70.44 155.51 7.58 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-O 120.946 0.403 . . . . 0.0 110.057 -179.948 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' ASN . . . . . . . . . . . . . 1.3 m-20 -59.28 160.42 12.63 Favored Pre-proline 0 C--N 1.325 -0.476 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.873 -179.289 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -60.02 -10.83 13.46 Favored 'Trans proline' 0 N--CA 1.494 1.503 0 C-N-CA 123.101 2.534 . . . . 0.0 111.941 179.391 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 5.0 pt20 -44.36 -26.98 0.38 Allowed 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.869 -179.412 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 85.9 t -65.1 -50.65 73.25 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 C-N-CA 120.434 -0.507 . . . . 0.0 110.578 -179.628 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 96.7 mtp -80.79 -39.11 27.3 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.819 179.645 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -64.93 -31.79 73.19 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.087 -179.527 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -62.95 -14.62 49.47 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.736 0.303 . . . . 0.0 110.464 -179.853 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 75.8 t -60.97 -21.83 25.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.448 179.72 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -57.71 -38.28 74.99 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.483 -179.892 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 58.3 tt0 -91.29 96.35 10.5 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.405 179.775 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 3.6 t -147.26 158.19 43.87 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.635 179.973 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 89.9 mt-10 -89.0 149.17 23.38 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.459 -179.822 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . 0.558 ' C ' ' H ' ' A' ' 110' ' ' LEU . 97.0 mt-10 -73.84 139.16 44.89 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 120.378 -0.529 . . . . 0.0 109.655 179.092 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 26.7 pt -54.86 -5.21 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.127 179.452 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.558 ' H ' ' C ' ' A' ' 108' ' ' GLU . 3.4 pp -170.35 120.05 0.59 Allowed 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 116.251 -0.431 . . . . 0.0 109.99 179.789 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 25.5 pttm -139.4 151.12 46.03 Favored 'General case' 0 C--O 1.231 0.124 0 CA-C-O 120.67 0.271 . . . . 0.0 110.377 -179.512 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 88.1 p -60.42 -22.28 63.21 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.667 -179.358 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 39.7 t30 -64.63 -40.81 96.11 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.682 179.73 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 23.3 t -117.64 -68.0 0.95 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.917 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 9.3 mt-30 41.31 86.48 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.034 0.445 . . . . 0.0 110.744 -179.73 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 72.0 p -74.28 -22.86 59.11 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.009 -0.542 . . . . 0.0 110.353 179.869 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 97.7 m-20 -83.44 -66.8 0.85 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.6 179.855 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 43.5 mt -63.44 -41.66 98.67 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.855 -179.89 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 94.0 mt-10 52.79 -170.78 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.701 -179.695 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 77.1 m-70 -66.52 -39.38 88.59 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.742 179.96 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 99.2 m-70 -112.71 149.05 33.46 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.601 -179.908 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 96.2 m-70 -63.93 -39.8 94.99 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.577 -179.771 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 75.6 m80 -113.41 149.06 34.67 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.549 -179.89 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 124' ' ' HIS . . . . . . . . . . . . . 85.2 m-70 -62.63 -43.64 98.3 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.782 -179.948 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 97.6 m-70 . . . . . 0 C--O 1.22 -0.489 0 CA-C-O 118.029 -0.986 . . . . 0.0 110.522 -179.896 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 201' ' ' MYR . . . . . 0.516 ' H82' ' HD1' ' A' ' 8' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.704 0 N-CA-C 110.958 -0.857 . . . . 0.0 110.958 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 77.5 mt-30 -58.27 -31.31 67.33 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.898 0.38 . . . . 0.0 110.624 -179.921 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . 0.431 ' OE1' ' OE1' ' A' ' 7' ' ' GLN . 78.0 mm-40 -51.91 -23.48 5.0 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.284 -179.945 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 37.2 tp -42.84 -27.2 0.17 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.439 -179.406 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 37.6 t -59.68 -41.64 91.14 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.15 179.661 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . 0.431 ' OE1' ' OE1' ' A' ' 4' ' ' GLU . 89.1 mt-30 -61.96 -30.19 70.75 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.569 179.827 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 84.5 t60 -63.46 -44.83 93.33 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.822 0.344 . . . . 0.0 110.359 179.932 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 80.5 tt0 -59.66 -50.13 75.04 Favored 'General case' 0 C--O 1.243 0.721 0 CA-C-O 121.361 0.6 . . . . 0.0 110.352 179.7 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.43 ' O ' ' CB ' ' A' ' 14' ' ' GLN . 86.2 mtt180 -62.44 -33.18 74.3 Favored 'General case' 0 C--O 1.211 -0.956 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 179.55 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 31.7 t80 -58.89 -36.4 74.59 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 110.175 -0.305 . . . . 0.0 110.175 -179.588 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 3.6 t -64.36 -49.66 79.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 C-N-CA 119.987 -0.685 . . . . 0.0 111.488 179.997 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -81.08 -30.74 34.62 Favored 'General case' 0 C--N 1.324 -0.523 0 C-N-CA 120.582 -0.447 . . . . 0.0 111.826 -179.357 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . 0.43 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 60.5 tp60 -74.23 -52.17 13.18 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.916 -0.583 . . . . 0.0 110.896 -178.982 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.91 -44.21 96.7 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 120.407 -0.517 . . . . 0.0 109.809 -179.557 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 66.0 mttm -59.53 -34.4 72.6 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.848 0.356 . . . . 0.0 110.198 179.091 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 35.8 mm-40 -66.58 -42.01 87.65 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.489 0.661 . . . . 0.0 110.022 179.038 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.39 -28.66 69.4 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.912 -0.585 . . . . 0.0 109.732 179.277 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.9 mt -74.19 -33.85 63.56 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.933 0.397 . . . . 0.0 110.652 178.651 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 67.8 mttm -54.56 -37.33 65.34 Favored 'General case' 0 C--N 1.323 -0.548 0 C-N-CA 120.188 -0.605 . . . . 0.0 109.883 -179.775 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 1.2 t -60.57 -28.1 68.2 Favored 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 120.397 -0.521 . . . . 0.0 110.863 179.37 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 7.7 mmm180 -80.2 12.79 2.65 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-O 120.98 0.419 . . . . 0.0 110.584 -179.567 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 81.04 14.0 80.1 Favored Glycine 0 CA--C 1.522 0.514 0 N-CA-C 110.491 -1.044 . . . . 0.0 110.491 -179.8 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 37.9 t -86.83 165.34 2.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 C-N-CA 120.981 -0.287 . . . . 0.0 110.446 -179.706 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -139.12 129.61 25.76 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 120.916 -0.314 . . . . 0.0 110.235 179.429 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 13.7 m -126.74 130.89 71.57 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.239 0 N-CA-C 109.943 -0.391 . . . . 0.0 109.943 179.584 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.55 ' N ' ' OD2' ' A' ' 30' ' ' ASP . 10.9 ttmt -109.16 161.78 14.89 Favored 'General case' 0 C--O 1.221 -0.401 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 179.674 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . 0.435 ' H ' ' HG2' ' A' ' 27' ' ' LYS . 98.4 m-85 -41.89 -33.28 0.51 Allowed 'General case' 0 C--O 1.236 0.392 0 CA-C-O 121.101 0.477 . . . . 0.0 110.796 179.646 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -55.7 -22.45 23.52 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.525 179.702 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.55 ' OD2' ' N ' ' A' ' 27' ' ' LYS . 3.2 m-20 -58.55 -49.48 77.27 Favored 'General case' 0 CA--C 1.516 -0.364 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.281 -179.396 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.5 ' O ' ' CB ' ' A' ' 35' ' ' PHE . 4.9 mp -67.21 -41.27 86.05 Favored 'General case' 0 C--O 1.215 -0.75 0 CA-C-O 120.985 0.421 . . . . 0.0 110.242 179.273 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.448 ' O ' ' OD1' ' A' ' 36' ' ' ASP . 40.8 mt -59.04 -44.97 91.84 Favored 'General case' 0 C--N 1.315 -0.927 0 C-N-CA 119.692 -0.803 . . . . 0.0 111.246 -178.238 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.527 ' O ' ' CD1' ' A' ' 37' ' ' PHE . 88.6 tttt -84.53 -37.79 20.82 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.939 -178.658 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . 0.413 ' CB ' ' O ' ' A' ' 30' ' ' ASP . 62.4 t80 -78.07 -51.03 10.93 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.393 -178.681 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.5 ' CB ' ' O ' ' A' ' 31' ' ' LEU . 12.9 t80 -60.07 -46.55 89.19 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.389 -179.327 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . 0.468 ' OD1' ' O ' ' A' ' 33' ' ' LYS . 3.7 p-10 -70.28 -31.37 68.7 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 120.216 -0.594 . . . . 0.0 111.198 -179.438 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.527 ' CD1' ' O ' ' A' ' 33' ' ' LYS . 1.4 m-85 -60.68 -55.62 31.07 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-O 120.73 0.3 . . . . 0.0 111.673 -179.037 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.521 ' O ' ' N ' ' A' ' 42' ' ' CYS . 5.3 m -69.7 -37.65 74.38 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 C-N-CA 120.556 -0.458 . . . . 0.0 110.717 -179.565 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 65.5 tttm -56.92 -27.61 61.07 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.57 -179.822 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 93.4 m-20 -50.6 -62.98 1.27 Allowed 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 120.685 -0.406 . . . . 0.0 110.63 -179.546 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' THR . . . . . 0.504 ' O ' ' SG ' ' A' ' 42' ' ' CYS . 24.9 p -115.05 8.99 15.87 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.293 -179.943 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . 0.521 ' N ' ' O ' ' A' ' 38' ' ' VAL . 7.4 p 38.42 59.14 5.24 Favored Pre-proline 0 N--CA 1.465 0.279 0 CA-C-O 120.883 0.373 . . . . 0.0 110.679 -179.529 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . 0.528 ' C ' ' H ' ' A' ' 45' ' ' PHE . 57.5 Cg_endo -74.21 -28.1 10.99 Favored 'Trans proline' 0 C--N 1.31 -1.499 0 C-N-CA 122.79 2.327 . . . . 0.0 112.445 -179.619 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . 0.563 ' CZ2' H141 ' A' ' 201' ' ' MYR . 0.6 OUTLIER -62.28 1.37 0.33 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.603 -179.469 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.544 ' O ' ' N ' ' A' ' 47' ' ' GLN . 60.8 m-85 50.44 55.61 16.81 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.44 -179.277 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.425 ' CD ' ' N ' ' A' ' 45' ' ' PHE . 70.1 Cg_exo -42.14 -14.82 0.05 OUTLIER 'Trans proline' 0 C--N 1.307 -1.627 0 C-N-CA 122.849 2.366 . . . . 0.0 112.218 179.644 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.684 ' O ' ' H32' ' A' ' 201' ' ' MYR . 87.1 mt-30 -65.98 -53.07 43.64 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.248 -179.27 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.65 ' O ' ' H52' ' A' ' 201' ' ' MYR . 65.8 tt0 -88.87 -30.21 19.07 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.373 178.599 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 73.78 50.64 10.74 Favored Glycine 0 CA--C 1.526 0.764 0 N-CA-C 110.383 -1.087 . . . . 0.0 110.383 -179.239 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' THR . . . . . 0.493 ' OG1' ' NE2' ' A' ' 98' ' ' GLN . 15.0 t -107.68 160.71 15.49 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.842 0.354 . . . . 0.0 110.744 -179.468 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.448 ' N ' ' HG1' ' A' ' 50' ' ' THR . 1.5 mt -89.71 137.35 21.59 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-O 121.143 0.497 . . . . 0.0 110.593 179.452 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 57.9 m-20 -108.18 120.77 43.29 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.435 -0.802 . . . . 0.0 111.328 179.227 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 30.2 mm -95.03 -57.01 4.68 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.255 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.17 179.166 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -77.09 -49.03 16.21 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-O 121.076 0.465 . . . . 0.0 111.215 -179.659 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 84.5 mtt85 -60.31 -32.47 71.25 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.01 -179.628 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 13.8 t-105 -61.87 -40.3 94.91 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.735 179.48 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 80.2 mtp85 -62.82 -38.55 91.16 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.531 -179.555 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . 0.494 ' O ' ' SG ' ' A' ' 62' ' ' CYS . 83.7 mtt85 -60.84 -52.65 64.16 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 120.593 -0.443 . . . . 0.0 111.385 -179.546 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 3.2 p -66.55 -42.12 89.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.6 179.739 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . 0.402 ' O ' ' CB ' ' A' ' 64' ' ' GLN . . . -61.7 -45.37 96.4 Favored Glycine 0 CA--C 1.522 0.521 0 N-CA-C 111.229 -0.748 . . . . 0.0 111.229 -179.399 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 71.3 m-20 -64.67 -35.15 80.1 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 121.118 -0.233 . . . . 0.0 110.669 -179.444 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' CYS . . . . . 0.494 ' SG ' ' O ' ' A' ' 58' ' ' ARG . 72.4 m -64.21 -59.73 4.06 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.809 0.338 . . . . 0.0 111.144 -179.492 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 50.7 m-85 -65.4 -39.7 92.52 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.284 -0.417 . . . . 0.0 110.86 179.642 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . 0.402 ' CB ' ' O ' ' A' ' 60' ' ' GLY . 58.5 tt0 -63.91 -36.02 82.57 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.749 -179.65 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 31.4 t0 -60.75 -52.77 63.7 Favored 'General case' 0 C--N 1.323 -0.549 0 C-N-CA 120.709 -0.396 . . . . 0.0 110.497 179.957 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 69.8 m-85 -70.5 -42.73 70.94 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.911 179.69 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 65.0 t80 -57.99 -43.39 86.54 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.226 -179.457 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . 0.455 ' OD1' ' C ' ' A' ' 68' ' ' ASN . 21.2 t-20 -60.58 -44.32 96.35 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.28 -179.917 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 82.2 p -74.48 -18.36 60.63 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 120.555 -0.458 . . . . 0.0 110.111 -179.934 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 26.7 m-85 -109.04 16.5 22.53 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.261 179.736 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -167.7 -105.61 0.18 Allowed Glycine 0 CA--C 1.533 1.156 0 C-N-CA 120.579 -0.82 . . . . 0.0 111.126 -179.99 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . 0.444 ' O ' ' OD1' ' A' ' 68' ' ' ASN . 67.7 Cg_endo -74.13 147.61 38.27 Favored 'Trans proline' 0 N--CA 1.494 1.558 0 C-N-CA 121.893 1.729 . . . . 0.0 113.093 -179.592 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 98.1 mt-10 -85.64 -47.49 9.77 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.286 179.541 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.613 ' CD ' ' H ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -95.84 -17.34 21.21 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.512 -178.821 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.433 ' O ' ' O ' ' A' ' 74' ' ' LYS . 26.7 t 59.2 131.87 0.02 OUTLIER Pre-proline 0 C--N 1.324 -0.505 0 CA-C-N 115.589 -0.732 . . . . 0.0 111.214 -179.186 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 49.4 Cg_exo -52.43 127.88 25.72 Favored 'Trans proline' 0 N--CA 1.494 1.536 0 C-N-CA 121.629 1.552 . . . . 0.0 111.358 179.045 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 46.2 t -82.62 -8.5 11.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.898 179.988 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 73.7 p -48.22 -20.51 0.38 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.361 -179.707 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -60.45 -24.62 65.37 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.499 179.5 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 47.8 t80 -60.81 -39.25 88.26 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.436 -179.987 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 77.4 p -58.46 -40.52 82.88 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.529 -179.958 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 23.5 m-85 -60.62 -52.3 65.75 Favored 'General case' 0 C--O 1.221 -0.412 0 C-N-CA 120.674 -0.41 . . . . 0.0 110.812 179.736 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' TRP . . . . . 0.405 ' O ' ' CB ' ' A' ' 87' ' ' LYS . 77.2 t90 -54.14 -39.67 66.69 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.431 -0.349 . . . . 0.0 110.638 -179.807 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 67.7 m-20 -63.28 -47.12 83.68 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.768 -0.373 . . . . 0.0 111.197 -179.813 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 32.7 tp -70.67 -54.39 12.07 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 120.21 -0.596 . . . . 0.0 110.705 179.399 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -56.53 -26.62 23.41 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.162 -179.81 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . 0.405 ' CB ' ' O ' ' A' ' 83' ' ' TRP . 53.8 tttt -66.61 -49.18 67.14 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.841 -179.473 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.2 pp20? -79.6 -20.44 46.88 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.54 -179.788 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.36 -45.82 91.42 Favored 'General case' 0 N--CA 1.446 -0.64 0 C-N-CA 120.077 -0.649 . . . . 0.0 110.574 -179.224 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 3.5 mt -64.91 -43.57 96.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 C-N-CA 120.332 -0.547 . . . . 0.0 109.78 -179.936 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 91.1 m-20 -44.06 -36.86 2.72 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.844 -178.455 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -50.49 129.28 21.85 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 120.475 -0.49 . . . . 0.0 110.427 179.803 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -62.34 -40.72 97.29 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.652 -179.853 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . 0.468 ' O ' ' C ' ' A' ' 95' ' ' VAL . 97.7 mt-10 -71.33 -3.96 23.48 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.823 -179.607 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.468 ' C ' ' O ' ' A' ' 94' ' ' GLU . 2.4 m 29.58 -109.88 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.36 0 O-C-N 123.711 0.632 . . . . 0.0 110.403 -179.791 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' ASN . . . . . 0.498 ' N ' ' OD1' ' A' ' 96' ' ' ASN . 0.0 OUTLIER -154.17 169.93 9.24 Favored Pre-proline 0 C--N 1.325 -0.461 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.482 178.962 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -48.56 -13.14 0.23 Allowed 'Trans proline' 0 N--CA 1.494 1.542 0 C-N-CA 122.705 2.27 . . . . 0.0 112.296 179.118 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . 0.493 ' NE2' ' OG1' ' A' ' 50' ' ' THR . 3.5 pt20 -53.17 -20.85 4.31 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.704 -179.908 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 90.4 t -61.17 -49.44 84.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.812 -178.92 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 78.3 mtm -72.59 -42.37 64.63 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.953 0.406 . . . . 0.0 111.099 179.6 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . 0.459 ' HB3' ' H31' ' A' ' 201' ' ' MYR . . . -60.97 -26.06 67.29 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.627 -179.248 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -57.13 -15.55 5.76 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.481 179.817 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 72.0 t -64.76 -21.33 29.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.304 179.647 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -57.04 -40.75 77.35 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.715 -179.857 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . 0.524 ' NE2' ' OE1' ' A' ' 47' ' ' GLN . 89.9 mt-30 -100.57 70.39 1.45 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.335 179.772 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 87.1 m -61.25 -45.06 96.07 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.135 -179.627 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 90.3 mt-10 49.85 -161.01 0.06 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.17 -179.845 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . 0.555 ' N ' ' OE1' ' A' ' 108' ' ' GLU . 56.3 mp0 -112.21 118.82 36.38 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 179.613 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . 0.409 HD11 HG21 ' A' ' 109' ' ' ILE . 41.5 pt -48.82 -14.13 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.339 -179.853 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.479 ' H ' ' C ' ' A' ' 108' ' ' GLU . 30.9 mt -64.91 -41.23 95.75 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.395 179.467 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . 0.401 ' HZ1' ' NE2' ' A' ' 121' ' ' HIS . 88.6 tttt -68.36 -35.82 78.29 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.399 179.818 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 44.7 t -60.81 -47.63 85.49 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.668 -179.508 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 17.0 m120 -65.57 -45.0 84.99 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.548 179.769 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 114' ' ' SER . . . . . 0.601 ' HG ' ' H ' ' A' ' 116' ' ' THR . 40.3 t -158.2 139.02 12.99 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.344 179.809 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 87.9 mt-30 -85.42 -4.63 59.22 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.384 179.843 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 116' ' ' THR . . . . . 0.601 ' H ' ' HG ' ' A' ' 114' ' ' SER . 15.0 m -62.5 -46.68 87.34 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.706 -179.631 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -63.33 -36.98 85.5 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.962 0.41 . . . . 0.0 110.47 179.977 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 38.3 tp -142.84 90.87 2.24 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.549 179.785 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 93.0 mt-10 -66.32 -40.15 89.73 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.761 0.315 . . . . 0.0 110.625 179.79 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 97.2 m-70 -135.88 143.74 45.19 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.561 -179.698 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 121' ' ' HIS . . . . . 0.401 ' NE2' ' HZ1' ' A' ' 111' ' ' LYS . 98.9 m-70 -69.42 138.98 54.0 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.607 -179.909 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 73.3 t60 -60.74 -40.78 93.65 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.58 -179.872 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 67.8 m80 -99.32 120.59 39.82 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.501 -179.847 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 124' ' ' HIS . . . . . . . . . . . . . 64.5 t-80 -61.49 -46.13 91.31 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.524 -179.933 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 84.1 t60 . . . . . 0 C--O 1.219 -0.507 0 CA-C-O 117.988 -1.006 . . . . 0.0 110.61 -179.964 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 201' ' ' MYR . . . . . 0.684 ' H32' ' O ' ' A' ' 47' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.725 0 N-CA-C 111.096 -0.802 . . . . 0.0 111.096 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 99.4 mm-40 -62.86 -30.18 71.31 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.899 0.381 . . . . 0.0 110.483 -179.871 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . 0.427 ' O ' ' N ' ' A' ' 7' ' ' GLN . 80.0 mm-40 -56.01 -22.15 25.38 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.542 179.593 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 36.6 tp -41.38 -28.94 0.13 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.031 0.443 . . . . 0.0 110.266 -179.403 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 54.1 m -58.25 -41.27 83.86 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.963 0.411 . . . . 0.0 110.173 179.675 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . 0.427 ' N ' ' O ' ' A' ' 4' ' ' GLU . 88.1 mt-30 -64.26 -31.83 73.18 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.835 179.97 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 86.4 t60 -60.18 -45.67 92.31 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-O 120.913 0.387 . . . . 0.0 110.285 179.95 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 99.3 mt-10 -60.48 -43.96 96.42 Favored 'General case' 0 C--O 1.244 0.772 0 CA-C-O 121.243 0.544 . . . . 0.0 110.126 179.769 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.436 ' O ' ' CB ' ' A' ' 14' ' ' GLN . 92.2 mtt-85 -63.18 -34.09 76.88 Favored 'General case' 0 C--O 1.211 -0.969 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 179.578 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.701 ' CE2' H121 ' A' ' 201' ' ' MYR . 37.4 t80 -59.11 -38.68 80.15 Favored 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 120.765 -0.374 . . . . 0.0 110.369 -179.636 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 2.2 t -60.55 -51.81 68.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 C-N-CA 119.624 -0.83 . . . . 0.0 110.983 -179.675 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 82.8 tt0 -79.56 -38.31 34.43 Favored 'General case' 0 C--N 1.322 -0.609 0 C-N-CA 120.14 -0.624 . . . . 0.0 112.053 -178.968 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . 0.436 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 69.0 tp60 -64.32 -50.5 67.57 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.847 -179.0 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.98 -46.39 87.94 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.487 -0.485 . . . . 0.0 110.073 -179.648 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 61.0 mttp -58.14 -31.6 67.36 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 120.746 -0.381 . . . . 0.0 110.203 179.482 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 75.5 mt-30 -75.73 -35.19 60.3 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.723 178.889 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -57.14 -35.99 70.16 Favored 'General case' 0 CA--C 1.519 -0.224 0 CA-C-N 115.727 -0.67 . . . . 0.0 110.01 -179.992 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.436 ' O ' ' N ' ' A' ' 22' ' ' ARG . 3.0 mt -84.97 -32.92 22.76 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.131 0.491 . . . . 0.0 110.587 179.172 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -46.02 -42.04 12.76 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.472 -179.121 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' THR . . . . . 0.533 ' C ' ' H ' ' A' ' 23' ' ' GLY . 0.1 OUTLIER -74.74 -23.5 58.57 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.693 -179.972 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.436 ' N ' ' O ' ' A' ' 19' ' ' LEU . 27.0 mmt180 -73.44 19.91 0.1 Allowed 'General case' 0 N--CA 1.463 0.224 0 CA-C-O 120.78 0.324 . . . . 0.0 110.4 179.987 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . 0.533 ' H ' ' C ' ' A' ' 21' ' ' THR . . . 87.75 16.84 59.25 Favored Glycine 0 CA--C 1.524 0.633 0 N-CA-C 110.941 -0.863 . . . . 0.0 110.941 -179.976 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 21.7 t -106.4 167.97 3.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 120.635 0.255 . . . . 0.0 110.533 -179.873 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -135.37 128.84 32.4 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 109.881 -0.414 . . . . 0.0 109.881 179.345 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 26.5 m -125.48 118.46 52.49 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.16 0 N-CA-C 109.993 -0.373 . . . . 0.0 109.993 -179.925 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.47 ' HD3' ' H ' ' A' ' 29' ' ' ALA . 13.7 tmtt? -110.03 160.07 16.75 Favored 'General case' 0 C--O 1.222 -0.392 0 N-CA-C 109.716 -0.476 . . . . 0.0 109.716 179.614 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 88.7 m-85 -41.94 -28.99 0.19 Allowed 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.028 0.442 . . . . 0.0 110.968 179.841 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.47 ' H ' ' HD3' ' A' ' 27' ' ' LYS . . . -60.27 -24.62 65.07 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.828 -179.849 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.455 ' O ' ' CB ' ' A' ' 34' ' ' PHE . 13.0 m-20 -62.48 -44.73 95.68 Favored 'General case' 0 C--O 1.216 -0.658 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.564 -179.673 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.475 ' O ' ' CB ' ' A' ' 35' ' ' PHE . 5.7 mp -65.48 -40.89 93.66 Favored 'General case' 0 C--N 1.322 -0.619 0 C-N-CA 120.576 -0.449 . . . . 0.0 110.101 179.449 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 32.1 mt -59.84 -45.23 93.08 Favored 'General case' 0 C--N 1.317 -0.833 0 C-N-CA 119.433 -0.907 . . . . 0.0 111.122 -178.698 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.424 ' O ' ' CB ' ' A' ' 37' ' ' PHE . 48.7 tttp -85.57 -47.37 9.93 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 112.084 0.402 . . . . 0.0 112.084 -179.016 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . 0.455 ' CB ' ' O ' ' A' ' 30' ' ' ASP . 54.4 t80 -63.42 -50.41 69.91 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.976 -178.833 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.475 ' CB ' ' O ' ' A' ' 31' ' ' LEU . 9.3 t80 -62.69 -45.1 94.34 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.298 -179.673 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 56.7 t0 -73.1 -37.17 66.82 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 120.558 -0.457 . . . . 0.0 111.332 -179.508 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.424 ' CB ' ' O ' ' A' ' 33' ' ' LYS . 5.6 t80 -61.43 -47.87 83.79 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.332 -178.376 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.5 ' O ' ' N ' ' A' ' 42' ' ' CYS . 19.6 m -72.26 -35.89 54.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 115.626 -0.716 . . . . 0.0 110.341 -179.869 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 65.1 tttm -58.57 -28.98 66.04 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.475 179.78 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 62.9 t0 -45.05 -59.65 2.49 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 120.58 -0.448 . . . . 0.0 110.606 -179.857 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 11.4 p -113.86 -5.28 13.24 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.744 0.307 . . . . 0.0 110.885 179.945 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . 0.529 ' N ' ' HD3' ' A' ' 43' ' ' PRO . 0.0 OUTLIER 48.65 54.36 15.91 Favored Pre-proline 0 CA--C 1.538 0.493 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.572 -178.738 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . 0.529 ' HD3' ' N ' ' A' ' 42' ' ' CYS . 27.0 Cg_exo -62.16 -38.97 51.95 Favored 'Trans proline' 0 N--CA 1.496 1.649 0 C-N-CA 122.051 1.834 . . . . 0.0 113.034 -179.075 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . 0.805 ' HE1' ' H ' ' A' ' 52' ' ' ASP . 0.0 OUTLIER -71.7 0.75 8.06 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.025 -178.911 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.566 ' O ' ' N ' ' A' ' 47' ' ' GLN . 33.9 m-85 53.37 48.51 5.13 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.664 -179.086 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.535 ' CD ' ' N ' ' A' ' 45' ' ' PHE . 44.7 Cg_exo -39.02 -17.83 0.04 OUTLIER 'Trans proline' 0 C--N 1.312 -1.394 0 C-N-CA 122.845 2.363 . . . . 0.0 112.348 179.11 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.566 ' N ' ' O ' ' A' ' 45' ' ' PHE . 83.6 mt-30 -58.25 -52.84 63.88 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.428 -179.642 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.528 ' O ' ' H52' ' A' ' 201' ' ' MYR . 47.1 tp10 -88.3 -34.22 17.74 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.821 -0.352 . . . . 0.0 110.236 178.975 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 87.29 71.7 1.29 Allowed Glycine 0 CA--C 1.526 0.723 0 N-CA-C 110.171 -1.172 . . . . 0.0 110.171 -178.514 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 12.4 t -129.76 171.78 12.32 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 110.4 -0.222 . . . . 0.0 110.4 -179.377 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.1 mt -102.19 142.59 16.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 120.982 0.42 . . . . 0.0 110.491 179.29 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . 0.805 ' H ' ' HE1' ' A' ' 44' ' ' TRP . 73.6 m-20 -122.41 121.66 37.17 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.46 -0.791 . . . . 0.0 111.465 179.343 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 23.5 mm -95.58 -56.19 5.43 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.352 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.24 178.964 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -74.15 -50.65 18.41 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-O 120.94 0.4 . . . . 0.0 111.438 -179.531 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 91.4 mtt-85 -61.04 -35.62 77.4 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.533 -179.891 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' TRP . . . . . 0.637 ' CE3' ' CH2' ' A' ' 44' ' ' TRP . 24.8 t-105 -59.38 -36.25 75.42 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.191 0.52 . . . . 0.0 110.452 179.102 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 61.4 ttp180 -66.41 -37.95 86.37 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.162 179.852 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 87.5 mtt180 -60.48 -51.85 67.7 Favored 'General case' 0 N--CA 1.466 0.375 0 C-N-CA 120.956 -0.298 . . . . 0.0 111.75 -178.866 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 2.9 p -62.46 -42.49 95.9 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.459 0 CA-C-O 120.95 0.405 . . . . 0.0 110.153 -179.952 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -68.95 -39.4 85.15 Favored Glycine 0 CA--C 1.527 0.836 0 N-CA-C 111.452 -0.659 . . . . 0.0 111.452 179.865 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 12.7 m-20 -64.97 -42.1 94.85 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.734 0.302 . . . . 0.0 111.075 -179.191 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 5.4 m -60.04 -53.29 59.56 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.619 -179.263 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 13.8 m-85 -67.61 -37.18 82.15 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.785 179.586 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 53.3 tt0 -62.45 -41.09 98.5 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.717 -179.715 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 46.2 t0 -60.74 -52.51 64.79 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.756 -179.9 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' TYR . . . . . 0.478 ' O ' ' OG1' ' A' ' 69' ' ' THR . 25.5 m-85 -66.17 -30.58 71.08 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.362 179.482 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 76.8 t80 -68.04 -41.77 81.57 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.541 -179.859 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . 0.427 ' O ' ' N ' ' A' ' 71' ' ' GLY . 99.0 m-20 -63.56 -40.24 96.48 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.129 -179.44 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.478 ' OG1' ' O ' ' A' ' 66' ' ' TYR . 74.5 p -49.8 -17.76 0.4 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.515 -179.73 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . 0.401 ' N ' ' C ' ' A' ' 68' ' ' ASN . 59.5 m-85 -93.31 15.72 14.94 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.82 -179.953 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . 0.427 ' N ' ' O ' ' A' ' 68' ' ' ASN . . . 40.58 58.02 2.64 Favored Glycine 0 CA--C 1.53 0.999 0 N-CA-C 110.905 -0.878 . . . . 0.0 110.905 -179.295 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -76.48 132.54 13.6 Favored 'Trans proline' 0 N--CA 1.495 1.606 0 C-N-CA 122.89 2.393 . . . . 0.0 112.13 179.715 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 83.5 tt0 -90.88 -19.94 22.8 Favored 'General case' 0 CA--C 1.507 -0.701 0 CA-C-O 121.408 0.623 . . . . 0.0 110.673 179.813 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.505 ' O ' ' C ' ' A' ' 75' ' ' VAL . 53.9 mmtt -73.01 -47.21 47.14 Favored 'General case' 0 C--N 1.31 -1.134 0 CA-C-N 115.237 -0.892 . . . . 0.0 112.056 -178.134 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.505 ' C ' ' O ' ' A' ' 74' ' ' LYS . 53.5 t 25.48 80.56 0.21 Allowed Pre-proline 0 CA--C 1.528 0.099 0 O-C-N 123.765 0.665 . . . . 0.0 111.476 179.874 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_exo -55.76 125.37 18.89 Favored 'Trans proline' 0 C--N 1.307 -1.654 0 C-N-CA 121.663 1.575 . . . . 0.0 111.703 -178.842 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 96.6 t -83.88 -21.09 8.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.788 179.811 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 40.2 p -43.41 -27.57 0.28 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.732 -179.079 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -51.95 -43.28 63.44 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.041 179.777 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . 0.528 ' CE2' ' OD1' ' A' ' 84' ' ' ASN . 60.2 t80 -63.05 -42.39 99.71 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.839 179.388 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 39.3 m -58.22 -44.63 88.28 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.477 -0.329 . . . . 0.0 110.871 -179.103 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 14.4 m-85 -60.67 -48.5 81.5 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 120.79 -0.364 . . . . 0.0 110.702 179.751 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' TRP . . . . . 0.407 ' O ' ' CB ' ' A' ' 87' ' ' LYS . 68.5 t90 -56.09 -39.81 72.68 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.647 179.936 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . 0.528 ' OD1' ' CE2' ' A' ' 80' ' ' PHE . 13.3 m120 -61.96 -45.2 94.69 Favored 'General case' 0 C--N 1.326 -0.429 0 C-N-CA 120.658 -0.417 . . . . 0.0 110.966 -179.496 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 50.8 tp -72.47 -56.88 4.7 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 120.466 -0.494 . . . . 0.0 110.449 179.717 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -54.11 -27.25 16.2 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 C-N-CA 120.671 -0.412 . . . . 0.0 110.123 -179.834 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . 0.407 ' CB ' ' O ' ' A' ' 83' ' ' TRP . 65.0 tttt -65.61 -50.89 63.4 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.218 -179.734 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . 0.466 ' O ' ' OE1' ' A' ' 88' ' ' GLU . 1.0 OUTLIER -79.66 -19.94 47.88 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.72 -179.371 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.51 -46.42 90.04 Favored 'General case' 0 N--CA 1.444 -0.736 0 C-N-CA 120.128 -0.629 . . . . 0.0 110.043 -179.148 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 3.5 mt -64.05 -42.62 96.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 C-N-CA 120.229 -0.588 . . . . 0.0 109.867 -179.908 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 71.3 m-20 -53.24 -44.81 68.41 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.676 -178.028 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . 0.518 ' C ' ' H ' ' A' ' 94' ' ' GLU . 97.5 mttt -71.39 142.76 50.32 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.797 0.332 . . . . 0.0 110.762 179.354 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -71.99 14.95 0.18 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.507 179.841 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . 0.518 ' H ' ' C ' ' A' ' 92' ' ' LYS . 40.4 tp10 -61.99 -35.21 77.85 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.296 -179.895 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 34.9 m -70.89 137.58 23.54 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.45 179.924 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' ASN . . . . . 0.525 ' O ' ' N ' ' A' ' 98' ' ' GLN . 0.9 OUTLIER -82.76 166.2 37.33 Favored Pre-proline 0 C--N 1.325 -0.471 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.743 -179.813 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 67.7 Cg_exo -44.94 -11.36 0.04 OUTLIER 'Trans proline' 0 N--CA 1.492 1.384 0 C-N-CA 122.434 2.089 . . . . 0.0 112.111 178.963 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . 0.628 ' NE2' ' H71' ' A' ' 201' ' ' MYR . 6.1 pt20 -46.37 -28.19 1.27 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.717 -179.597 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 75.7 t -64.62 -48.94 82.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-O 120.855 0.36 . . . . 0.0 110.921 -179.954 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 94.8 mtp -69.39 -39.64 77.85 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.925 -179.83 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -61.52 -28.89 69.64 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.722 -179.319 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -59.52 -16.68 26.31 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.96 0.409 . . . . 0.0 110.225 179.777 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.44 ' O ' ' O ' ' A' ' 106' ' ' THR . 88.2 t -71.13 -2.95 3.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.562 179.439 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -59.66 -34.04 72.32 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.771 -179.932 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . 0.537 ' NE2' ' OE1' ' A' ' 47' ' ' GLN . 88.2 mt-30 -62.28 -43.18 99.41 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.819 -179.65 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' THR . . . . . 0.44 ' O ' ' O ' ' A' ' 103' ' ' VAL . 87.9 m -109.79 125.35 52.62 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.399 -179.965 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . 0.477 ' H ' ' CD ' ' A' ' 107' ' ' GLU . 30.3 mp0 -68.33 161.58 27.09 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.53 -179.406 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . 0.596 ' C ' ' H ' ' A' ' 110' ' ' LEU . 94.7 mt-10 -92.25 140.37 29.68 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.201 -0.454 . . . . 0.0 109.923 179.705 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 33.0 pt -60.74 3.75 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.379 179.848 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.596 ' H ' ' C ' ' A' ' 108' ' ' GLU . 85.3 mt -109.54 32.33 5.1 Favored 'General case' 0 N--CA 1.461 0.082 0 CA-C-O 121.023 0.439 . . . . 0.0 110.37 -179.899 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . 0.4 ' N ' ' OE1' ' A' ' 115' ' ' GLN . 43.3 pttt -82.2 -115.41 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.484 179.962 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 112' ' ' SER . . . . . 0.499 ' OG ' ' N ' ' A' ' 113' ' ' ASN . 29.1 p -129.59 -132.88 0.21 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.259 179.584 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 113' ' ' ASN . . . . . 0.499 ' N ' ' OG ' ' A' ' 112' ' ' SER . 99.2 m-20 56.41 34.59 24.49 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.597 -179.802 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER 76.26 94.12 0.07 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.141 0.496 . . . . 0.0 110.623 179.962 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 115' ' ' GLN . . . . . 0.4 ' OE1' ' N ' ' A' ' 111' ' ' LYS . 82.7 mt-30 -144.12 164.52 30.42 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.819 -179.967 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 8.2 m -60.8 -45.34 94.77 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.916 -0.583 . . . . 0.0 110.463 -179.494 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 93.0 m-20 -73.79 171.15 13.87 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.542 179.91 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 50.6 mt -55.74 134.3 51.4 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.267 -179.346 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 94.2 mt-10 -66.5 -40.81 89.46 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.729 0.3 . . . . 0.0 110.949 -179.808 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 94.2 m-70 -115.95 146.77 41.81 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.508 -179.98 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 79.0 m80 -104.05 135.76 44.95 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.342 179.859 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 49.8 m-70 -114.78 150.47 35.36 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.636 -179.797 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 84.1 t60 -58.6 -41.83 86.73 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.457 -179.623 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 124' ' ' HIS . . . . . . . . . . . . . 76.9 t60 -119.71 123.23 43.28 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.52 179.852 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 84.0 t60 . . . . . 0 C--O 1.221 -0.444 0 CA-C-O 118.016 -0.992 . . . . 0.0 110.558 179.985 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 201' ' ' MYR . . . . . 0.701 H121 ' CE2' ' A' ' 11' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.732 0 N-CA-C 110.991 -0.844 . . . . 0.0 110.991 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 85.7 mt-30 -60.81 -27.06 67.76 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.859 0.361 . . . . 0.0 110.571 -179.937 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . 0.586 ' OE1' ' H51' ' A' ' 201' ' ' MYR . 97.1 mt-10 -60.6 -23.6 64.83 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.611 179.823 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 37.6 tp -43.53 -32.74 0.97 Allowed 'General case' 0 C--O 1.234 0.271 0 CA-C-O 121.115 0.483 . . . . 0.0 110.362 -179.458 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 78.0 p -57.98 -37.76 74.84 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 120.662 -0.415 . . . . 0.0 110.111 179.952 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . 0.449 ' N ' ' O ' ' A' ' 4' ' ' GLU . 68.5 tp60 -65.43 -32.19 73.69 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.406 179.605 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 75.3 t60 -59.73 -45.35 92.44 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.809 0.338 . . . . 0.0 110.292 -179.941 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -59.79 -46.71 88.36 Favored 'General case' 0 C--O 1.244 0.77 0 CA-C-O 121.177 0.513 . . . . 0.0 110.233 179.713 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.421 ' O ' ' CB ' ' A' ' 14' ' ' GLN . 63.6 mtp85 -64.27 -33.47 75.88 Favored 'General case' 0 C--O 1.209 -1.066 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 179.707 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 29.8 t80 -58.78 -36.74 74.9 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.774 0.321 . . . . 0.0 110.322 -179.547 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 4.2 t -64.15 -50.28 77.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 C-N-CA 120.179 -0.608 . . . . 0.0 111.288 -179.939 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 93.7 mt-10 -80.24 -31.77 38.48 Favored 'General case' 0 C--N 1.325 -0.49 0 C-N-CA 120.485 -0.486 . . . . 0.0 111.767 -179.285 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . 0.421 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 65.1 tp60 -72.58 -53.22 12.54 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.025 -178.936 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.33 -45.51 92.88 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.842 -0.429 . . . . 0.0 109.842 -179.673 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 66.0 mttm -56.28 -34.42 66.42 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 120.49 -0.484 . . . . 0.0 109.977 179.489 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 69.7 mm-40 -72.05 -41.42 67.46 Favored 'General case' 0 C--O 1.241 0.608 0 CA-C-O 121.175 0.512 . . . . 0.0 110.521 178.551 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -53.64 -45.88 70.32 Favored 'General case' 0 C--O 1.223 -0.342 0 N-CA-C 109.693 -0.484 . . . . 0.0 109.693 179.902 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.449 ' O ' ' N ' ' A' ' 22' ' ' ARG . 4.5 mt -65.58 -37.11 85.72 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 120.984 0.421 . . . . 0.0 110.421 178.838 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 78.5 tttt -45.4 -37.22 4.85 Favored 'General case' 0 C--N 1.321 -0.646 0 C-N-CA 120.418 -0.513 . . . . 0.0 109.83 -179.798 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' THR . . . . . 0.574 ' C ' ' H ' ' A' ' 23' ' ' GLY . 0.9 OUTLIER -63.14 -34.08 76.86 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.11 179.43 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.449 ' N ' ' O ' ' A' ' 19' ' ' LEU . 12.8 mmt180 -70.37 17.59 0.06 Allowed 'General case' 0 C--O 1.233 0.215 0 CA-C-O 120.801 0.334 . . . . 0.0 110.393 -179.721 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . 0.574 ' H ' ' C ' ' A' ' 21' ' ' THR . . . 83.13 13.11 77.94 Favored Glycine 0 CA--C 1.523 0.562 0 N-CA-C 110.356 -1.098 . . . . 0.0 110.356 -179.878 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 12.7 t -89.2 167.49 1.68 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 N-CA-C 110.333 -0.247 . . . . 0.0 110.333 -179.907 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 58.5 mttp -134.87 127.46 30.75 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.223 179.335 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 3.0 m -121.63 126.31 74.58 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.247 0 C-N-CA 121.018 -0.273 . . . . 0.0 110.393 -179.921 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.405 ' HG2' ' H ' ' A' ' 28' ' ' TYR . 20.2 ttmt -110.88 159.38 17.75 Favored 'General case' 0 CA--C 1.528 0.114 0 N-CA-C 110.167 -0.308 . . . . 0.0 110.167 179.496 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . 0.405 ' H ' ' HG2' ' A' ' 27' ' ' LYS . 76.5 m-85 -49.67 -32.34 13.01 Favored 'General case' 0 C--O 1.237 0.44 0 CA-C-O 121.159 0.504 . . . . 0.0 110.224 179.414 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -55.21 -23.42 22.02 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.151 179.664 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.437 ' O ' ' CB ' ' A' ' 34' ' ' PHE . 87.5 m-20 -61.83 -46.77 88.03 Favored 'General case' 0 C--O 1.216 -0.66 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.758 -179.38 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.486 ' O ' ' CB ' ' A' ' 35' ' ' PHE . 5.4 mp -65.65 -40.76 92.83 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 121.106 0.479 . . . . 0.0 109.924 179.736 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 35.6 mt -59.2 -45.36 91.29 Favored 'General case' 0 C--N 1.314 -0.962 0 C-N-CA 119.798 -0.761 . . . . 0.0 110.962 -178.473 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.623 ' NZ ' ' CZ ' ' A' ' 37' ' ' PHE . 63.9 tttm -86.05 -50.25 7.18 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 112.064 0.394 . . . . 0.0 112.064 -179.089 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . 0.437 ' CB ' ' O ' ' A' ' 30' ' ' ASP . 51.4 t80 -60.21 -50.21 74.57 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.707 -0.678 . . . . 0.0 110.758 -178.591 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.486 ' CB ' ' O ' ' A' ' 31' ' ' LEU . 7.5 t80 -62.29 -46.84 86.96 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.354 -179.659 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 96.7 m-20 -63.03 -36.43 83.55 Favored 'General case' 0 C--N 1.344 0.329 0 CA-C-O 120.908 0.385 . . . . 0.0 111.209 -179.533 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.623 ' CZ ' ' NZ ' ' A' ' 33' ' ' LYS . 1.9 m-85 -57.33 -46.34 83.37 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.825 -179.479 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.561 ' O ' ' N ' ' A' ' 42' ' ' CYS . 23.8 m -81.78 -24.84 9.7 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 C-N-CA 120.299 -0.56 . . . . 0.0 110.395 179.694 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 45.8 tttp -58.03 -31.57 67.12 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 120.78 -0.368 . . . . 0.0 110.4 -179.208 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 65.2 t0 -52.94 -61.14 2.48 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 120.587 -0.445 . . . . 0.0 111.232 -179.548 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' THR . . . . . 0.409 ' C ' ' SG ' ' A' ' 42' ' ' CYS . 31.5 p -114.43 -32.03 6.05 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-O 121.141 0.496 . . . . 0.0 111.261 -179.531 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . 0.561 ' N ' ' O ' ' A' ' 38' ' ' VAL . 2.4 m 70.57 58.59 0.48 Allowed Pre-proline 0 C--N 1.324 -0.518 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.386 -178.698 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . 0.569 ' C ' ' H ' ' A' ' 45' ' ' PHE . 19.9 Cg_exo -68.08 -25.13 38.04 Favored 'Trans proline' 0 N--CA 1.495 1.591 0 C-N-CA 122.443 2.096 . . . . 0.0 112.319 179.885 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . 0.727 ' CE2' H141 ' A' ' 201' ' ' MYR . 0.0 OUTLIER -58.1 0.39 0.07 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.059 -179.34 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.569 ' H ' ' C ' ' A' ' 43' ' ' PRO . 0.1 OUTLIER 63.86 82.11 0.22 Allowed Pre-proline 0 C--N 1.328 -0.369 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.25 -179.987 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_endo -71.89 -9.79 25.27 Favored 'Trans proline' 0 N--CA 1.489 1.219 0 C-N-CA 122.041 1.828 . . . . 0.0 112.24 -179.55 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.518 ' O ' ' H32' ' A' ' 201' ' ' MYR . 88.1 mt-30 -81.02 -54.72 5.31 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 120.525 -0.47 . . . . 0.0 110.516 -179.81 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.664 ' O ' ' H52' ' A' ' 201' ' ' MYR . 63.2 tt0 -88.82 -26.72 21.52 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.48 178.984 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . 0.504 ' O ' ' H72' ' A' ' 201' ' ' MYR . . . 68.56 61.01 5.0 Favored Glycine 0 CA--C 1.52 0.404 0 N-CA-C 110.086 -1.206 . . . . 0.0 110.086 -179.363 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 13.5 t -118.34 154.19 32.76 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.7 0.286 . . . . 0.0 110.995 -179.274 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.4 mt -80.63 137.06 22.07 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-O 121.259 0.552 . . . . 0.0 110.841 179.494 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . 0.427 ' OD2' ' O ' ' A' ' 43' ' ' PRO . 79.9 m-20 -108.85 121.48 45.18 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.106 -0.952 . . . . 0.0 111.249 179.504 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 27.6 mm -94.81 -56.02 5.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.111 179.145 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -78.66 -50.09 12.05 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-O 121.032 0.444 . . . . 0.0 111.243 -179.609 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 78.1 mtp180 -58.88 -31.94 69.04 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.016 179.756 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 19.1 t-105 -62.41 -39.18 92.44 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.061 0.458 . . . . 0.0 110.616 178.987 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -62.44 -36.27 81.89 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.135 -179.717 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 95.5 mtt-85 -62.14 -55.32 29.94 Favored 'General case' 0 C--N 1.331 -0.224 0 C-N-CA 120.508 -0.477 . . . . 0.0 111.54 -179.655 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 5.0 p -65.6 -43.33 94.06 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.441 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.447 179.803 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . 0.437 ' O ' ' CB ' ' A' ' 64' ' ' GLN . . . -63.67 -41.53 98.99 Favored Glycine 0 C--O 1.22 -0.729 0 N-CA-C 111.33 -0.708 . . . . 0.0 111.33 -179.455 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 76.1 m-20 -61.64 -39.93 93.08 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.82 0.31 . . . . 0.0 110.749 -179.096 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 85.3 m -60.09 -62.98 1.47 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.996 0.427 . . . . 0.0 111.002 -179.694 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 70.7 m-85 -63.35 -42.2 98.9 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.864 -179.917 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . 0.437 ' CB ' ' O ' ' A' ' 60' ' ' GLY . 56.5 tt0 -57.31 -40.49 78.0 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.814 0.34 . . . . 0.0 110.776 -179.736 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -58.87 -53.75 54.87 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.986 -179.79 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 71.1 m-85 -67.47 -36.49 81.25 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.681 179.851 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 67.7 t80 -60.69 -43.62 97.52 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.61 -179.469 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . 0.418 HD22 ' HG2' ' A' ' 64' ' ' GLN . 32.8 m-20 -63.79 -41.8 97.85 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.792 -179.203 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 40.5 p -71.64 -17.59 62.25 Favored 'General case' 0 CA--C 1.514 -0.441 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.227 -179.996 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -69.11 -18.59 63.99 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.955 179.881 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 165.24 -62.73 0.23 Allowed Glycine 0 CA--C 1.53 1.019 0 C-N-CA 120.887 -0.673 . . . . 0.0 111.453 -179.237 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -41.39 100.8 0.03 OUTLIER 'Trans proline' 0 C--N 1.313 -1.311 0 C-N-CA 122.691 2.261 . . . . 0.0 112.363 -179.616 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -73.81 -41.69 61.99 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.523 179.282 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.558 ' CD ' ' H ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -95.11 -13.9 24.69 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.243 -179.878 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.447 ' O ' ' O ' ' A' ' 74' ' ' LYS . 28.9 t 58.27 130.14 0.02 OUTLIER Pre-proline 0 CA--C 1.538 0.504 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.192 -178.985 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 48.6 Cg_exo -52.51 126.47 20.92 Favored 'Trans proline' 0 N--CA 1.496 1.636 0 C-N-CA 121.405 1.403 . . . . 0.0 112.283 179.102 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . 0.46 ' O ' ' N ' ' A' ' 80' ' ' PHE . 56.6 t -83.9 -22.57 8.17 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.333 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.848 179.254 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 28.4 p -42.08 -24.65 0.05 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.371 -179.378 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . 0.446 ' N ' ' O ' ' A' ' 77' ' ' VAL . . . -65.76 -38.46 89.14 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.862 179.691 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . 0.46 ' N ' ' O ' ' A' ' 77' ' ' VAL . 3.8 m-85 -57.85 -34.8 70.11 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.435 -179.6 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 35.6 t -60.77 -42.88 98.38 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.269 179.947 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 21.8 m-85 -60.38 -50.15 74.74 Favored 'General case' 0 C--O 1.223 -0.32 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.038 179.905 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' TRP . . . . . . . . . . . . . 55.1 t90 -54.43 -39.14 67.08 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.573 -179.555 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 89.6 m-20 -62.31 -47.07 85.89 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 120.649 -0.42 . . . . 0.0 111.02 -179.584 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 41.0 tp -71.79 -54.35 10.45 Favored 'General case' 0 C--O 1.219 -0.545 0 C-N-CA 120.328 -0.549 . . . . 0.0 110.574 179.86 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -56.84 -25.93 23.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.372 179.643 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 63.9 tttt -65.1 -50.62 65.4 Favored 'General case' 0 C--N 1.321 -0.653 0 C-N-CA 120.177 -0.609 . . . . 0.0 110.16 179.892 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . 0.437 ' O ' ' OE1' ' A' ' 88' ' ' GLU . 0.9 OUTLIER -80.78 -20.07 43.42 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.008 -179.992 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 14.2 tp -61.03 -44.33 97.57 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.629 -178.95 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 3.3 mt -63.99 -43.58 97.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 C-N-CA 120.12 -0.632 . . . . 0.0 109.711 -179.634 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . 0.429 ' OD1' ' O ' ' A' ' 91' ' ' ASP . 64.9 t0 -47.45 -34.98 7.93 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.843 -179.02 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . 0.429 ' O ' ' CG2' ' A' ' 95' ' ' VAL . 72.1 tttt -58.84 143.84 46.23 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.924 -179.965 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 64.5 tttm -74.26 -42.56 59.42 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.087 179.846 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 69.1 tt0 -94.24 54.96 1.95 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.02 0.438 . . . . 0.0 110.47 -178.899 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.46 ' CG1' ' ND2' ' A' ' 96' ' ' ASN . 5.0 t -61.19 -74.3 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.717 -179.736 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' ASN . . . . . 0.644 ' ND2' ' N ' ' A' ' 96' ' ' ASN . 0.0 OUTLIER -154.04 162.84 25.83 Favored Pre-proline 0 C--N 1.328 -0.352 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.617 179.972 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . 0.456 ' C ' ' N ' ' A' ' 99' ' ' VAL . 14.1 Cg_endo -56.12 -11.01 5.09 Favored 'Trans proline' 0 N--CA 1.496 1.65 0 C-N-CA 122.999 2.466 . . . . 0.0 112.161 179.072 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . 0.598 ' OE1' ' ND2' ' A' ' 96' ' ' ASN . 5.5 pt20 -45.04 -19.59 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.614 -179.769 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . 0.456 ' N ' ' C ' ' A' ' 97' ' ' PRO . 82.8 t -63.68 -51.42 70.25 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 C-N-CA 120.618 -0.433 . . . . 0.0 110.871 -179.885 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 97.3 mmm -71.59 -40.08 70.1 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.916 179.905 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . 0.479 ' CB ' ' H31' ' A' ' 201' ' ' MYR . . . -62.99 -21.46 66.15 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.529 -179.759 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -60.62 -15.95 33.53 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.477 179.894 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.448 ' O ' ' O ' ' A' ' 106' ' ' THR . 84.2 t -64.16 -18.84 23.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 120.984 0.421 . . . . 0.0 110.155 179.586 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -63.43 -38.37 90.88 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.827 -179.953 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 55.3 tt0 -64.28 -42.08 96.59 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.919 -179.499 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' THR . . . . . 0.448 ' O ' ' O ' ' A' ' 103' ' ' VAL . 87.7 m -119.15 124.54 47.06 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.451 179.867 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 93.7 mt-10 -112.54 146.88 37.73 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.432 -179.895 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . 0.597 ' C ' ' H ' ' A' ' 110' ' ' LEU . 99.1 mt-10 -64.61 130.6 44.23 Favored 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 120.699 -0.4 . . . . 0.0 110.216 179.572 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . 0.402 HD11 HG21 ' A' ' 109' ' ' ILE . 37.9 pt -58.0 -0.31 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.192 179.313 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.597 ' H ' ' C ' ' A' ' 108' ' ' GLU . 97.8 mt -96.23 -2.72 45.57 Favored 'General case' 0 C--O 1.233 0.185 0 C-N-CA 120.723 -0.391 . . . . 0.0 110.518 -179.725 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -111.15 128.89 56.04 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.314 179.916 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 112' ' ' SER . . . . . 0.458 ' OG ' ' N ' ' A' ' 113' ' ' ASN . 86.8 p -136.87 -120.37 0.15 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.883 -0.598 . . . . 0.0 110.33 179.942 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 113' ' ' ASN . . . . . 0.458 ' N ' ' OG ' ' A' ' 112' ' ' SER . 8.2 m120 -63.13 -40.68 98.28 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.437 -179.889 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 45.0 t -140.53 143.66 35.51 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.466 179.85 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 88.3 mt-30 -70.68 90.52 0.77 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.535 -179.966 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 40.1 p -66.83 -34.77 78.53 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.567 179.995 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 64.9 t0 -60.83 -48.17 83.02 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.643 -179.877 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 30.4 tp -125.6 133.61 52.2 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.345 -179.961 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -104.52 130.14 52.49 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.751 0.31 . . . . 0.0 110.339 179.612 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 40.4 m80 -57.08 -41.44 78.85 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.482 -179.803 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 80.3 m80 -113.25 129.65 56.46 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.637 179.791 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 79.9 t60 -86.08 122.63 30.38 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.259 -179.988 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 99.3 m-70 -98.18 118.21 34.31 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.323 -179.982 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 124' ' ' HIS . . . . . . . . . . . . . 77.3 t60 -63.35 -43.66 97.05 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.532 -179.809 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 62.0 t-80 . . . . . 0 C--O 1.22 -0.468 0 CA-C-O 117.946 -1.026 . . . . 0.0 110.585 -179.981 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 201' ' ' MYR . . . . . 0.727 H141 ' CE2' ' A' ' 44' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . 0.425 ' C ' ' N ' ' A' ' 4' ' ' GLU . . . . . . . . 0 CA--C 1.526 0.737 0 N-CA-C 111.009 -0.836 . . . . 0.0 111.009 . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 86.9 mt-30 -46.42 -19.78 0.09 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.877 0.37 . . . . 0.0 110.736 -179.965 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . 0.443 ' HG2' ' H62' ' A' ' 201' ' ' MYR . 82.6 tt0 -54.37 -24.13 18.33 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.471 179.975 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 41.7 tp -42.26 -28.22 0.18 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.386 -179.736 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 59.7 p -59.95 -40.01 87.51 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.665 -179.88 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 90.0 mm-40 -61.72 -36.04 79.81 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.158 179.569 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 84.4 t60 -61.13 -41.25 96.38 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.361 179.657 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 79.1 tt0 -58.38 -47.36 84.1 Favored 'General case' 0 C--O 1.24 0.597 0 CA-C-O 121.327 0.584 . . . . 0.0 110.122 179.878 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.406 ' O ' ' CB ' ' A' ' 14' ' ' GLN . 61.9 mmt-85 -63.54 -34.76 78.51 Favored 'General case' 0 C--O 1.213 -0.854 0 N-CA-C 109.186 -0.672 . . . . 0.0 109.186 179.562 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.729 ' CZ ' H122 ' A' ' 201' ' ' MYR . 35.9 t80 -58.29 -37.43 75.0 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 120.222 -0.591 . . . . 0.0 110.334 -179.642 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 16.9 t -63.33 -48.5 87.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 C-N-CA 120.24 -0.584 . . . . 0.0 111.898 179.885 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -83.39 -26.92 30.0 Favored 'General case' 0 C--N 1.322 -0.617 0 C-N-CA 120.383 -0.527 . . . . 0.0 111.777 -179.125 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . 0.406 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 68.2 tp60 -77.82 -51.79 9.93 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.823 -179.181 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.98 -45.98 89.87 Favored 'General case' 0 CA--C 1.535 0.38 0 N-CA-C 109.839 -0.43 . . . . 0.0 109.839 179.886 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 96.8 mttt -58.68 -37.64 76.49 Favored 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 120.464 -0.494 . . . . 0.0 110.265 179.514 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 75.4 mt-30 -70.24 -37.35 74.95 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.619 178.644 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -56.35 -33.07 65.3 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.114 -0.494 . . . . 0.0 109.935 179.842 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.8 mt -85.63 -32.16 22.18 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.043 0.449 . . . . 0.0 110.65 178.969 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 66.0 tttm -48.84 -43.02 38.26 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.497 -178.794 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' THR . . . . . 0.504 ' C ' ' H ' ' A' ' 23' ' ' GLY . 0.1 OUTLIER -70.32 -25.0 63.1 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.611 179.752 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 29.1 mmt180 -74.14 19.04 0.13 Allowed 'General case' 0 N--CA 1.463 0.178 0 CA-C-O 120.812 0.339 . . . . 0.0 110.393 -179.753 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . 0.504 ' H ' ' C ' ' A' ' 21' ' ' THR . . . 87.66 17.18 58.81 Favored Glycine 0 N--CA 1.468 0.824 0 N-CA-C 111.138 -0.785 . . . . 0.0 111.138 179.957 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.437 ' CG1' ' N ' ' A' ' 25' ' ' LYS . 24.7 t -105.61 169.37 2.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 120.57 0.224 . . . . 0.0 110.527 179.953 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.437 ' N ' ' CG1' ' A' ' 24' ' ' VAL . 67.4 mttm -133.23 136.17 45.44 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.366 179.58 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 19.3 m -132.64 111.45 17.31 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.36 0 C-N-CA 121.148 -0.221 . . . . 0.0 110.666 -179.97 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.431 ' O ' ' N ' ' A' ' 30' ' ' ASP . 23.8 pttt -108.74 166.25 10.94 Favored 'General case' 0 CA--C 1.522 -0.122 0 N-CA-C 110.4 -0.222 . . . . 0.0 110.4 179.601 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 90.1 m-85 -46.92 -36.78 8.01 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-O 121.103 0.478 . . . . 0.0 110.019 179.719 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -56.73 -23.76 44.8 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.889 -0.596 . . . . 0.0 109.909 179.159 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.431 ' N ' ' O ' ' A' ' 27' ' ' LYS . 50.4 t0 -61.96 -49.78 74.73 Favored 'General case' 0 C--O 1.223 -0.291 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.974 -179.694 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.49 ' O ' ' CB ' ' A' ' 35' ' ' PHE . 5.8 mp -63.12 -41.13 99.27 Favored 'General case' 0 C--O 1.218 -0.561 0 CA-C-O 120.867 0.365 . . . . 0.0 110.336 179.965 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 51.2 mt -53.34 -46.07 69.36 Favored 'General case' 0 C--N 1.31 -1.109 0 C-N-CA 119.297 -0.961 . . . . 0.0 111.008 -178.985 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.495 ' O ' ' CD1' ' A' ' 37' ' ' PHE . 87.0 tttt -82.22 -53.16 6.29 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 112.151 0.426 . . . . 0.0 112.151 -179.003 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 10.2 m-85 -63.09 -50.44 70.53 Favored 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 120.405 -0.518 . . . . 0.0 111.52 -178.866 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.49 ' CB ' ' O ' ' A' ' 31' ' ' LEU . 22.4 t80 -58.21 -47.76 82.46 Favored 'General case' 0 C--N 1.323 -0.56 0 C-N-CA 120.752 -0.379 . . . . 0.0 110.577 -178.584 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 85.2 m-20 -71.33 -21.5 62.04 Favored 'General case' 0 C--N 1.339 0.122 0 C-N-CA 120.11 -0.636 . . . . 0.0 111.052 -179.43 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.506 ' O ' ' OG1' ' A' ' 41' ' ' THR . 2.7 m-85 -76.36 -63.43 1.33 Allowed 'General case' 0 C--O 1.224 -0.238 0 C-N-CA 120.508 -0.477 . . . . 0.0 111.92 -178.666 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.525 ' O ' ' N ' ' A' ' 42' ' ' CYS . 0.3 OUTLIER -63.41 -38.54 82.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-O 120.927 0.394 . . . . 0.0 110.805 -179.24 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 89.0 tttt -63.03 -45.18 93.51 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.36 -179.56 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.428 ' N ' ' OD1' ' A' ' 40' ' ' ASP . 4.4 m-20 -85.06 -33.58 22.44 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 120.951 -0.299 . . . . 0.0 111.46 -179.664 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' THR . . . . . 0.512 ' O ' ' C ' ' A' ' 42' ' ' CYS . 34.8 p -86.96 -25.83 24.14 Favored 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 120.746 -0.382 . . . . 0.0 111.255 -178.969 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . 0.525 ' N ' ' O ' ' A' ' 38' ' ' VAL . 1.7 m 23.15 67.46 0.36 Allowed Pre-proline 0 N--CA 1.466 0.362 0 O-C-N 123.954 0.784 . . . . 0.0 110.539 -178.378 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 16.8 Cg_exo -64.0 -43.38 15.79 Favored 'Trans proline' 0 C--N 1.306 -1.689 0 C-N-CA 121.814 1.676 . . . . 0.0 115.056 -175.914 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . 0.514 ' HE1' ' C ' ' A' ' 50' ' ' THR . 5.7 p90 -125.97 17.05 7.93 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.685 0.755 . . . . 0.0 110.128 179.89 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.64 ' CD2' ' NE2' ' A' ' 105' ' ' GLN . 4.3 t80 74.96 56.91 0.26 Allowed Pre-proline 0 C--N 1.32 -0.711 0 CA-C-N 114.786 -1.097 . . . . 0.0 111.16 -179.233 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.543 ' HD3' ' N ' ' A' ' 45' ' ' PHE . 11.3 Cg_exo -68.66 -19.83 41.29 Favored 'Trans proline' 0 N--CA 1.495 1.614 0 C-N-CA 123.018 2.479 . . . . 0.0 112.491 179.83 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 58.2 tt0 -54.24 -40.49 67.78 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.903 -179.002 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 31.6 tp10 -68.45 -32.25 72.13 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.825 -0.435 . . . . 0.0 109.825 179.637 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . 0.656 ' O ' H112 ' A' ' 201' ' ' MYR . . . 116.62 -17.93 13.45 Favored Glycine 0 CA--C 1.521 0.431 0 N-CA-C 110.448 -1.061 . . . . 0.0 110.448 -179.27 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' THR . . . . . 0.514 ' C ' ' HE1' ' A' ' 44' ' ' TRP . 6.2 t -56.38 159.49 3.6 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 109.284 -0.635 . . . . 0.0 109.284 179.411 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.454 ' HA ' ' NE1' ' A' ' 44' ' ' TRP . 0.7 OUTLIER -128.28 132.29 68.39 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.488 0 CA-C-O 120.743 0.306 . . . . 0.0 110.49 -179.977 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 48.3 t0 -123.18 117.69 25.94 Favored 'General case' 0 C--N 1.312 -1.039 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.9 177.88 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 25.3 mm -72.95 -43.4 59.3 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.882 -179.561 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -62.74 -55.62 24.99 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 121.241 0.543 . . . . 0.0 111.168 -178.374 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 91.2 mtt180 -64.48 -34.92 79.35 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.305 179.201 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 33.6 t-105 -55.85 -37.29 68.54 Favored 'General case' 0 C--N 1.332 -0.18 0 N-CA-C 109.698 -0.482 . . . . 0.0 109.698 179.394 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.62 ' NH2' ' CH2' ' A' ' 83' ' ' TRP . 63.7 ttm-85 -67.12 -36.97 83.05 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.003 179.126 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 44.3 ttm180 -59.65 -46.22 89.68 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 120.766 -0.373 . . . . 0.0 111.427 -179.509 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 3.1 p -69.08 -36.56 74.08 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 CA-C-O 120.774 0.321 . . . . 0.0 110.436 179.266 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -67.15 -50.53 45.04 Favored Glycine 0 CA--C 1.526 0.754 0 N-CA-C 111.296 -0.722 . . . . 0.0 111.296 179.827 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -63.83 -40.65 97.11 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.624 0.25 . . . . 0.0 111.207 -179.744 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 3.1 m -58.68 -51.56 69.43 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.993 0.425 . . . . 0.0 110.694 -179.464 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . 0.494 ' CE2' ' CE2' ' A' ' 37' ' ' PHE . 14.1 m-85 -68.3 -33.79 74.97 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.362 179.386 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 72.2 tp60 -60.1 -45.25 93.58 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.639 -179.755 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 16.3 t0 -60.63 -51.85 67.64 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.025 0.441 . . . . 0.0 110.603 179.971 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' TYR . . . . . 0.45 ' O ' ' OG1' ' A' ' 69' ' ' THR . 49.3 m-85 -63.71 -33.19 75.08 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.103 179.65 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 76.4 t80 -61.74 -40.43 95.06 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.105 179.703 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 98.5 m-20 -62.64 -38.11 88.97 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.065 -179.705 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.45 ' OG1' ' O ' ' A' ' 66' ' ' TYR . 43.5 p -47.23 -32.58 4.64 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 120.458 -0.497 . . . . 0.0 110.472 -179.084 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 60.2 m-85 -67.35 -38.35 84.7 Favored 'General case' 0 C--N 1.32 -0.69 0 C-N-CA 120.211 -0.596 . . . . 0.0 111.209 179.774 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . 0.421 ' H ' ' HD3' ' A' ' 72' ' ' PRO . . . 100.68 58.24 0.85 Allowed Glycine 0 CA--C 1.528 0.866 0 N-CA-C 110.715 -0.954 . . . . 0.0 110.715 -179.37 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . 0.421 ' HD3' ' H ' ' A' ' 71' ' ' GLY . 66.4 Cg_endo -76.36 116.64 4.38 Favored 'Trans proline' 0 C--N 1.31 -1.454 0 C-N-CA 122.781 2.321 . . . . 0.0 111.59 -179.941 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 79.4 tt0 -85.18 -21.23 29.26 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.248 -179.8 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.647 ' CD ' ' H ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -98.44 -29.14 13.29 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.867 -0.606 . . . . 0.0 112.392 -179.765 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.497 ' H ' ' HD3' ' A' ' 74' ' ' LYS . 24.4 t 39.3 92.68 0.05 OUTLIER Pre-proline 0 C--N 1.331 -0.231 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.736 -178.827 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -58.07 125.52 18.81 Favored 'Trans proline' 0 C--N 1.316 -1.169 0 C-N-CA 121.113 1.209 . . . . 0.0 111.049 179.792 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . 0.443 ' O ' ' N ' ' A' ' 80' ' ' PHE . 96.0 t -84.23 -16.24 10.82 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.618 179.452 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 36.4 p -40.68 -27.07 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.637 -178.688 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . 0.426 ' N ' ' O ' ' A' ' 77' ' ' VAL . . . -59.92 -42.47 94.0 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.031 0.443 . . . . 0.0 110.313 179.648 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . 0.475 ' CZ ' ' OD1' ' A' ' 84' ' ' ASN . 55.4 t80 -61.34 -41.54 97.21 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.54 179.682 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 17.9 m -58.05 -43.53 86.91 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.905 -179.215 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 6.4 m-85 -58.65 -53.63 56.16 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.916 0.389 . . . . 0.0 111.298 -179.504 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' TRP . . . . . 0.62 ' CH2' ' NH2' ' A' ' 57' ' ' ARG . 15.2 t90 -59.58 -38.43 81.15 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.103 179.966 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . 0.475 ' OD1' ' CZ ' ' A' ' 80' ' ' PHE . 5.3 m120 -61.55 -44.46 97.0 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 120.67 -0.412 . . . . 0.0 110.796 -179.611 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 53.9 tp -71.47 -53.72 13.0 Favored 'General case' 0 C--O 1.218 -0.575 0 C-N-CA 120.343 -0.543 . . . . 0.0 110.119 179.511 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -58.9 -24.85 27.67 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 C-N-CA 120.8 -0.36 . . . . 0.0 110.883 179.763 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 70.0 tttt -67.97 -49.68 60.26 Favored 'General case' 0 C--N 1.313 -1.0 0 C-N-CA 120.351 -0.54 . . . . 0.0 110.144 179.647 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.2 pp20? -79.97 -20.57 45.23 Favored 'General case' 0 C--N 1.32 -0.682 0 C-N-CA 120.321 -0.552 . . . . 0.0 110.366 -179.883 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 14.0 tp -62.19 -44.87 95.63 Favored 'General case' 0 N--CA 1.445 -0.705 0 C-N-CA 120.338 -0.545 . . . . 0.0 109.879 179.918 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -64.16 -43.42 97.38 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.228 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.936 179.57 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 99.4 m-20 -43.74 -37.51 2.72 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.025 -178.545 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -47.36 144.09 3.09 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 120.72 -0.392 . . . . 0.0 110.499 179.629 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 89.0 tttt -71.91 -49.16 40.21 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.874 0.369 . . . . 0.0 111.207 -179.662 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -108.31 54.21 0.67 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.583 -179.286 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 11.5 t -45.21 -73.88 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.242 -179.159 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' ASN . . . . . 0.408 ' OD1' ' N ' ' A' ' 96' ' ' ASN . 0.0 OUTLIER -153.42 160.5 30.87 Favored Pre-proline 0 C--N 1.325 -0.496 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.598 -179.965 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -59.31 -13.35 19.79 Favored 'Trans proline' 0 C--N 1.306 -1.659 0 C-N-CA 122.672 2.248 . . . . 0.0 111.87 179.063 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . 0.436 ' OE1' ' O ' ' A' ' 49' ' ' GLY . 9.5 pt20 -57.06 -19.88 21.61 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.89 -179.962 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 52.0 t -61.77 -49.63 83.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.62 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 97.9 mmm -73.07 -40.85 64.69 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.817 179.769 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -61.87 -24.36 66.87 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.485 -179.794 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -59.1 -17.29 25.05 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.197 179.709 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.411 ' O ' ' CG1' ' A' ' 103' ' ' VAL . 97.8 t -66.74 -2.65 1.59 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.396 179.124 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -60.05 -39.52 86.26 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.678 -179.748 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . 0.64 ' NE2' ' CD2' ' A' ' 45' ' ' PHE . 86.6 mt-30 -73.69 105.63 5.09 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.819 0.342 . . . . 0.0 110.655 179.568 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 65.0 p -68.24 -35.09 77.39 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.584 179.916 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 85.4 mt-10 -137.13 179.4 6.41 Favored 'General case' 0 CA--C 1.52 -0.206 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.29 179.974 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . 0.526 ' C ' ' H ' ' A' ' 110' ' ' LEU . 95.4 mt-10 -105.62 128.55 53.7 Favored 'General case' 0 CA--C 1.513 -0.463 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.003 179.198 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 44.8 pt -50.16 -12.18 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-N 115.938 -0.574 . . . . 0.0 109.962 179.805 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.526 ' H ' ' C ' ' A' ' 108' ' ' GLU . 31.2 mt -65.51 -40.45 93.04 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.609 179.606 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . 0.417 ' O ' ' O ' ' A' ' 114' ' ' SER . 86.8 tttt -68.09 -19.35 64.84 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.991 179.828 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 6.3 t -57.25 -44.2 83.64 Favored 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 120.615 -0.434 . . . . 0.0 110.611 -179.263 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 10.1 m120 -64.06 -41.51 97.34 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.88 179.939 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 114' ' ' SER . . . . . 0.417 ' O ' ' O ' ' A' ' 111' ' ' LYS . 29.6 p -157.6 167.46 30.07 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.491 -179.695 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 86.8 mt-30 -40.96 -28.99 0.09 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.846 0.355 . . . . 0.0 110.887 -179.773 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 2.8 t -166.9 176.49 6.98 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.528 -179.759 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 63.4 t0 -59.22 -45.19 91.77 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.305 -179.912 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 80.5 mt -118.81 111.96 19.1 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.171 179.755 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 95.1 mt-10 -54.0 126.43 22.52 Favored 'General case' 0 C--O 1.23 0.07 0 CA-C-O 120.872 0.367 . . . . 0.0 110.306 179.951 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 89.8 m-70 -59.21 -47.41 85.43 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.508 -179.698 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 50.0 t-80 -127.13 124.12 38.38 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.155 179.694 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 122' ' ' HIS . . . . . 0.588 ' HD1' ' H ' ' A' ' 124' ' ' HIS . 19.4 t-80 -91.93 124.76 36.29 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.348 179.97 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 5.4 m80 -58.45 -40.8 83.6 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.362 -179.818 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 124' ' ' HIS . . . . . 0.588 ' H ' ' HD1' ' A' ' 122' ' ' HIS . 97.8 m-70 -111.18 127.76 55.69 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.634 179.845 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 99.6 m-70 . . . . . 0 C--O 1.22 -0.466 0 CA-C-O 118.02 -0.991 . . . . 0.0 110.513 179.989 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 201' ' ' MYR . . . . . 0.729 H122 ' CZ ' ' A' ' 11' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . 0.406 ' C ' ' N ' ' A' ' 4' ' ' GLU . . . . . . . . 0 CA--C 1.526 0.765 0 N-CA-C 110.992 -0.843 . . . . 0.0 110.992 . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 85.0 mt-30 -44.15 -23.29 0.09 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.977 0.417 . . . . 0.0 110.507 -179.853 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . 0.44 ' O ' ' N ' ' A' ' 7' ' ' GLN . 95.0 mt-10 -53.05 -20.95 4.0 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.77 179.799 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 27.3 tp -40.85 -35.67 0.54 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.413 -178.716 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 78.1 p -54.61 -40.68 69.13 Favored 'General case' 0 C--N 1.325 -0.481 0 C-N-CA 120.432 -0.507 . . . . 0.0 110.011 179.532 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . 0.44 ' N ' ' O ' ' A' ' 4' ' ' GLU . 76.7 mt-30 -64.66 -32.31 73.92 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.612 179.735 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 63.3 t-80 -57.37 -45.32 84.56 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 121.12 0.486 . . . . 0.0 109.851 -179.925 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -61.31 -41.69 97.41 Favored 'General case' 0 C--O 1.24 0.588 0 CA-C-O 121.265 0.555 . . . . 0.0 109.625 179.498 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.463 ' O ' ' N ' ' A' ' 14' ' ' GLN . 93.8 mtt-85 -65.13 -38.8 91.78 Favored 'General case' 0 C--O 1.212 -0.904 0 C-N-CA 119.983 -0.687 . . . . 0.0 109.253 179.632 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.667 ' CE1' H142 ' A' ' 201' ' ' MYR . 0.0 OUTLIER -52.59 -40.06 62.25 Favored 'General case' 0 C--N 1.32 -0.692 0 C-N-CA 120.194 -0.603 . . . . 0.0 110.451 -179.848 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 5.6 t -62.32 -53.83 42.3 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 C-N-CA 120.154 -0.618 . . . . 0.0 111.366 -179.808 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 91.4 mt-10 -79.22 -48.13 14.73 Favored 'General case' 0 N--CA 1.466 0.356 0 C-N-CA 120.104 -0.639 . . . . 0.0 111.907 -179.258 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . 0.463 ' N ' ' O ' ' A' ' 10' ' ' ARG . 70.5 tp60 -49.34 -55.74 11.86 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.056 -179.461 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.02 -47.66 83.75 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.85 -0.426 . . . . 0.0 109.85 -179.629 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 92.4 mttt -55.46 -32.06 62.47 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 120.728 -0.389 . . . . 0.0 110.206 179.217 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 83.8 mt-30 -77.98 -36.58 48.78 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.512 178.967 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -56.7 -32.08 65.11 Favored 'General case' 0 C--O 1.226 -0.165 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.019 -179.907 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.463 ' O ' ' N ' ' A' ' 22' ' ' ARG . 3.5 mt -85.49 -37.42 19.72 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.248 0.547 . . . . 0.0 109.939 178.826 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 64.6 tttm -42.88 -45.62 5.01 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.447 -178.944 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' THR . . . . . 0.572 ' C ' ' H ' ' A' ' 23' ' ' GLY . 0.5 OUTLIER -68.39 -30.67 69.64 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.708 179.895 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.463 ' N ' ' O ' ' A' ' 19' ' ' LEU . 86.8 mmt-85 -69.81 24.06 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.634 -179.778 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . 0.572 ' H ' ' C ' ' A' ' 21' ' ' THR . . . 82.4 17.09 69.68 Favored Glycine 0 N--CA 1.468 0.83 0 N-CA-C 110.994 -0.842 . . . . 0.0 110.994 179.606 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.441 ' CG1' ' N ' ' A' ' 25' ' ' LYS . 26.2 t -105.5 169.03 2.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-O 120.742 0.306 . . . . 0.0 110.599 -179.93 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.441 ' N ' ' CG1' ' A' ' 24' ' ' VAL . 98.7 mttt -137.98 133.56 33.8 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.162 179.167 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 3.7 m -124.19 129.6 74.02 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.349 0 CA-C-O 120.558 0.218 . . . . 0.0 110.666 -179.977 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.456 ' HG2' ' H ' ' A' ' 28' ' ' TYR . 19.0 ttmt -111.35 162.12 15.36 Favored 'General case' 0 CA--C 1.529 0.136 0 N-CA-C 110.253 -0.277 . . . . 0.0 110.253 179.628 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . 0.456 ' H ' ' HG2' ' A' ' 27' ' ' LYS . 97.7 m-85 -51.22 -30.44 17.36 Favored 'General case' 0 C--O 1.238 0.482 0 CA-C-O 121.257 0.551 . . . . 0.0 110.017 179.228 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -57.24 -23.25 46.79 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.21 179.434 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.415 ' O ' ' CB ' ' A' ' 34' ' ' PHE . 87.8 m-20 -61.0 -47.43 86.47 Favored 'General case' 0 C--O 1.22 -0.496 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.47 -179.44 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.486 ' O ' ' CB ' ' A' ' 35' ' ' PHE . 5.6 mp -65.68 -40.35 92.28 Favored 'General case' 0 C--O 1.216 -0.681 0 C-N-CA 120.769 -0.372 . . . . 0.0 110.277 179.373 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 41.5 mt -58.21 -45.39 87.74 Favored 'General case' 0 C--N 1.313 -0.99 0 C-N-CA 119.429 -0.908 . . . . 0.0 111.164 -178.381 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.597 ' NZ ' ' CZ ' ' A' ' 37' ' ' PHE . 64.8 tttm -86.0 -48.49 8.62 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 121.072 0.463 . . . . 0.0 111.802 -179.222 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . 0.415 ' CB ' ' O ' ' A' ' 30' ' ' ASP . 60.2 t80 -61.1 -49.01 79.03 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.844 -179.0 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.486 ' CB ' ' O ' ' A' ' 31' ' ' LEU . 13.8 t80 -63.17 -46.62 86.27 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.576 -179.639 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 99.1 m-20 -64.48 -34.39 78.09 Favored 'General case' 0 C--N 1.341 0.227 0 CA-C-O 120.862 0.363 . . . . 0.0 110.965 -179.668 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.597 ' CZ ' ' NZ ' ' A' ' 33' ' ' LYS . 1.6 m-85 -59.35 -48.02 83.23 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.114 -179.597 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.575 ' O ' ' N ' ' A' ' 42' ' ' CYS . 14.8 m -74.81 -36.35 39.39 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.68 179.878 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -55.54 -27.7 50.5 Favored 'General case' 0 C--N 1.322 -0.606 0 C-N-CA 120.733 -0.387 . . . . 0.0 110.15 -179.792 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 85.0 m-20 -54.1 -62.27 1.76 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.797 -179.719 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' THR . . . . . 0.44 ' C ' ' SG ' ' A' ' 42' ' ' CYS . 7.8 p -114.33 -27.37 7.62 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 120.864 0.364 . . . . 0.0 111.392 -179.801 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . 0.575 ' N ' ' O ' ' A' ' 38' ' ' VAL . 2.3 m 71.46 55.57 0.4 Allowed Pre-proline 0 C--N 1.326 -0.436 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.468 -179.151 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . 0.556 ' C ' ' H ' ' A' ' 45' ' ' PHE . 73.0 Cg_endo -77.18 -37.32 1.08 Allowed 'Trans proline' 0 N--CA 1.494 1.512 0 C-N-CA 122.753 2.302 . . . . 0.0 113.054 -179.536 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . 0.639 ' HE1' ' H ' ' A' ' 52' ' ' ASP . 0.0 OUTLIER -62.83 4.68 0.16 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.787 -179.974 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.556 ' H ' ' C ' ' A' ' 43' ' ' PRO . 0.2 OUTLIER 55.17 53.54 9.19 Favored Pre-proline 0 CA--C 1.539 0.533 0 CA-C-O 121.49 0.662 . . . . 0.0 110.233 -178.85 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.508 ' HD3' ' N ' ' A' ' 45' ' ' PHE . 48.0 Cg_exo -52.46 -28.93 37.73 Favored 'Trans proline' 0 N--CA 1.493 1.453 0 C-N-CA 122.09 1.86 . . . . 0.0 111.84 179.327 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -70.45 -42.87 70.91 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.132 -179.44 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.529 ' O ' ' H52' ' A' ' 201' ' ' MYR . 14.1 tt0 -84.71 -15.22 45.97 Favored 'General case' 0 N--CA 1.465 0.305 0 C-N-CA 120.687 -0.405 . . . . 0.0 109.978 -179.69 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . 0.569 ' O ' ' H72' ' A' ' 201' ' ' MYR . . . 63.26 56.86 17.74 Favored Glycine 0 C--O 1.229 -0.181 0 N-CA-C 110.142 -1.183 . . . . 0.0 110.142 -179.947 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' THR . . . . . 0.659 ' O ' H131 ' A' ' 201' ' ' MYR . 6.5 t -121.11 165.88 14.72 Favored 'General case' 0 C--N 1.327 -0.397 0 O-C-N 123.586 0.227 . . . . 0.0 110.785 -179.295 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.54 ' H ' HE22 ' A' ' 98' ' ' GLN . 1.1 mt -101.24 137.95 27.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 N-CA-C 109.688 -0.486 . . . . 0.0 109.688 179.522 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . 0.639 ' H ' ' HE1' ' A' ' 44' ' ' TRP . 20.0 m-20 -115.05 120.43 39.83 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.279 179.836 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 23.2 mm -94.69 -56.39 5.25 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.904 179.147 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 99.8 mttt -78.44 -48.33 15.66 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.226 -179.733 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 83.0 mtp180 -60.19 -32.92 71.54 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.091 -179.844 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' TRP . . . . . 0.525 ' CE3' ' CZ3' ' A' ' 44' ' ' TRP . 17.2 t-105 -62.16 -39.24 91.98 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-O 120.998 0.428 . . . . 0.0 110.536 179.437 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 63.5 ttm-85 -62.43 -38.11 88.47 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.325 179.849 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . 0.499 ' O ' ' SG ' ' A' ' 62' ' ' CYS . 61.6 ttt85 -59.69 -56.65 19.14 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 120.63 -0.428 . . . . 0.0 110.909 -179.36 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 6.6 p -66.7 -42.79 90.09 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.552 0 CA-C-O 120.803 0.335 . . . . 0.0 111.049 -179.865 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . 0.427 ' O ' ' CB ' ' A' ' 64' ' ' GLN . . . -63.34 -46.74 92.11 Favored Glycine 0 C--O 1.222 -0.636 0 N-CA-C 111.681 -0.568 . . . . 0.0 111.681 -179.259 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 66.7 t0 -61.0 -36.89 80.66 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.574 0.226 . . . . 0.0 110.948 -179.444 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' CYS . . . . . 0.499 ' SG ' ' O ' ' A' ' 58' ' ' ARG . 71.3 m -61.03 -64.83 0.82 Allowed 'General case' 0 C--N 1.325 -0.468 0 C-N-CA 120.712 -0.395 . . . . 0.0 111.304 -179.674 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 73.3 m-85 -64.77 -43.58 92.79 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.334 -0.393 . . . . 0.0 111.441 -179.666 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . 0.427 ' CB ' ' O ' ' A' ' 60' ' ' GLY . 53.0 tt0 -59.45 -40.7 87.7 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.768 -179.394 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 18.9 t0 -58.09 -55.4 35.47 Favored 'General case' 0 C--N 1.323 -0.548 0 C-N-CA 120.65 -0.42 . . . . 0.0 110.853 -179.885 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 61.9 m-85 -66.27 -38.89 88.85 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 120.617 -0.433 . . . . 0.0 110.868 179.89 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . 0.442 ' O ' ' N ' ' A' ' 71' ' ' GLY . 59.9 t80 -58.99 -42.34 89.8 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.533 -179.496 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . 0.406 ' CG ' ' O ' ' A' ' 64' ' ' GLN . 23.5 m-20 -62.99 -42.74 99.93 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.225 -179.015 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 10.1 p -77.33 -18.92 57.06 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 120.609 -0.436 . . . . 0.0 109.958 -179.575 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 40.5 m-85 -113.41 16.47 18.89 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.797 179.715 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . 0.442 ' N ' ' O ' ' A' ' 67' ' ' TYR . . . -154.16 -109.76 0.36 Allowed Glycine 0 CA--C 1.535 1.329 0 C-N-CA 120.594 -0.813 . . . . 0.0 111.133 -179.875 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -74.34 144.82 33.34 Favored 'Trans proline' 0 N--CA 1.492 1.386 0 C-N-CA 121.906 1.738 . . . . 0.0 113.296 -179.432 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 84.7 tt0 -85.43 -43.92 13.2 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.718 -0.673 . . . . 0.0 110.659 179.773 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.564 ' CD ' ' H ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -87.21 -18.13 31.03 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.984 -179.83 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.424 ' H ' ' HD3' ' A' ' 74' ' ' LYS . 99.6 t 57.22 114.46 0.02 OUTLIER Pre-proline 0 N--CA 1.448 -0.571 0 CA-C-N 115.846 -0.616 . . . . 0.0 111.5 -179.465 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_exo -53.23 128.8 30.59 Favored 'Trans proline' 0 N--CA 1.491 1.337 0 C-N-CA 121.312 1.342 . . . . 0.0 111.58 179.847 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 42.5 t -82.53 -7.81 10.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.59 179.483 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 75.4 p -48.21 -23.57 0.91 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.957 0.408 . . . . 0.0 110.172 -179.916 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.72 -36.57 84.73 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.797 179.461 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 -58.33 -34.59 70.78 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.119 179.934 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 49.5 m -59.32 -40.59 86.76 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.352 179.573 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 11.8 m-85 -60.97 -49.58 76.85 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 120.793 -0.363 . . . . 0.0 111.022 179.826 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' TRP . . . . . 0.491 ' CD1' ' N ' ' A' ' 83' ' ' TRP . 21.9 m0 -58.6 -35.34 72.28 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.508 -179.756 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 77.5 m-20 -63.49 -46.52 85.74 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 120.618 -0.433 . . . . 0.0 110.758 179.727 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 35.1 tp -71.24 -53.32 14.77 Favored 'General case' 0 C--O 1.219 -0.501 0 C-N-CA 120.486 -0.486 . . . . 0.0 110.274 179.344 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -56.85 -27.51 26.43 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-O 120.863 0.363 . . . . 0.0 110.466 -179.988 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 34.8 tttm -65.8 -49.68 67.41 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.72 -179.599 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . 0.536 ' OE1' ' NZ ' ' A' ' 92' ' ' LYS . 1.1 pp20? -80.08 -20.1 45.91 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.794 -179.64 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.48 -45.06 94.77 Favored 'General case' 0 N--CA 1.444 -0.753 0 C-N-CA 120.263 -0.575 . . . . 0.0 110.427 -179.104 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 3.4 mt -64.79 -43.19 96.46 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.153 0 C-N-CA 120.504 -0.478 . . . . 0.0 109.955 -179.831 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 88.7 m-20 -44.31 -42.05 6.45 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.604 -178.487 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . 0.536 ' NZ ' ' OE1' ' A' ' 88' ' ' GLU . 51.2 mttp -57.14 124.96 20.58 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.025 0.441 . . . . 0.0 110.773 179.923 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -71.43 -38.28 71.37 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.436 179.187 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 93.0 mt-10 -81.72 50.25 1.48 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.915 -179.395 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.511 ' CG1' ' N ' ' A' ' 96' ' ' ASN . 13.1 t -80.61 162.35 3.67 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.057 179.719 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' ASN . . . . . 0.602 ' O ' ' N ' ' A' ' 98' ' ' GLN . 0.0 OUTLIER -40.87 166.35 0.06 OUTLIER Pre-proline 0 C--N 1.328 -0.362 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.324 179.95 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 77.3 Cg_exo -40.19 -14.05 0.03 OUTLIER 'Trans proline' 0 C--N 1.313 -1.335 0 C-N-CA 122.864 2.376 . . . . 0.0 112.695 179.327 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . 0.602 ' N ' ' O ' ' A' ' 96' ' ' ASN . 4.8 tt0 -46.6 -31.52 2.88 Favored 'General case' 0 C--N 1.321 -0.632 0 C-N-CA 120.742 -0.383 . . . . 0.0 110.056 179.281 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 93.9 t -61.53 -49.89 82.57 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 C-N-CA 120.382 -0.527 . . . . 0.0 110.63 -178.942 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 63.6 ttp -82.22 -43.7 17.3 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.966 179.6 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -61.06 -26.02 67.34 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.722 -179.599 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . 0.411 ' CB ' ' O ' ' A' ' 98' ' ' GLN . . . -63.47 -16.09 59.63 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.91 0.385 . . . . 0.0 110.399 179.981 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 54.4 t -63.12 -42.61 97.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.493 179.706 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . 0.45 ' O ' ' N ' ' A' ' 106' ' ' THR . . . -46.14 -29.66 1.62 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.551 -179.712 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 92.5 mm-40 40.4 -95.3 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.716 179.835 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' THR . . . . . 0.45 ' N ' ' O ' ' A' ' 104' ' ' ALA . 30.7 p -131.34 160.02 36.22 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.325 -179.982 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -99.43 147.0 25.72 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.538 -179.846 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . 0.45 ' C ' ' H ' ' A' ' 110' ' ' LEU . 79.6 mm-40 -79.57 129.69 34.7 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.15 -0.477 . . . . 0.0 109.978 179.499 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . 0.443 ' O ' ' OG ' ' A' ' 112' ' ' SER . 39.1 pt -54.29 -12.1 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 115.922 -0.581 . . . . 0.0 109.846 -179.887 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.45 ' H ' ' C ' ' A' ' 108' ' ' GLU . 79.1 mt -73.47 -39.08 65.19 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.429 179.278 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -65.64 -33.73 76.56 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.424 -179.884 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 112' ' ' SER . . . . . 0.534 ' HG ' ' N ' ' A' ' 113' ' ' ASN . 94.0 p -59.74 -44.5 93.76 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.968 -179.304 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 113' ' ' ASN . . . . . 0.534 ' N ' ' HG ' ' A' ' 112' ' ' SER . 40.6 t30 -64.77 -41.74 95.64 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.192 179.944 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 17.1 p -167.81 157.24 9.92 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.514 179.498 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 86.7 mt-30 -99.75 10.34 41.49 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.835 0.35 . . . . 0.0 110.495 179.764 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 43.7 p -65.02 -36.75 85.39 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.471 -179.901 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 91.0 m-20 -62.8 -42.97 99.94 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.528 179.962 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 97.8 mt -129.21 62.26 1.52 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.317 179.763 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 79.6 tt0 -71.71 145.12 49.03 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.313 179.99 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 93.3 m-70 -58.54 -43.91 89.42 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.625 -179.836 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 93.9 m-70 -106.84 104.67 14.41 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.675 179.878 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 72.4 m80 -73.01 -40.67 64.99 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.74 179.88 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 48.2 t-80 -77.05 143.32 39.38 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.601 -179.877 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 124' ' ' HIS . . . . . . . . . . . . . 97.0 m-70 -111.01 136.82 49.44 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.433 -179.762 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 81.6 t60 . . . . . 0 C--O 1.22 -0.483 0 CA-C-O 118.054 -0.974 . . . . 0.0 110.626 179.895 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 201' ' ' MYR . . . . . 0.667 H142 ' CE1' ' A' ' 11' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.743 0 N-CA-C 111.2 -0.76 . . . . 0.0 111.2 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 97.2 mm-40 -60.01 -21.58 61.49 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.911 0.386 . . . . 0.0 110.315 -179.87 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 82.8 tt0 -56.23 -22.62 30.68 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.468 179.705 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 34.2 tp -41.63 -28.54 0.14 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.373 -179.681 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 78.2 p -57.73 -36.97 72.76 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 120.662 -0.415 . . . . 0.0 110.112 -179.762 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 88.0 mt-30 -64.28 -33.04 74.92 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.573 179.431 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 58.5 t-80 -61.85 -45.62 92.99 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.596 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 98.1 mt-10 -59.84 -44.84 93.88 Favored 'General case' 0 C--O 1.243 0.718 0 CA-C-O 121.243 0.544 . . . . 0.0 110.111 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 77.9 mmt-85 -62.27 -33.47 74.69 Favored 'General case' 0 C--O 1.214 -0.813 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 179.235 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.615 ' CE1' HD23 ' A' ' 15' ' ' LEU . 40.7 t80 -59.96 -37.29 79.14 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 120.548 -0.461 . . . . 0.0 110.353 -179.762 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 3.4 t -61.62 -48.28 89.45 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 C-N-CA 119.75 -0.78 . . . . 0.0 110.888 179.885 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 98.4 mt-10 -82.02 -46.85 13.38 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 120.038 -0.665 . . . . 0.0 111.66 -179.554 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 71.2 tp60 -58.3 -51.38 70.04 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.89 -0.595 . . . . 0.0 111.201 -179.131 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.647 HD13 ' O ' ' A' ' 15' ' ' LEU . 0.4 OUTLIER -63.48 -46.12 87.65 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-O 120.991 0.424 . . . . 0.0 109.933 179.875 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.544 ' HB3' HG11 ' A' ' 26' ' ' VAL . 91.8 mttt -58.32 -35.54 72.02 Favored 'General case' 0 C--N 1.329 -0.284 0 O-C-N 121.962 -0.461 . . . . 0.0 110.478 179.359 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 93.2 mt-30 -71.91 -36.25 69.94 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.369 178.967 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.16 -38.68 80.31 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.087 179.87 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.5 mt -79.88 -28.01 39.96 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.965 0.412 . . . . 0.0 110.581 179.293 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 65.1 tttm -55.29 -39.81 70.31 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.243 -179.337 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' THR . . . . . 0.434 HG23 HH11 ' A' ' 22' ' ' ARG . 1.5 t -74.13 -18.18 60.83 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.877 -179.821 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.434 HH11 HG23 ' A' ' 21' ' ' THR . 62.8 mmt-85 -77.22 -0.19 24.28 Favored 'General case' 0 C--N 1.331 -0.2 0 C-N-CA 120.672 -0.411 . . . . 0.0 110.202 179.544 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 106.67 13.57 21.84 Favored Glycine 0 N--CA 1.466 0.7 0 N-CA-C 110.884 -0.886 . . . . 0.0 110.884 -179.554 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.589 HG12 ' N ' ' A' ' 25' ' ' LYS . 17.9 t -100.86 168.74 1.83 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 N-CA-C 110.441 -0.207 . . . . 0.0 110.441 -179.838 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.589 ' N ' HG12 ' A' ' 24' ' ' VAL . 68.6 mttm -125.54 137.9 53.95 Favored 'General case' 0 C--O 1.233 0.209 0 N-CA-C 110.175 -0.306 . . . . 0.0 110.175 179.591 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.544 HG11 ' HB3' ' A' ' 16' ' ' LYS . 3.2 m -135.63 107.12 6.9 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.374 0 CA-C-O 120.761 0.315 . . . . 0.0 110.801 -179.651 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 27.8 pttt -108.55 165.83 11.23 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-O 120.75 0.309 . . . . 0.0 110.527 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.605 ' CE2' HD11 ' A' ' 32' ' ' LEU . 81.6 t80 -47.97 -38.52 17.02 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-O 121.04 0.447 . . . . 0.0 109.884 179.442 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.444 ' HA ' HD12 ' A' ' 32' ' ' LEU . . . -56.98 -23.08 43.26 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.021 -0.536 . . . . 0.0 109.984 179.041 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 58.2 t0 -62.26 -44.36 96.72 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.559 -179.594 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.518 ' O ' ' CB ' ' A' ' 35' ' ' PHE . 5.6 mp -67.47 -41.29 84.87 Favored 'General case' 0 C--O 1.213 -0.828 0 CA-C-O 121.164 0.507 . . . . 0.0 109.694 179.184 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.605 HD11 ' CE2' ' A' ' 28' ' ' TYR . 49.4 mt -56.97 -44.57 82.77 Favored 'General case' 0 C--N 1.313 -0.987 0 C-N-CA 119.715 -0.794 . . . . 0.0 111.26 -178.605 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -84.31 -50.86 7.45 Favored 'General case' 0 C--N 1.32 -0.702 0 C-N-CA 120.666 -0.413 . . . . 0.0 111.617 -179.013 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' PHE . . . . . 0.794 ' O ' HG22 ' A' ' 38' ' ' VAL . 59.7 t80 -63.48 -48.27 78.35 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.47 -178.916 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.518 ' CB ' ' O ' ' A' ' 31' ' ' LEU . 17.4 t80 -61.97 -44.47 96.68 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 110.009 -0.367 . . . . 0.0 110.009 -179.442 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 92.4 m-20 -70.39 -37.96 74.6 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 120.717 -0.393 . . . . 0.0 111.683 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.472 ' CE2' ' CE2' ' A' ' 63' ' ' PHE . 2.7 m-85 -62.34 -50.46 71.52 Favored 'General case' 0 N--CA 1.464 0.253 0 N-CA-C 112.116 0.413 . . . . 0.0 112.116 -178.629 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.794 HG22 ' O ' ' A' ' 34' ' ' PHE . 13.9 m -68.17 -42.58 84.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 C-N-CA 120.541 -0.463 . . . . 0.0 110.493 -179.599 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 43.3 mmtt -64.24 -28.5 69.77 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.069 179.872 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 67.3 t0 -54.2 -49.24 69.84 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 120.725 -0.39 . . . . 0.0 110.542 -179.309 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.465 ' O ' ' SG ' ' A' ' 42' ' ' CYS . 12.1 p -113.38 -2.77 13.89 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.026 179.766 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' CYS . . . . . 0.533 ' N ' ' O ' ' A' ' 38' ' ' VAL . 29.8 p 37.72 57.6 4.48 Favored Pre-proline 0 N--CA 1.465 0.3 0 CA-C-N 116.484 -0.325 . . . . 0.0 110.553 -179.223 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 69.7 Cg_endo -76.54 -33.23 3.26 Favored 'Trans proline' 0 C--N 1.31 -1.461 0 C-N-CA 122.538 2.159 . . . . 0.0 112.806 -179.062 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' TRP . . . . . 0.639 ' HE1' ' H ' ' A' ' 52' ' ' ASP . 0.0 OUTLIER -75.94 2.36 12.78 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.711 -179.775 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.489 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 16.7 m-85 50.14 51.41 10.64 Favored Pre-proline 0 C--N 1.327 -0.397 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.02 -179.786 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.489 ' CD ' ' N ' ' A' ' 45' ' ' PHE . 10.1 Cg_endo -51.14 -7.24 0.14 Allowed 'Trans proline' 0 C--N 1.308 -1.587 0 C-N-CA 122.805 2.337 . . . . 0.0 111.973 -179.783 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.47 ' H ' ' C ' ' A' ' 45' ' ' PHE . 99.5 mm-40 -62.21 -52.8 62.31 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.627 -179.576 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 55.1 tt0 -88.3 -12.86 42.31 Favored 'General case' 0 N--CA 1.466 0.326 0 C-N-CA 120.569 -0.452 . . . . 0.0 110.387 179.713 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 71.73 69.05 1.46 Allowed Glycine 0 CA--C 1.524 0.651 0 N-CA-C 110.486 -1.045 . . . . 0.0 110.486 -179.504 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 3.0 t -136.39 161.31 36.16 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.712 0.291 . . . . 0.0 110.945 -179.249 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.1 mt -99.92 139.75 20.75 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.248 0 CA-C-O 120.98 0.419 . . . . 0.0 110.29 179.428 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' ASP . . . . . 0.639 ' H ' ' HE1' ' A' ' 44' ' ' TRP . 4.9 t70 -125.44 120.83 32.08 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.588 -0.733 . . . . 0.0 109.648 179.405 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 20.1 mm -88.04 -44.74 15.87 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.834 -179.26 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 65.4 tttm -66.92 -51.45 55.15 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-O 121.077 0.465 . . . . 0.0 111.618 -179.718 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 79.3 mmt-85 -62.09 -32.52 73.08 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.807 -0.442 . . . . 0.0 109.807 -179.665 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' TRP . . . . . 0.594 ' CE3' ' CH2' ' A' ' 44' ' ' TRP . 29.9 t-105 -57.59 -39.72 77.42 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 120.564 -0.454 . . . . 0.0 110.097 -179.897 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -65.22 -37.81 88.44 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.981 -0.554 . . . . 0.0 109.944 179.544 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 68.6 ttt180 -61.24 -53.35 58.02 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 120.67 -0.412 . . . . 0.0 111.144 -179.723 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.432 HG13 ' N ' ' A' ' 60' ' ' GLY . 3.5 p -64.46 -43.87 96.97 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.507 0 CA-C-O 120.721 0.296 . . . . 0.0 110.274 179.695 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 60' ' ' GLY . . . . . 0.432 ' N ' HG13 ' A' ' 59' ' ' VAL . . . -62.65 -40.4 99.12 Favored Glycine 0 CA--C 1.524 0.645 0 N-CA-C 111.047 -0.821 . . . . 0.0 111.047 179.741 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 61' ' ' ASP . . . . . 0.43 ' O ' ' OD1' ' A' ' 61' ' ' ASP . 67.9 t0 -64.17 -37.8 88.76 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.742 0.306 . . . . 0.0 110.929 -179.688 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 67.5 m -60.55 -53.08 61.77 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.911 -179.367 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' PHE . . . . . 0.472 ' CE2' ' CE2' ' A' ' 37' ' ' PHE . 44.3 m-85 -68.97 -37.03 78.55 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.725 179.457 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 69.5 tp60 -59.71 -43.34 94.16 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.867 0.365 . . . . 0.0 110.358 -179.805 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 18.4 t0 -60.56 -50.77 72.21 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.568 179.707 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' TYR . . . . . 0.465 ' O ' ' OG1' ' A' ' 69' ' ' THR . 70.9 t80 -66.36 -26.16 67.14 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.113 179.749 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 59.2 t80 -73.36 -42.08 62.65 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.612 179.882 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' ASN . . . . . 0.473 ' O ' ' N ' ' A' ' 71' ' ' GLY . 94.0 m-20 -63.35 -37.1 85.97 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.025 -179.14 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.465 ' OG1' ' O ' ' A' ' 66' ' ' TYR . 40.5 p -48.35 -17.08 0.12 Allowed 'General case' 0 N--CA 1.464 0.256 0 C-N-CA 120.786 -0.366 . . . . 0.0 110.664 -179.593 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 70' ' ' PHE . . . . . 0.418 ' N ' ' C ' ' A' ' 68' ' ' ASN . 90.3 m-85 -95.59 15.47 19.77 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 120.806 -0.358 . . . . 0.0 111.047 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 71' ' ' GLY . . . . . 0.473 ' N ' ' O ' ' A' ' 68' ' ' ASN . . . 38.0 59.18 1.46 Allowed Glycine 0 N--CA 1.471 1.018 0 N-CA-C 110.976 -0.85 . . . . 0.0 110.976 -179.451 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 72' ' ' PRO . . . . . 0.5 ' O ' HG23 ' A' ' 75' ' ' VAL . 69.4 Cg_endo -80.62 125.42 5.57 Favored 'Trans proline' 0 C--N 1.309 -1.5 0 C-N-CA 122.431 2.087 . . . . 0.0 112.223 -179.962 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 77.5 mm-40 -85.73 -39.2 17.43 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.885 179.771 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.724 ' CD ' ' H ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -62.58 -41.29 98.84 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.424 -0.807 . . . . 0.0 111.646 -179.752 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.516 ' O ' HG12 ' A' ' 75' ' ' VAL . 29.0 t 31.77 93.05 0.05 OUTLIER Pre-proline 0 N--CA 1.463 0.212 0 O-C-N 123.296 0.373 . . . . 0.0 111.194 179.633 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 34.6 Cg_exo -55.63 125.62 19.73 Favored 'Trans proline' 0 C--N 1.311 -1.441 0 C-N-CA 121.442 1.428 . . . . 0.0 111.645 -179.073 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.448 ' O ' ' N ' ' A' ' 80' ' ' PHE . 60.5 t -82.8 -19.61 10.09 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.452 179.576 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 78' ' ' THR . . . . . 0.416 ' H ' HG23 ' A' ' 78' ' ' THR . 10.3 p -41.56 -28.26 0.12 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.328 -179.187 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 79' ' ' ALA . . . . . 0.407 ' N ' ' C ' ' A' ' 77' ' ' VAL . . . -59.78 -41.48 91.22 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.371 179.724 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 80' ' ' PHE . . . . . 0.448 ' N ' ' O ' ' A' ' 77' ' ' VAL . 3.2 m-85 -63.21 -40.27 97.01 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.672 179.701 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 43.5 m -59.1 -42.12 89.75 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.866 -179.77 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 5.6 m-85 -60.05 -51.23 70.55 Favored 'General case' 0 C--N 1.331 -0.22 0 C-N-CA 120.813 -0.355 . . . . 0.0 110.74 -179.736 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 83' ' ' TRP . . . . . . . . . . . . . 32.9 t90 -58.48 -38.52 77.78 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.536 179.565 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 92.8 m-20 -61.51 -44.18 97.52 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 120.652 -0.419 . . . . 0.0 110.529 -179.475 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.405 HD11 HD23 ' A' ' 89' ' ' LEU . 23.7 tp -72.98 -56.06 5.68 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 120.328 -0.549 . . . . 0.0 110.242 179.403 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -54.88 -25.56 15.85 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 CA-C-O 120.9 0.381 . . . . 0.0 110.364 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 64.4 tttt -67.19 -50.64 60.21 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.576 179.83 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 88' ' ' GLU . . . . . 0.442 ' OE1' ' O ' ' A' ' 88' ' ' GLU . 1.0 OUTLIER -80.42 -19.89 45.15 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.917 -179.473 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.532 ' O ' HD13 ' A' ' 89' ' ' LEU . 0.2 OUTLIER -62.31 -44.82 95.63 Favored 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 120.549 -0.461 . . . . 0.0 110.327 -179.346 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 3.4 mt -64.28 -43.27 97.18 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 C-N-CA 120.007 -0.677 . . . . 0.0 109.991 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -47.94 -40.24 21.57 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.405 -0.362 . . . . 0.0 110.445 -179.09 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 43.1 mttm -60.02 136.29 57.97 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.991 0.424 . . . . 0.0 110.841 179.821 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -90.27 -8.96 49.63 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.192 -179.811 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 42.2 tp10 -66.45 -31.62 72.49 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.894 -0.593 . . . . 0.0 110.442 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.408 HG23 ' H ' ' A' ' 95' ' ' VAL . 21.2 t -41.7 135.48 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.298 -0.41 . . . . 0.0 109.902 -179.66 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 96' ' ' ASN . . . . . 0.491 ' O ' ' N ' ' A' ' 98' ' ' GLN . 0.9 OUTLIER -40.48 157.22 0.17 Allowed Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.07 -178.833 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 40.9 Cg_exo -45.62 -13.0 0.07 OUTLIER 'Trans proline' 0 N--CA 1.492 1.414 0 C-N-CA 122.432 2.088 . . . . 0.0 112.209 179.23 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 98' ' ' GLN . . . . . 0.491 ' N ' ' O ' ' A' ' 96' ' ' ASN . 1.9 pt20 . . . . . 0 C--N 1.322 -0.601 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.742 -179.436 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 98.7 m . . . . . 0 C--O 1.231 0.095 0 CA-C-O 120.805 0.336 . . . . 0.0 110.577 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 67.3 mm-40 -66.27 -163.38 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.139 -179.908 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 108' ' ' GLU . . . . . 0.483 ' C ' ' N ' ' A' ' 110' ' ' LEU . 97.4 mt-10 -106.73 129.12 54.66 Favored 'General case' 0 CA--C 1.516 -0.346 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.009 179.073 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 38.9 pt -50.42 -11.84 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-N 116.075 -0.511 . . . . 0.0 109.928 179.645 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.483 ' N ' ' C ' ' A' ' 108' ' ' GLU . 26.3 mt -64.41 -40.59 96.07 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.577 179.649 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -94.6 87.18 5.01 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.956 -179.895 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 50.2 m -63.24 -41.63 99.11 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.679 179.441 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 96.3 m-20 -137.18 -166.26 1.89 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.644 -179.565 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 77.8 p -64.02 -17.27 63.17 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.441 -179.832 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 84.4 mt-30 -56.13 -165.98 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.375 -179.915 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 77.0 p -83.34 -171.73 3.74 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.53 179.872 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 117' ' ' ASP . . . . . 0.424 ' N ' ' OD1' ' A' ' 117' ' ' ASP . 33.9 p-10 . . . . . 0 C--N 1.328 -0.327 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.763 -179.894 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.67 0 N-CA-C 110.972 -0.851 . . . . 0.0 110.972 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 99.4 mt-30 -64.97 -38.74 91.95 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.856 0.36 . . . . 0.0 110.601 179.857 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 4' ' ' GLU . . . . . 0.4 ' O ' ' N ' ' A' ' 7' ' ' GLN . 83.7 tt0 -52.88 -22.88 6.03 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.523 179.995 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 40.0 tp -42.12 -31.42 0.37 Allowed 'General case' 0 C--O 1.237 0.426 0 CA-C-O 121.016 0.436 . . . . 0.0 110.349 -179.625 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 70.4 m -56.34 -36.74 69.1 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.112 -0.495 . . . . 0.0 109.954 179.743 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' GLN . . . . . 0.456 ' HA ' ' HE ' ' A' ' 10' ' ' ARG . 57.6 tt0 -63.38 -34.82 78.56 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.586 179.537 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 73.6 t60 -60.29 -46.08 91.1 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.813 0.34 . . . . 0.0 110.277 -179.672 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 77.1 tt0 -61.17 -48.77 80.01 Favored 'General case' 0 C--O 1.244 0.804 0 CA-C-O 121.391 0.615 . . . . 0.0 110.288 179.552 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.456 ' HE ' ' HA ' ' A' ' 7' ' ' GLN . 85.9 mtm180 -62.47 -32.6 73.52 Favored 'General case' 0 C--O 1.213 -0.844 0 N-CA-C 108.624 -0.88 . . . . 0.0 108.624 179.462 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.433 ' CE1' HD23 ' A' ' 15' ' ' LEU . 26.4 t80 -58.68 -37.17 75.46 Favored 'General case' 0 C--N 1.324 -0.51 0 C-N-CA 120.41 -0.516 . . . . 0.0 110.186 -179.839 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 2.3 t -61.26 -50.69 79.41 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 C-N-CA 119.601 -0.84 . . . . 0.0 110.658 179.904 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 78.1 tt0 -81.66 -46.92 13.66 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 119.989 -0.684 . . . . 0.0 112.108 -179.215 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 66.4 tp60 -57.61 -52.47 65.28 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.428 -179.018 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.603 HD13 ' O ' ' A' ' 15' ' ' LEU . 0.3 OUTLIER -63.31 -45.64 90.42 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 109.619 -0.512 . . . . 0.0 109.619 -179.693 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.535 ' HB3' HG11 ' A' ' 26' ' ' VAL . 87.7 mttt -57.25 -35.2 69.43 Favored 'General case' 0 C--N 1.332 -0.182 0 C-N-CA 120.511 -0.475 . . . . 0.0 110.365 179.36 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 81.6 mm-40 -71.07 -41.89 70.11 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.071 0.462 . . . . 0.0 110.616 178.988 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.567 ' O ' HG22 ' A' ' 21' ' ' THR . . . -54.21 -45.64 72.26 Favored 'General case' 0 C--O 1.223 -0.294 0 CA-C-N 116.02 -0.536 . . . . 0.0 109.641 179.931 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.444 ' O ' ' N ' ' A' ' 22' ' ' ARG . 4.7 mt -68.03 -35.23 77.92 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.888 0.375 . . . . 0.0 110.851 178.849 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 56.1 tttm -47.37 -37.57 11.45 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 -179.424 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' THR . . . . . 0.567 HG22 ' O ' ' A' ' 18' ' ' ALA . 0.7 OUTLIER -64.56 -31.55 72.82 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.947 -0.569 . . . . 0.0 111.149 179.019 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.444 ' N ' ' O ' ' A' ' 19' ' ' LEU . 30.9 mmt-85 -73.16 21.3 0.08 Allowed 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 120.921 0.391 . . . . 0.0 110.761 -179.615 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' GLY . . . . . 0.484 ' H ' ' C ' ' A' ' 21' ' ' THR . . . 81.58 13.24 80.51 Favored Glycine 0 N--CA 1.466 0.652 0 N-CA-C 110.487 -1.045 . . . . 0.0 110.487 179.972 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.464 HG12 ' N ' ' A' ' 25' ' ' LYS . 4.3 t -92.12 167.33 1.66 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 N-CA-C 110.082 -0.34 . . . . 0.0 110.082 179.959 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.464 ' N ' HG12 ' A' ' 24' ' ' VAL . 99.1 mttt -129.52 134.49 47.8 Favored 'General case' 0 N--CA 1.455 -0.219 0 N-CA-C 110.149 -0.315 . . . . 0.0 110.149 179.64 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.535 HG11 ' HB3' ' A' ' 16' ' ' LYS . 2.6 m -132.03 105.7 10.04 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.371 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.141 179.927 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.455 ' O ' ' OD1' ' A' ' 30' ' ' ASP . 11.6 ttmt -107.99 162.08 14.35 Favored 'General case' 0 C--O 1.224 -0.276 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 179.822 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.439 ' H ' ' HG2' ' A' ' 27' ' ' LYS . 93.6 m-85 -38.83 -33.33 0.11 Allowed 'General case' 0 C--O 1.235 0.334 0 CA-C-O 121.118 0.485 . . . . 0.0 110.823 179.837 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.532 ' HA ' HD12 ' A' ' 32' ' ' LEU . . . -52.62 -23.13 5.93 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.196 179.836 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.488 ' CG ' ' N ' ' A' ' 31' ' ' LEU . 21.6 p-10 -59.03 -54.19 49.87 Favored 'General case' 0 C--O 1.217 -0.646 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.763 -179.33 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.488 ' N ' ' CG ' ' A' ' 30' ' ' ASP . 0.5 OUTLIER -63.49 -40.07 96.12 Favored 'General case' 0 C--O 1.217 -0.619 0 C-N-CA 120.439 -0.504 . . . . 0.0 109.814 -179.724 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.532 HD12 ' HA ' ' A' ' 29' ' ' ALA . 45.7 mt -56.74 -50.21 72.93 Favored 'General case' 0 C--N 1.314 -0.959 0 C-N-CA 119.267 -0.973 . . . . 0.0 111.021 -178.76 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.415 ' O ' ' N ' ' A' ' 37' ' ' PHE . 88.1 tttt -85.54 -52.77 5.61 Favored 'General case' 0 C--N 1.32 -0.68 0 C-N-CA 120.317 -0.553 . . . . 0.0 112.031 -179.295 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' PHE . . . . . 0.462 ' CB ' ' O ' ' A' ' 30' ' ' ASP . 45.1 t80 -55.2 -47.8 74.76 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.027 -178.121 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.47 ' CB ' ' O ' ' A' ' 31' ' ' LEU . 14.7 t80 -61.2 -46.62 89.69 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 120.083 -0.647 . . . . 0.0 109.513 -179.794 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 98.1 m-20 -71.22 -23.65 62.05 Favored 'General case' 0 C--N 1.345 0.401 0 C-N-CA 120.511 -0.476 . . . . 0.0 111.404 179.949 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.415 ' N ' ' O ' ' A' ' 33' ' ' LYS . 7.5 t80 -61.28 -48.06 83.14 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.849 0.357 . . . . 0.0 110.403 -178.934 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.555 ' O ' ' N ' ' A' ' 42' ' ' CYS . 6.6 m -77.85 -30.68 16.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.387 179.343 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -55.96 -30.1 61.21 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.44 -0.504 . . . . 0.0 110.545 -179.41 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 65.0 t0 -55.37 -63.97 0.99 Allowed 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 120.699 -0.4 . . . . 0.0 111.805 -179.208 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.428 ' C ' ' SG ' ' A' ' 42' ' ' CYS . 17.0 p -116.27 -19.77 10.06 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-O 120.98 0.419 . . . . 0.0 111.481 -179.559 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' CYS . . . . . 0.555 ' N ' ' O ' ' A' ' 38' ' ' VAL . 1.7 m 65.84 58.48 1.14 Allowed Pre-proline 0 CA--C 1.537 0.443 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.625 -178.461 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' PRO . . . . . 0.51 ' HD3' ' N ' ' A' ' 42' ' ' CYS . 11.8 Cg_exo -70.23 -37.35 8.17 Favored 'Trans proline' 0 N--CA 1.498 1.783 0 C-N-CA 122.891 2.394 . . . . 0.0 112.889 -179.409 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' TRP . . . . . 0.762 ' HE1' ' H ' ' A' ' 52' ' ' ASP . 0.0 OUTLIER -75.91 15.29 0.55 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.455 -179.387 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.439 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 62.1 m-85 41.57 53.65 7.47 Favored Pre-proline 0 C--N 1.332 -0.188 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.027 -179.879 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.439 ' CD ' ' N ' ' A' ' 45' ' ' PHE . 9.8 Cg_endo -52.39 -9.62 0.61 Allowed 'Trans proline' 0 C--N 1.308 -1.569 0 C-N-CA 122.803 2.335 . . . . 0.0 112.077 -179.883 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 98.3 mm-40 -64.99 -52.81 54.11 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.255 179.729 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 46.7 tp10 -87.02 -51.26 6.12 Favored 'General case' 0 N--CA 1.466 0.357 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 178.983 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 108.25 77.89 1.05 Allowed Glycine 0 CA--C 1.526 0.719 0 N-CA-C 109.619 -1.392 . . . . 0.0 109.619 -178.714 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 13.0 t -134.49 170.87 15.12 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 110.179 -0.304 . . . . 0.0 110.179 -179.106 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.1 mt -101.95 137.63 29.08 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.283 0 CA-C-O 121.027 0.441 . . . . 0.0 109.952 178.977 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' ASP . . . . . 0.762 ' H ' ' HE1' ' A' ' 44' ' ' TRP . 11.7 m-20 -117.15 121.21 40.64 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.646 -0.706 . . . . 0.0 111.377 179.807 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.497 ' CG1' HD12 ' A' ' 90' ' ' ILE . 22.9 mm -94.86 -56.14 5.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.756 179.045 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 67.7 mttm -75.86 -48.37 21.73 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-O 121.105 0.479 . . . . 0.0 111.364 -179.856 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 74.6 mtp85 -60.27 -32.46 71.2 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.253 179.898 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' TRP . . . . . 0.454 ' CE3' ' CZ3' ' A' ' 44' ' ' TRP . 22.8 t-105 -59.8 -38.8 82.94 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.133 178.727 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 85.7 mtp180 -65.22 -36.18 83.35 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 120.51 -0.476 . . . . 0.0 110.406 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 94.5 mtt180 -59.82 -50.15 74.94 Favored 'General case' 0 N--CA 1.466 0.359 0 C-N-CA 120.25 -0.58 . . . . 0.0 111.579 -179.175 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 3.2 p -64.4 -43.74 97.05 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.508 0 CA-C-O 120.809 0.337 . . . . 0.0 110.141 179.717 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -64.0 -35.51 92.09 Favored Glycine 0 CA--C 1.524 0.65 0 N-CA-C 111.072 -0.811 . . . . 0.0 111.072 179.611 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 97.3 m-20 -63.6 -36.53 84.1 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.659 0.266 . . . . 0.0 110.802 -179.694 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 63.4 m -65.58 -56.21 13.5 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 120.845 -0.342 . . . . 0.0 110.945 -179.713 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 59.4 m-85 -65.51 -37.22 86.14 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.721 179.819 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 55.8 tt0 -63.1 -40.14 96.76 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.675 -179.719 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.592 ' O ' HG23 ' A' ' 69' ' ' THR . 37.7 t0 -59.75 -51.03 71.53 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.449 -179.959 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 66' ' ' TYR . . . . . 0.469 ' O ' ' OG1' ' A' ' 69' ' ' THR . 53.8 m-85 -69.08 -33.13 73.06 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.681 179.585 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 56.2 t80 -66.69 -44.09 82.7 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.983 0.42 . . . . 0.0 110.415 -179.641 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 94.1 m-20 -64.2 -39.09 93.26 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.425 -179.237 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.592 HG23 ' O ' ' A' ' 65' ' ' ASP . 44.8 p -48.24 -28.53 3.11 Favored 'General case' 0 CA--C 1.516 -0.342 0 C-N-CA 120.766 -0.374 . . . . 0.0 110.676 -179.125 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 67.5 m-85 -69.77 -35.82 75.24 Favored 'General case' 0 C--N 1.32 -0.686 0 C-N-CA 120.283 -0.567 . . . . 0.0 111.31 179.263 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' GLY . . . . . 0.51 ' N ' ' CD ' ' A' ' 72' ' ' PRO . . . 90.65 46.4 4.0 Favored Glycine 0 CA--C 1.533 1.185 0 N-CA-C 110.64 -0.984 . . . . 0.0 110.64 -178.457 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 72' ' ' PRO . . . . . 0.531 ' O ' HG23 ' A' ' 75' ' ' VAL . 66.8 Cg_endo -75.0 128.26 11.34 Favored 'Trans proline' 0 N--CA 1.49 1.285 0 C-N-CA 122.744 2.296 . . . . 0.0 111.861 -179.671 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 80.4 mm-40 -86.77 -38.63 16.71 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.342 0.591 . . . . 0.0 111.089 -179.92 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.716 ' CD ' ' H ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -59.12 -39.52 82.55 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 115.261 -0.882 . . . . 0.0 111.559 -179.436 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.531 HG23 ' O ' ' A' ' 72' ' ' PRO . 41.6 t 20.87 90.0 0.05 OUTLIER Pre-proline 0 N--CA 1.466 0.349 0 O-C-N 124.074 0.859 . . . . 0.0 111.287 -179.972 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_exo -55.53 125.44 19.13 Favored 'Trans proline' 0 C--N 1.313 -1.307 0 C-N-CA 121.131 1.221 . . . . 0.0 111.613 -178.725 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.475 ' O ' ' N ' ' A' ' 79' ' ' ALA . 89.4 t -83.8 -18.98 9.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 115.301 -0.863 . . . . 0.0 110.638 179.663 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 71.5 p -41.94 -22.55 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.707 -178.901 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' ALA . . . . . 0.475 ' N ' ' O ' ' A' ' 77' ' ' VAL . . . -61.94 -39.0 90.6 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.251 179.711 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 38.6 t80 -61.41 -40.39 94.22 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.464 179.956 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 82.8 p -58.36 -40.33 81.94 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.709 0.29 . . . . 0.0 110.727 -179.489 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 7.5 m-85 -60.46 -50.63 72.79 Favored 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 120.745 -0.382 . . . . 0.0 110.716 179.915 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 83' ' ' TRP . . . . . . . . . . . . . 55.6 t90 -58.34 -38.34 76.96 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.604 179.938 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 87.6 m-20 -61.29 -44.86 96.51 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 120.594 -0.442 . . . . 0.0 110.838 -179.364 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 29.1 tp -73.67 -57.15 4.19 Favored 'General case' 0 N--CA 1.449 -0.478 0 C-N-CA 120.262 -0.575 . . . . 0.0 110.194 179.552 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -52.59 -26.8 10.61 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 C-N-CA 120.531 -0.468 . . . . 0.0 110.454 179.667 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 63.7 tttt -66.81 -50.32 63.0 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.976 -0.557 . . . . 0.0 110.78 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 88' ' ' GLU . . . . . 0.413 ' OE1' ' O ' ' A' ' 88' ' ' GLU . 1.2 pp20? -80.02 -20.24 45.83 Favored 'General case' 0 C--N 1.319 -0.738 0 C-N-CA 120.302 -0.559 . . . . 0.0 110.899 -179.396 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.533 ' O ' HD13 ' A' ' 89' ' ' LEU . 0.2 OUTLIER -62.16 -46.94 86.73 Favored 'General case' 0 N--CA 1.447 -0.613 0 C-N-CA 120.72 -0.392 . . . . 0.0 110.324 -178.865 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.497 HD12 ' CG1' ' A' ' 53' ' ' ILE . 3.3 mt -63.79 -43.43 97.93 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.141 0 C-N-CA 120.121 -0.632 . . . . 0.0 109.695 -179.821 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 96.2 m-20 -48.92 -44.86 40.73 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.56 -178.817 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 95.0 mttt -64.35 147.9 51.56 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.933 0.397 . . . . 0.0 110.759 179.599 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 69.8 mmtt -81.63 8.0 10.89 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.261 -179.83 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 80.5 tt0 -61.11 -33.81 73.97 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.128 179.801 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.46 ' H ' HG22 ' A' ' 95' ' ' VAL . 2.9 m -67.89 137.39 24.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.284 -0.417 . . . . 0.0 110.184 179.872 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 96' ' ' ASN . . . . . 0.487 ' ND2' ' N ' ' A' ' 96' ' ' ASN . 0.0 OUTLIER -81.07 176.23 4.04 Favored Pre-proline 0 C--N 1.328 -0.354 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.93 -179.369 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_exo -57.95 -13.32 14.76 Favored 'Trans proline' 0 N--CA 1.495 1.606 0 C-N-CA 122.551 2.168 . . . . 0.0 112.268 179.428 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 6.0 pt20 . . . . . 0 C--N 1.322 -0.605 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.785 -179.577 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 89.7 m . . . . . 0 C--O 1.232 0.168 0 CA-C-O 120.807 0.337 . . . . 0.0 110.248 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 86.3 mt-10 -77.98 172.64 13.19 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.244 -179.557 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 108' ' ' GLU . . . . . 0.481 ' O ' ' N ' ' A' ' 110' ' ' LEU . 94.8 mt-10 -106.2 124.42 49.56 Favored 'General case' 0 CA--C 1.513 -0.451 0 N-CA-C 109.85 -0.426 . . . . 0.0 109.85 179.129 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 45.7 pt -48.66 -13.16 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.971 179.76 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.481 ' N ' ' O ' ' A' ' 108' ' ' GLU . 33.0 mt -65.25 -42.22 93.5 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.596 179.778 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -69.01 -38.64 79.34 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.929 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 60.2 m -58.86 -43.63 90.88 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.835 -179.369 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 24.4 t-20 -66.76 -43.4 84.17 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.473 179.848 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 99.7 p -165.73 156.37 13.34 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.42 179.686 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 87.3 mt-30 -100.96 11.81 38.89 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.767 0.318 . . . . 0.0 110.567 179.81 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 41.0 p -65.58 -35.87 82.11 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.803 -179.797 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 55.2 m-20 . . . . . 0 C--N 1.329 -0.291 0 CA-C-N 116.467 -0.333 . . . . 0.0 110.281 -179.714 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.653 0 N-CA-C 110.912 -0.875 . . . . 0.0 110.912 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 84.5 mt-30 -64.03 -38.73 92.14 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.791 0.329 . . . . 0.0 110.559 -179.998 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 4' ' ' GLU . . . . . 0.492 ' O ' ' N ' ' A' ' 7' ' ' GLN . 92.8 mt-10 -55.79 -21.29 18.55 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.567 -179.852 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 46.5 tp -40.63 -37.22 0.7 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.546 179.951 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 82.5 p -55.72 -38.0 69.18 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.578 179.366 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' GLN . . . . . 0.492 ' N ' ' O ' ' A' ' 4' ' ' GLU . 85.6 mt-30 -65.96 -30.58 71.18 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.523 179.798 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 59.3 t-80 -61.1 -43.69 98.49 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.557 179.695 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -62.11 -43.27 99.21 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.614 179.251 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.502 ' O ' ' CB ' ' A' ' 14' ' ' GLN . 89.1 mtt-85 -65.93 -33.89 76.87 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.54 178.889 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.467 ' O ' ' CB ' ' A' ' 15' ' ' LEU . 0.1 OUTLIER -57.69 -43.2 84.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.609 -179.488 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 2.2 t -60.43 -52.31 62.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.546 -178.649 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 80.9 tt0 -78.16 -46.54 20.31 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.545 -178.683 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' GLN . . . . . 0.502 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 65.1 tp60 -59.29 -46.73 87.75 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.594 -178.423 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.793 ' C ' HD13 ' A' ' 15' ' ' LEU . 3.4 tm? -62.37 -51.25 68.33 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.562 -179.159 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -61.19 -37.15 81.95 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.558 -179.522 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 76.0 mt-30 -66.51 -40.3 89.13 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.557 177.832 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.512 ' O ' HG23 ' A' ' 21' ' ' THR . . . -63.04 -19.28 64.23 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.591 178.676 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.484 ' CD1' ' CE2' ' A' ' 82' ' ' TYR . 9.1 mt -86.59 -35.66 19.32 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.597 178.229 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 96.6 mttt -55.03 -42.26 72.4 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.543 -179.702 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' THR . . . . . 0.512 HG23 ' O ' ' A' ' 18' ' ' ALA . 0.5 OUTLIER -63.09 -29.2 70.62 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.597 -179.73 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 75.0 mmt-85 -71.91 -7.33 47.86 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.582 179.462 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 105.82 23.96 7.21 Favored Glycine 0 CA--C 1.524 0.641 0 N-CA-C 110.92 -0.872 . . . . 0.0 110.92 179.854 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.643 HG12 ' N ' ' A' ' 25' ' ' LYS . 34.7 t -103.4 168.61 2.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 120.809 0.337 . . . . 0.0 110.579 179.839 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.643 ' N ' HG12 ' A' ' 24' ' ' VAL . 49.1 tttp -130.46 110.56 11.55 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.541 178.807 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.423 ' CG1' ' OD2' ' A' ' 30' ' ' ASP . 2.1 t -128.3 90.56 1.52 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.603 -179.391 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 19.2 pttt -78.56 166.55 22.43 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.555 179.416 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 87.7 m-85 -47.84 -35.69 10.68 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.588 179.812 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -48.98 -22.16 0.81 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.577 179.057 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.465 ' O ' ' CB ' ' A' ' 34' ' ' PHE . 20.3 t0 -66.62 -41.5 88.25 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.511 -179.56 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.541 ' O ' ' CB ' ' A' ' 35' ' ' PHE . 4.0 mp -61.45 -40.82 95.89 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.556 179.217 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 32.5 mt -62.28 -48.01 81.78 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.557 -179.014 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 82.0 tttt -84.82 -53.97 4.99 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.608 -177.469 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' PHE . . . . . 0.465 ' CB ' ' O ' ' A' ' 30' ' ' ASP . 35.4 t80 -56.94 -52.03 66.83 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.597 -177.434 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.541 ' CB ' ' O ' ' A' ' 31' ' ' LEU . 5.5 t80 -61.55 -45.79 92.69 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.534 -177.85 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 91.1 m-20 -65.72 -32.81 74.56 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.585 -179.08 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -65.85 -49.81 66.81 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.533 -178.831 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.605 ' O ' ' N ' ' A' ' 42' ' ' CYS . 26.9 m -72.08 -36.28 56.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.532 -179.037 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -61.97 -29.2 70.09 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.541 -179.354 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 97.5 m-20 -57.99 -47.49 82.85 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.55 -179.148 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.474 ' O ' ' C ' ' A' ' 42' ' ' CYS . 82.7 p -113.9 0.1 14.32 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.59 -178.91 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' CYS . . . . . 0.605 ' N ' ' O ' ' A' ' 38' ' ' VAL . 26.0 p 33.78 61.02 1.86 Allowed Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.595 -179.494 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' PRO . . . . . 0.404 ' HD3' ' N ' ' A' ' 42' ' ' CYS . 58.0 Cg_endo -78.43 -36.61 0.89 Allowed 'Trans proline' 0 C--N 1.305 -1.721 0 C-N-CA 122.816 2.344 . . . . 0.0 112.133 -179.256 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 44' ' ' TRP . . . . . 0.791 ' HE1' ' H ' ' A' ' 52' ' ' ASP . 0.0 OUTLIER -71.73 -2.01 15.94 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.565 -179.755 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.576 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 69.0 m-85 58.1 47.5 2.22 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.58 -179.677 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.576 ' CD ' ' N ' ' A' ' 45' ' ' PHE . 46.9 Cg_exo -38.48 -19.0 0.04 OUTLIER 'Trans proline' 0 C--N 1.305 -1.725 0 C-N-CA 122.837 2.358 . . . . 0.0 112.112 178.248 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.564 ' N ' ' O ' ' A' ' 45' ' ' PHE . 86.5 mt-30 -65.85 -53.64 37.21 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.601 -178.468 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -86.09 -15.77 40.15 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.544 -179.861 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 64.76 84.24 0.08 OUTLIER Glycine 0 CA--C 1.525 0.661 0 N-CA-C 110.97 -0.852 . . . . 0.0 110.97 -179.746 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' THR . . . . . 0.412 ' HA ' HE21 ' A' ' 98' ' ' GLN . 14.8 t -145.33 171.29 14.8 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.816 0.341 . . . . 0.0 110.537 -179.284 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.2 mt -104.85 134.3 46.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.57 179.277 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' ASP . . . . . 0.791 ' H ' ' HE1' ' A' ' 44' ' ' TRP . 1.7 m-20 -111.93 121.94 46.39 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.536 -179.764 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.439 ' CG1' HD12 ' A' ' 90' ' ' ILE . 33.4 mm -94.6 -56.17 5.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.591 179.578 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -74.99 -51.56 13.34 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.566 -179.391 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.432 ' HA ' ' HE ' ' A' ' 58' ' ' ARG . 84.5 mtt85 -59.26 -29.75 67.78 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.553 -179.042 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 56' ' ' TRP . . . . . 0.585 ' CE3' ' CH2' ' A' ' 44' ' ' TRP . 24.9 t-105 -63.44 -36.96 85.46 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.529 178.923 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 79.3 mtp85 -64.96 -35.37 80.96 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.565 179.217 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' ARG . . . . . 0.432 ' HE ' ' HA ' ' A' ' 55' ' ' ARG . 69.8 mtm180 -60.11 -52.59 64.67 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.621 -179.466 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 2.8 p -65.44 -33.35 63.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.612 -179.86 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -71.22 -38.97 62.94 Favored Glycine 0 CA--C 1.525 0.689 0 N-CA-C 110.944 -0.862 . . . . 0.0 110.944 179.932 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 56.0 t0 -63.36 -48.75 76.65 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.792 0.329 . . . . 0.0 110.554 -179.627 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 99.8 m -64.06 -46.59 83.68 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.553 -179.863 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 6.3 m-85 -63.79 -31.65 72.9 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.6 179.767 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 70.8 tp60 -61.57 -40.22 93.95 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.514 179.647 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 20.6 t0 -63.19 -52.03 63.97 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.561 179.583 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' TYR . . . . . 0.461 ' O ' ' OG1' ' A' ' 69' ' ' THR . 68.8 m-85 -66.81 -32.06 73.1 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.579 179.743 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 63.9 t80 -60.41 -43.37 96.76 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.525 179.388 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 99.0 m-20 -65.65 -38.68 90.03 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.526 -179.863 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.461 ' OG1' ' O ' ' A' ' 66' ' ' TYR . 62.0 p -64.91 -22.59 67.02 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.568 -179.571 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -72.21 -42.58 65.61 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.561 179.938 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 71' ' ' GLY . . . . . 0.531 ' H ' ' HD3' ' A' ' 72' ' ' PRO . . . 110.24 72.34 0.69 Allowed Glycine 0 CA--C 1.525 0.715 0 N-CA-C 110.925 -0.87 . . . . 0.0 110.925 179.139 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 72' ' ' PRO . . . . . 0.531 ' HD3' ' H ' ' A' ' 71' ' ' GLY . 16.4 Cg_exo -67.4 147.28 77.33 Favored 'Trans proline' 0 C--N 1.305 -1.728 0 C-N-CA 122.746 2.297 . . . . 0.0 112.124 178.108 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 99.1 mt-10 -76.92 -51.13 11.74 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.546 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.527 ' HD3' ' H ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -140.44 5.59 2.05 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.547 -179.609 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 55.5 t 56.46 91.69 0.07 OUTLIER Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.57 -179.808 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_exo -55.26 122.64 12.08 Favored 'Trans proline' 0 C--N 1.305 -1.732 0 C-N-CA 122.845 2.363 . . . . 0.0 112.146 -179.011 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.44 ' O ' HG12 ' A' ' 77' ' ' VAL . 98.0 t -86.25 -13.49 10.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.539 -179.536 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 81.0 p -44.01 -23.74 0.11 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.601 -179.587 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' ALA . . . . . 0.401 ' N ' ' O ' ' A' ' 77' ' ' VAL . . . -55.41 -40.61 71.65 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.61 179.794 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 41.1 t80 -63.02 -38.35 90.83 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.604 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 19.6 m -59.05 -41.86 88.93 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.6 -179.511 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 82' ' ' TYR . . . . . 0.484 ' CE2' ' CD1' ' A' ' 19' ' ' LEU . 13.0 m-85 -59.66 -51.65 68.89 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.533 -179.952 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 83' ' ' TRP . . . . . 0.431 ' O ' ' CB ' ' A' ' 87' ' ' LYS . 80.9 t90 -56.66 -40.25 75.16 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.522 -179.69 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 71.8 m-20 -59.92 -46.37 89.58 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.542 -179.883 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.407 ' O ' ' HG3' ' A' ' 88' ' ' GLU . 26.1 tp -71.8 -63.34 1.15 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.57 179.674 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -47.57 -26.77 1.06 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.584 179.11 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.431 ' CB ' ' O ' ' A' ' 83' ' ' TRP . 59.6 tttt -68.03 -49.97 58.22 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.564 -179.536 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 88' ' ' GLU . . . . . 0.488 ' OE1' ' O ' ' A' ' 88' ' ' GLU . 1.0 OUTLIER -79.74 -19.59 48.39 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.565 -179.924 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.586 ' O ' HD13 ' A' ' 89' ' ' LEU . 0.2 OUTLIER -60.92 -49.15 78.61 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.573 -179.509 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.439 HD12 ' CG1' ' A' ' 53' ' ' ILE . 3.1 mt -63.66 -42.6 96.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.53 179.726 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 65.0 t0 -57.16 -45.87 83.24 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.555 -178.931 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 78.8 mttt -57.12 136.79 56.39 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.568 -179.546 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 58.6 mttp -69.81 -4.34 19.64 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.582 179.857 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -73.4 47.65 0.23 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.573 -179.871 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 21.4 m -121.82 163.98 19.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.581 179.81 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 96' ' ' ASN . . . . . 0.459 ' CB ' ' CD ' ' A' ' 97' ' ' PRO . 0.0 OUTLIER -97.31 176.75 1.92 Allowed Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.58 -179.896 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 97' ' ' PRO . . . . . 0.459 ' CD ' ' CB ' ' A' ' 96' ' ' ASN . 37.9 Cg_exo -59.55 -22.49 66.9 Favored 'Trans proline' 0 C--N 1.305 -1.744 0 C-N-CA 122.839 2.359 . . . . 0.0 112.109 179.688 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 98' ' ' GLN . . . . . 0.412 HE21 ' HA ' ' A' ' 50' ' ' THR . 5.7 pt20 . . . . . 0 C--N 1.329 -0.317 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.579 -179.766 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 98.0 m . . . . . 0 C--O 1.231 0.08 0 CA-C-O 120.828 0.347 . . . . 0.0 110.573 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 107' ' ' GLU . . . . . 0.436 ' OE2' ' O ' ' A' ' 113' ' ' ASN . 90.2 mt-10 -74.95 -178.27 3.69 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.547 -179.813 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 108' ' ' GLU . . . . . 0.553 ' C ' ' H ' ' A' ' 110' ' ' LEU . 80.7 mm-40 -102.87 128.56 49.6 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.571 179.256 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 40.7 pt -56.37 -0.78 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.613 -179.803 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.553 ' H ' ' C ' ' A' ' 108' ' ' GLU . 94.9 mt -89.33 -2.33 58.4 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.592 179.969 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 84.6 tttt -141.8 154.44 45.21 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.555 -179.747 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 5.5 p -60.69 173.3 0.76 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.546 -179.791 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 113' ' ' ASN . . . . . 0.436 ' O ' ' OE2' ' A' ' 107' ' ' GLU . 70.6 m-20 -62.45 -38.5 90.01 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.566 -179.628 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 114' ' ' SER . . . . . 0.483 ' O ' ' O ' ' A' ' 115' ' ' GLN . 11.6 m -68.77 138.82 55.14 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.599 -179.705 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 115' ' ' GLN . . . . . 0.483 ' O ' ' O ' ' A' ' 114' ' ' SER . 82.7 mt-30 56.95 148.57 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.556 -179.624 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 116' ' ' THR . . . . . 0.481 ' O ' ' C ' ' A' ' 117' ' ' ASP . 21.5 p -84.17 170.59 13.63 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.581 179.472 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 117' ' ' ASP . . . . . 0.481 ' C ' ' O ' ' A' ' 116' ' ' THR . 58.6 t0 . . . . . 0 C--N 1.329 -0.306 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.588 179.894 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.632 0 N-CA-C 111.104 -0.798 . . . . 0.0 111.104 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 88.6 mt-30 -58.94 -31.39 68.65 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.874 0.368 . . . . 0.0 110.407 -179.723 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 69.7 mm-40 -65.32 -24.53 67.3 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.681 179.545 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 37.4 tp -43.06 -33.08 0.77 Allowed 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.245 0.545 . . . . 0.0 110.307 -179.553 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 68.1 m -53.67 -41.27 66.69 Favored 'General case' 0 C--N 1.324 -0.526 0 C-N-CA 120.486 -0.486 . . . . 0.0 110.123 179.912 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' GLN . . . . . 0.467 ' OE1' ' CG ' ' A' ' 97' ' ' PRO . 86.6 mt-30 -61.93 -34.16 75.58 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.827 179.703 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 73.9 t60 -57.1 -41.81 79.6 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.974 0.416 . . . . 0.0 109.952 -179.982 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 96.2 mt-10 -62.5 -43.38 98.95 Favored 'General case' 0 C--O 1.238 0.482 0 C-N-CA 120.357 -0.537 . . . . 0.0 110.026 179.566 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.446 ' O ' ' CB ' ' A' ' 14' ' ' GLN . 62.6 mtp180 -65.16 -33.18 75.39 Favored 'General case' 0 C--O 1.208 -1.096 0 CA-C-N 116.038 -0.528 . . . . 0.0 109.58 179.668 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -58.4 -44.6 89.04 Favored 'General case' 0 C--N 1.322 -0.588 0 C-N-CA 120.77 -0.372 . . . . 0.0 110.62 -179.54 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 13.4 t -61.62 -48.83 86.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 C-N-CA 120.433 -0.507 . . . . 0.0 111.892 -179.863 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.414 ' OE2' HD11 ' A' ' 31' ' ' LEU . 70.0 mm-40 -76.02 -41.79 49.89 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.291 0.567 . . . . 0.0 111.428 -179.649 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 14' ' ' GLN . . . . . 0.446 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 66.6 tp60 -62.07 -50.4 72.11 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.498 -179.189 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.57 HD13 ' O ' ' A' ' 15' ' ' LEU . 0.3 OUTLIER -63.97 -49.17 73.58 Favored 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 120.303 -0.559 . . . . 0.0 109.99 179.828 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 94.9 mttt -58.93 -34.44 71.74 Favored 'General case' 0 C--N 1.324 -0.525 0 C-N-CA 120.707 -0.397 . . . . 0.0 110.729 -179.683 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 91.1 mt-30 -78.58 -36.2 44.79 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.864 179.633 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -56.39 -34.63 66.89 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.932 -0.576 . . . . 0.0 109.929 -179.749 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.472 ' O ' ' N ' ' A' ' 22' ' ' ARG . 3.7 mt -85.16 -35.06 21.96 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.156 0.503 . . . . 0.0 110.461 179.231 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 65.1 tttm -45.95 -41.68 11.94 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.478 -178.642 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' THR . . . . . 0.404 ' H ' HG22 ' A' ' 21' ' ' THR . 0.2 OUTLIER -75.71 -16.06 60.21 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.747 -179.942 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.472 ' N ' ' O ' ' A' ' 19' ' ' LEU . 86.2 mmt-85 -83.56 13.21 4.74 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 120.828 0.347 . . . . 0.0 110.28 -179.881 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 97.32 4.94 58.24 Favored Glycine 0 CA--C 1.522 0.512 0 N-CA-C 110.915 -0.874 . . . . 0.0 110.915 179.671 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.599 HG12 ' N ' ' A' ' 25' ' ' LYS . 15.7 t -93.5 169.33 1.38 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 C-N-CA 121.094 -0.242 . . . . 0.0 110.469 -179.798 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.599 ' N ' HG12 ' A' ' 24' ' ' VAL . 99.4 mttt -134.41 134.46 41.66 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.24 179.654 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 8.9 m -131.03 129.86 63.53 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.288 0 CA-C-N 116.601 -0.272 . . . . 0.0 110.268 179.812 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.4 ' HD2' ' HB3' ' A' ' 29' ' ' ALA . 16.0 pttp -110.13 163.59 13.45 Favored 'General case' 0 C--O 1.226 -0.134 0 CA-C-O 120.652 0.263 . . . . 0.0 110.585 179.771 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 98.0 m-85 -56.51 -34.75 67.3 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.021 0.439 . . . . 0.0 110.267 179.858 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.512 ' HA ' HD12 ' A' ' 32' ' ' LEU . . . -51.93 -23.32 4.8 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.236 179.708 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.487 ' O ' ' CB ' ' A' ' 34' ' ' PHE . 97.3 m-20 -62.2 -49.99 73.59 Favored 'General case' 0 C--O 1.219 -0.531 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.311 -179.547 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.433 ' O ' ' CB ' ' A' ' 35' ' ' PHE . 3.7 mp -63.32 -38.3 90.63 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 121.224 0.535 . . . . 0.0 109.837 179.565 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.512 HD12 ' HA ' ' A' ' 29' ' ' ALA . 42.9 mt -61.1 -51.32 69.63 Favored 'General case' 0 C--N 1.308 -1.199 0 C-N-CA 119.106 -1.038 . . . . 0.0 111.435 -179.068 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.408 ' O ' ' OD1' ' A' ' 36' ' ' ASP . 87.1 tttt -88.07 -54.18 4.35 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 112.864 0.691 . . . . 0.0 112.864 -178.287 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' PHE . . . . . 0.487 ' CB ' ' O ' ' A' ' 30' ' ' ASP . 9.7 t80 -53.48 -47.75 69.52 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.427 -178.093 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.433 ' CB ' ' O ' ' A' ' 31' ' ' LEU . 1.1 t80 -62.89 -48.88 77.07 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 120.348 -0.541 . . . . 0.0 110.341 179.978 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' ASP . . . . . 0.408 ' OD1' ' O ' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -62.94 -34.3 77.19 Favored 'General case' 0 C--O 1.234 0.282 0 C-N-CA 119.554 -0.858 . . . . 0.0 111.816 -179.052 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.439 ' O ' ' OG1' ' A' ' 41' ' ' THR . 3.2 t80 -62.15 -47.12 85.94 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.226 -178.734 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.505 ' O ' ' N ' ' A' ' 42' ' ' CYS . 29.8 m -71.17 -26.27 26.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.528 -179.47 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 24.4 mttt -61.22 -45.55 94.11 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 120.465 -0.494 . . . . 0.0 110.89 -179.584 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 89.3 m-20 -75.88 -50.55 14.74 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 120.549 -0.46 . . . . 0.0 111.41 -179.835 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.439 ' OG1' ' O ' ' A' ' 37' ' ' PHE . 1.6 p -70.27 -34.74 73.16 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.443 -179.501 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' CYS . . . . . 0.505 ' N ' ' O ' ' A' ' 38' ' ' VAL . 48.6 m 47.09 53.14 13.36 Favored Pre-proline 0 C--N 1.331 -0.219 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.416 -178.45 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' PRO . . . . . 0.464 ' HD3' ' N ' ' A' ' 42' ' ' CYS . 68.6 Cg_endo -79.22 -33.21 1.48 Allowed 'Trans proline' 0 N--CA 1.488 1.165 0 C-N-CA 122.507 2.138 . . . . 0.0 112.463 -179.608 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' TRP . . . . . 0.676 ' HE1' ' H ' ' A' ' 52' ' ' ASP . 0.0 OUTLIER -87.86 20.12 3.21 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.971 -179.27 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.428 ' C ' ' H ' ' A' ' 47' ' ' GLN . 59.4 m-85 48.21 59.61 16.58 Favored Pre-proline 0 C--N 1.33 -0.277 0 C-N-CA 120.455 -0.498 . . . . 0.0 109.972 179.917 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo -51.82 -7.76 0.25 Allowed 'Trans proline' 0 C--N 1.312 -1.371 0 C-N-CA 122.893 2.395 . . . . 0.0 112.333 179.867 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.428 ' H ' ' C ' ' A' ' 45' ' ' PHE . 87.8 mt-30 -71.32 -54.37 11.04 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.635 -179.849 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -88.76 -28.59 20.39 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.576 179.254 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 79.12 66.8 1.66 Allowed Glycine 0 CA--C 1.525 0.696 0 N-CA-C 110.661 -0.976 . . . . 0.0 110.661 -179.615 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 15.3 t -127.93 169.13 14.32 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.827 0.346 . . . . 0.0 111.012 -179.361 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.2 mt -98.88 132.08 44.85 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.253 0 CA-C-N 116.094 -0.503 . . . . 0.0 109.901 179.418 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' ASP . . . . . 0.676 ' H ' ' HE1' ' A' ' 44' ' ' TRP . 5.6 t0 -116.54 119.08 34.46 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.008 179.012 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 17.8 mm -82.98 -25.41 8.13 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.035 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -85.81 -57.18 3.15 Favored 'General case' 0 C--O 1.239 0.523 0 CA-C-O 121.471 0.653 . . . . 0.0 111.442 -179.116 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 95.7 mtt-85 -60.72 -33.27 72.64 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.396 -179.342 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' TRP . . . . . 0.629 ' CE3' ' CH2' ' A' ' 44' ' ' TRP . 34.2 t-105 -57.85 -37.7 74.35 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.114 0.483 . . . . 0.0 110.265 179.96 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 85.0 mtp180 -64.58 -37.94 89.3 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.183 179.79 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 41.2 ttm180 -60.95 -51.62 68.51 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 120.447 -0.501 . . . . 0.0 111.049 -179.551 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 6.9 p -68.85 -38.43 78.69 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.425 0 CA-C-O 120.896 0.379 . . . . 0.0 110.218 179.404 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -64.5 -39.05 96.53 Favored Glycine 0 CA--C 1.525 0.68 0 N-CA-C 111.135 -0.786 . . . . 0.0 111.135 179.689 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' ASP . . . . . 0.422 ' O ' ' OD1' ' A' ' 61' ' ' ASP . 64.0 t0 -62.64 -38.29 89.69 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.876 0.369 . . . . 0.0 110.326 -179.962 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 75.8 m -61.95 -38.42 88.44 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.447 -179.893 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 5.5 m-85 -62.71 -37.75 87.73 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.358 179.89 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 57.6 tt0 -63.11 -42.1 99.5 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.963 -179.898 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 62.2 t0 -60.22 -52.0 67.17 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.055 0.455 . . . . 0.0 110.456 -179.925 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 55.0 m-85 -62.2 -39.52 93.02 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.414 179.811 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 9.8 t80 -62.1 -40.53 96.18 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.291 179.818 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 88.3 m-20 -57.33 -32.72 67.0 Favored 'General case' 0 CA--C 1.518 -0.269 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.046 -179.27 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 25.0 p -65.64 -20.47 66.31 Favored 'General case' 0 C--N 1.317 -0.816 0 C-N-CA 119.748 -0.781 . . . . 0.0 110.034 179.281 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 69.7 m-85 -107.34 -51.45 2.91 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 116.024 -0.534 . . . . 0.0 112.399 -179.738 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -142.46 78.11 0.28 Allowed Glycine 0 CA--C 1.539 1.54 0 N-CA-C 111.074 -0.811 . . . . 0.0 111.074 -179.292 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' PRO . . . . . 0.412 ' O ' HG23 ' A' ' 75' ' ' VAL . 56.8 Cg_endo -75.98 -16.14 18.26 Favored 'Trans proline' 0 C--N 1.298 -2.093 0 C-N-CA 122.831 2.354 . . . . 0.0 111.735 -179.672 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 77.4 mm-40 -89.47 -38.39 14.09 Favored 'General case' 0 CA--C 1.505 -0.774 0 CA-C-O 121.567 0.699 . . . . 0.0 110.585 179.798 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 51.5 mmtt -65.48 -46.09 81.1 Favored 'General case' 0 C--N 1.308 -1.213 0 CA-C-N 114.82 -1.082 . . . . 0.0 111.123 -178.199 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.555 ' O ' HG12 ' A' ' 75' ' ' VAL . 54.6 t 38.51 84.06 0.19 Allowed Pre-proline 0 N--CA 1.451 -0.406 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.115 179.492 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_exo -55.41 126.86 23.92 Favored 'Trans proline' 0 C--N 1.311 -1.436 0 C-N-CA 121.925 1.75 . . . . 0.0 111.373 -179.629 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 58.0 t -82.08 -17.17 11.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.513 -179.936 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 22.6 p -48.19 -26.46 1.93 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.176 -179.35 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.27 -41.24 98.3 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.179 0.514 . . . . 0.0 110.583 179.661 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 8.4 m-85 -62.69 -37.31 85.96 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.346 179.829 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 59.9 m -58.58 -40.62 83.68 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.309 179.745 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 5.1 m-85 -59.67 -50.83 72.34 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.722 -179.675 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 83' ' ' TRP . . . . . 0.539 ' N ' ' CD1' ' A' ' 83' ' ' TRP . 6.1 m0 -59.8 -38.26 81.41 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.595 -179.881 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 92.9 m-20 -62.09 -45.28 94.18 Favored 'General case' 0 C--N 1.325 -0.457 0 C-N-CA 120.581 -0.447 . . . . 0.0 110.79 -179.339 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 56.7 tp -71.91 -53.99 11.42 Favored 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 120.341 -0.544 . . . . 0.0 110.5 179.87 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -58.54 -25.16 27.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 C-N-CA 120.766 -0.374 . . . . 0.0 110.483 179.884 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.401 ' CB ' ' O ' ' A' ' 83' ' ' TRP . 67.1 tttt -65.39 -50.24 66.25 Favored 'General case' 0 C--N 1.321 -0.672 0 C-N-CA 120.348 -0.541 . . . . 0.0 110.306 -179.79 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 88' ' ' GLU . . . . . 0.415 ' OE1' ' O ' ' A' ' 88' ' ' GLU . 1.0 OUTLIER -80.54 -20.84 42.59 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.782 -179.912 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.412 HD12 ' HA ' ' A' ' 89' ' ' LEU . 12.4 tp -62.15 -45.16 94.64 Favored 'General case' 0 N--CA 1.448 -0.57 0 C-N-CA 120.316 -0.554 . . . . 0.0 110.438 -178.686 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.482 ' O ' ' N ' ' A' ' 92' ' ' LYS . 2.9 mt -65.02 -43.63 96.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 C-N-CA 120.334 -0.547 . . . . 0.0 109.955 179.943 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 98.0 m-20 -47.03 -14.06 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.791 -178.199 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 92' ' ' LYS . . . . . 0.482 ' N ' ' O ' ' A' ' 90' ' ' ILE . 86.4 tttt -68.58 133.9 49.2 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.371 179.92 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -64.46 -41.41 96.53 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.942 -179.939 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 99.1 mt-10 -105.79 55.17 0.68 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.053 -179.664 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.515 ' O ' ' ND2' ' A' ' 96' ' ' ASN . 6.9 t -45.27 -75.48 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.497 -179.476 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 96' ' ' ASN . . . . . 0.515 ' ND2' ' O ' ' A' ' 95' ' ' VAL . 0.9 OUTLIER -153.74 160.54 30.82 Favored Pre-proline 0 C--N 1.326 -0.431 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.738 179.979 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 97' ' ' PRO . . . . . 0.467 ' CG ' ' OE1' ' A' ' 7' ' ' GLN . 16.3 Cg_endo -56.83 -11.89 8.07 Favored 'Trans proline' 0 N--CA 1.495 1.602 0 C-N-CA 122.959 2.439 . . . . 0.0 112.059 178.751 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 98' ' ' GLN . . . . . 0.435 HE21 ' HB3' ' A' ' 98' ' ' GLN . 0.2 OUTLIER . . . . . 0 C--N 1.322 -0.597 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.999 -179.758 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 106' ' ' THR . . . . . 0.415 ' O ' ' O ' ' A' ' 107' ' ' GLU . 4.9 t . . . . . 0 C--O 1.231 0.08 0 CA-C-O 120.874 0.368 . . . . 0.0 110.634 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 107' ' ' GLU . . . . . 0.415 ' O ' ' O ' ' A' ' 106' ' ' THR . 75.4 mm-40 44.39 -169.37 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.343 179.856 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 108' ' ' GLU . . . . . 0.513 ' O ' ' N ' ' A' ' 110' ' ' LEU . 93.0 mt-10 -109.07 122.16 46.67 Favored 'General case' 0 CA--C 1.515 -0.393 0 N-CA-C 109.697 -0.483 . . . . 0.0 109.697 179.387 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 44.0 pt -47.69 -12.43 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.14 179.573 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.513 ' N ' ' O ' ' A' ' 108' ' ' GLU . 31.5 mt -66.25 -41.95 89.25 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.812 179.615 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -66.12 -36.0 81.98 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.479 -179.899 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 45.9 m -57.7 -45.44 85.68 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.684 -179.289 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 29.6 t30 -65.56 -43.33 90.2 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.637 179.676 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 20.8 m -166.06 150.94 8.28 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.559 179.663 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 87.4 mt-30 -91.09 18.8 6.35 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.487 179.715 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 15.3 p -60.16 -47.42 85.99 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.495 -179.809 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 94.8 m-20 . . . . . 0 C--N 1.33 -0.268 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.539 179.684 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.875 0 N-CA-C 111.142 -0.783 . . . . 0.0 111.142 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 87.1 mt-30 -59.3 -27.05 65.51 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.952 0.406 . . . . 0.0 110.389 -179.925 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 82.2 tt0 -53.9 -21.48 7.9 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.613 179.862 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 34.5 tp -40.19 -29.59 0.08 Allowed 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 120.959 0.409 . . . . 0.0 110.418 -179.321 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 78.3 p -55.38 -38.6 69.07 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 120.586 -0.446 . . . . 0.0 110.078 179.947 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 99.7 mm-40 -62.28 -37.23 84.71 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.585 179.64 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 75.1 t60 -57.24 -42.29 81.21 Favored 'General case' 0 C--N 1.332 -0.169 0 N-CA-C 109.91 -0.404 . . . . 0.0 109.91 -179.854 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 81.2 mm-40 -60.11 -45.63 92.32 Favored 'General case' 0 C--O 1.243 0.726 0 CA-C-O 121.208 0.528 . . . . 0.0 109.873 179.318 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.415 ' O ' ' CB ' ' A' ' 14' ' ' GLN . 70.3 mtp180 -64.87 -33.34 75.78 Favored 'General case' 0 C--O 1.212 -0.912 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 179.327 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.574 ' CE1' HD23 ' A' ' 15' ' ' LEU . 49.0 t80 -59.37 -38.17 79.78 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 120.217 -0.593 . . . . 0.0 110.3 -179.295 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 3.4 t -62.07 -50.01 81.8 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 C-N-CA 119.774 -0.77 . . . . 0.0 111.37 179.974 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 97.3 mt-10 -79.38 -35.86 40.12 Favored 'General case' 0 C--N 1.322 -0.587 0 C-N-CA 120.232 -0.587 . . . . 0.0 112.061 -179.082 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' GLN . . . . . 0.415 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 66.2 tp60 -68.71 -51.68 39.04 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.527 -179.005 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.574 HD23 ' CE1' ' A' ' 11' ' ' TYR . 0.2 OUTLIER -63.35 -46.43 86.62 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.343 -179.518 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -57.76 -31.95 67.0 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 178.838 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 49.2 tt0 -75.24 -39.45 59.92 Favored 'General case' 0 C--O 1.239 0.552 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.198 178.879 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.417 ' O ' HG23 ' A' ' 21' ' ' THR . . . -58.07 -25.06 60.79 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-N 115.933 -0.576 . . . . 0.0 109.725 179.536 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.448 ' O ' ' N ' ' A' ' 22' ' ' ARG . 3.7 mt -85.36 -40.73 16.17 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.199 178.581 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 92.9 mttt -43.24 -45.69 5.86 Favored 'General case' 0 N--CA 1.464 0.273 0 C-N-CA 120.353 -0.539 . . . . 0.0 111.035 -179.2 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' THR . . . . . 0.49 ' C ' ' H ' ' A' ' 23' ' ' GLY . 0.2 OUTLIER -63.62 -31.38 72.53 Favored 'General case' 0 C--N 1.324 -0.535 0 C-N-CA 120.467 -0.493 . . . . 0.0 110.758 -179.812 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.448 ' N ' ' O ' ' A' ' 19' ' ' LEU . 80.1 mmt-85 -69.05 10.24 0.32 Allowed 'General case' 0 C--O 1.232 0.18 0 C-N-CA 120.795 -0.362 . . . . 0.0 110.457 -179.745 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' GLY . . . . . 0.49 ' H ' ' C ' ' A' ' 21' ' ' THR . . . 91.52 22.49 31.4 Favored Glycine 0 N--CA 1.467 0.736 0 N-CA-C 111.162 -0.775 . . . . 0.0 111.162 179.738 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.642 HG12 ' N ' ' A' ' 25' ' ' LYS . 39.8 t -105.27 168.27 2.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-O 120.63 0.253 . . . . 0.0 110.575 -179.882 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.642 ' N ' HG12 ' A' ' 24' ' ' VAL . 98.9 mttt -134.96 105.15 6.25 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.171 179.356 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.491 ' CG1' ' OD2' ' A' ' 30' ' ' ASP . 1.7 t -117.92 93.66 2.67 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.443 0 C-N-CA 120.895 -0.322 . . . . 0.0 110.765 -179.656 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 25.5 pttt -81.43 165.22 21.47 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.711 179.619 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 98.0 m-85 -48.21 -31.83 6.33 Favored 'General case' 0 C--O 1.241 0.614 0 CA-C-O 121.254 0.55 . . . . 0.0 110.647 179.895 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -54.43 -23.22 15.05 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.012 179.552 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.491 ' OD2' ' CG1' ' A' ' 26' ' ' VAL . 21.4 t0 -65.11 -42.0 94.4 Favored 'General case' 0 C--O 1.218 -0.567 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.894 -179.54 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.482 ' O ' ' CB ' ' A' ' 35' ' ' PHE . 4.7 mp -65.16 -40.58 94.55 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-O 121.029 0.443 . . . . 0.0 109.856 -179.866 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 40.7 mt -58.91 -46.35 88.11 Favored 'General case' 0 C--N 1.312 -1.064 0 C-N-CA 119.34 -0.944 . . . . 0.0 111.086 -178.216 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.411 ' O ' ' CD1' ' A' ' 37' ' ' PHE . 83.3 tttt -85.67 -49.99 7.54 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.896 -178.889 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' PHE . . . . . 0.44 ' CB ' ' O ' ' A' ' 30' ' ' ASP . 49.7 t80 -61.51 -50.75 71.44 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.206 -178.742 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.482 ' CB ' ' O ' ' A' ' 31' ' ' LEU . 5.4 t80 -61.6 -46.79 88.33 Favored 'General case' 0 C--N 1.33 -0.264 0 O-C-N 123.325 0.391 . . . . 0.0 110.241 -179.152 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 93.1 m-20 -63.44 -38.31 90.64 Favored 'General case' 0 C--N 1.34 0.167 0 C-N-CA 120.597 -0.441 . . . . 0.0 111.224 -179.431 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.411 ' CD1' ' O ' ' A' ' 33' ' ' LYS . 2.8 m-85 -61.09 -46.49 90.41 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.487 -178.929 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.524 ' O ' ' N ' ' A' ' 42' ' ' CYS . 27.6 m -76.87 -37.29 27.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 C-N-CA 120.307 -0.557 . . . . 0.0 110.425 -179.779 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 61.5 tttm -56.49 -29.25 61.57 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.763 -179.627 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 66.4 t0 -49.73 -62.43 1.56 Allowed 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.748 -0.381 . . . . 0.0 111.138 -179.446 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 17.2 p -115.21 1.1 13.74 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 116.529 -0.305 . . . . 0.0 111.562 -179.84 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' CYS . . . . . 0.524 ' N ' ' O ' ' A' ' 38' ' ' VAL . 2.2 m 40.49 59.25 7.72 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.434 -178.479 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' PRO . . . . . 0.483 ' HD3' ' N ' ' A' ' 42' ' ' CYS . 9.1 Cg_exo -67.75 -29.65 35.31 Favored 'Trans proline' 0 N--CA 1.496 1.668 0 C-N-CA 122.442 2.094 . . . . 0.0 112.568 -179.415 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 44' ' ' TRP . . . . . 0.535 ' HE1' ' H ' ' A' ' 52' ' ' ASP . 0.0 OUTLIER -64.75 0.47 1.14 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.827 -179.272 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.487 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 45.9 t80 45.25 52.25 10.29 Favored Pre-proline 0 C--N 1.327 -0.395 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.078 -179.789 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.487 ' CD ' ' N ' ' A' ' 45' ' ' PHE . 19.8 Cg_endo -59.23 -7.17 4.64 Favored 'Trans proline' 0 C--N 1.307 -1.627 0 C-N-CA 122.965 2.443 . . . . 0.0 112.176 179.804 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 99.3 mm-40 -51.22 -54.38 26.2 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 120.534 -0.466 . . . . 0.0 110.167 -179.491 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -89.65 -13.36 37.21 Favored 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 120.737 -0.385 . . . . 0.0 110.697 179.028 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 77.32 71.58 1.19 Allowed Glycine 0 CA--C 1.522 0.53 0 N-CA-C 110.474 -1.051 . . . . 0.0 110.474 -179.318 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 1.7 t -137.22 162.99 31.97 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 121.052 -0.259 . . . . 0.0 110.719 -179.383 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.443 ' CD1' HD23 ' A' ' 89' ' ' LEU . 1.5 mt -91.6 141.97 13.71 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.101 179.445 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 52' ' ' ASP . . . . . 0.535 ' H ' ' HE1' ' A' ' 44' ' ' TRP . 9.3 m-20 -113.77 119.21 36.56 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.987 -0.552 . . . . 0.0 111.503 179.835 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.503 ' CG1' HD12 ' A' ' 90' ' ' ILE . 27.8 mm -95.21 -57.01 4.69 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 C-N-CA 120.768 -0.373 . . . . 0.0 110.963 178.694 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 99.7 mttt -75.81 -46.73 28.98 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-O 121.137 0.494 . . . . 0.0 111.52 -179.784 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 79.7 mtp180 -60.56 -32.4 71.47 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 116.031 -0.531 . . . . 0.0 109.897 -179.668 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 26.9 t-105 -59.67 -36.86 77.3 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 116.039 -0.528 . . . . 0.0 109.759 178.691 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 63.3 ttm-85 -66.75 -38.22 86.19 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.498 179.505 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 82.7 mtp180 -57.22 -48.09 79.69 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 120.577 -0.449 . . . . 0.0 111.318 -179.122 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 4.3 p -66.14 -34.25 68.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 C-N-CA 120.602 -0.439 . . . . 0.0 110.059 179.461 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -66.22 -38.85 94.17 Favored Glycine 0 CA--C 1.526 0.772 0 N-CA-C 111.197 -0.761 . . . . 0.0 111.197 179.545 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 99.9 m-20 -62.46 -46.02 90.41 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.758 0.313 . . . . 0.0 111.07 -179.524 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 88.6 m -65.74 -42.48 90.95 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.173 0.511 . . . . 0.0 110.305 179.941 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 6.8 m-85 -67.47 -30.05 69.66 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.289 179.572 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 59.7 tt0 -62.33 -43.75 98.09 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.228 -179.888 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 31.3 t0 -61.28 -50.74 71.81 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.11 0.481 . . . . 0.0 110.422 179.232 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 34.0 m-85 -62.88 -34.91 78.37 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.075 -0.512 . . . . 0.0 109.947 179.318 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' TYR . . . . . 0.548 ' CE2' ' O ' ' A' ' 71' ' ' GLY . 76.2 t80 -62.43 -36.85 83.68 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.005 -0.543 . . . . 0.0 109.96 179.679 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 23.5 m-20 -62.63 -37.77 87.63 Favored 'General case' 0 CA--C 1.519 -0.217 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.334 179.801 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 66.5 p -61.27 -19.45 61.73 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 119.812 -0.755 . . . . 0.0 109.16 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 60.0 m-85 -99.27 -49.99 4.28 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 112.752 0.649 . . . . 0.0 112.752 179.731 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' GLY . . . . . 0.548 ' O ' ' CE2' ' A' ' 67' ' ' TYR . . . 173.02 92.73 0.08 OUTLIER Glycine 0 CA--C 1.537 1.429 0 N-CA-C 111.024 -0.83 . . . . 0.0 111.024 -178.874 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 72' ' ' PRO . . . . . 0.514 ' O ' HG23 ' A' ' 75' ' ' VAL . 52.9 Cg_endo -84.23 16.06 2.02 Favored 'Trans proline' 0 N--CA 1.487 1.103 0 C-N-CA 124.12 3.214 . . . . 0.0 111.182 179.458 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 92.4 mt-10 -88.24 -49.65 6.85 Favored 'General case' 0 CA--C 1.51 -0.583 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.248 -178.896 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.423 ' O ' ' O ' ' A' ' 75' ' ' VAL . 0.5 OUTLIER -62.14 -44.31 96.9 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.015 -0.993 . . . . 0.0 110.614 179.671 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.514 HG23 ' O ' ' A' ' 72' ' ' PRO . 78.8 t 36.31 94.16 0.04 OUTLIER Pre-proline 0 N--CA 1.467 0.408 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.395 -179.52 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_exo -57.63 126.21 21.14 Favored 'Trans proline' 0 N--CA 1.493 1.473 0 C-N-CA 121.377 1.385 . . . . 0.0 112.283 -179.672 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 60.6 t -83.83 -25.9 7.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.905 179.144 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' THR . . . . . 0.43 ' H ' HG23 ' A' ' 78' ' ' THR . 22.0 p -44.73 -24.25 0.19 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.499 -179.112 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -59.86 -40.67 89.41 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.348 179.635 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 35.9 t80 -64.61 -39.47 93.78 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.717 179.872 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 11.6 t -58.66 -46.67 86.66 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.028 -179.409 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 14.6 m-85 -62.7 -49.07 76.55 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.731 -0.388 . . . . 0.0 110.942 179.622 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 83' ' ' TRP . . . . . . . . . . . . . 53.1 t90 -53.82 -39.17 65.29 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.579 -179.576 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 92.8 m-20 -61.64 -47.02 87.27 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 120.473 -0.491 . . . . 0.0 111.167 -179.431 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 36.5 tp -72.63 -54.58 8.68 Favored 'General case' 0 C--O 1.221 -0.444 0 C-N-CA 120.186 -0.606 . . . . 0.0 110.496 179.717 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -55.56 -26.09 18.99 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-O 120.765 0.317 . . . . 0.0 110.507 179.575 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 70.8 tttt -65.66 -51.46 59.33 Favored 'General case' 0 C--N 1.322 -0.613 0 C-N-CA 119.966 -0.693 . . . . 0.0 110.224 179.952 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 88' ' ' GLU . . . . . 0.401 ' O ' ' OE1' ' A' ' 88' ' ' GLU . 1.1 pp20? -80.07 -19.77 46.74 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.009 -179.498 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.443 HD23 ' CD1' ' A' ' 51' ' ' ILE . 14.6 tp -61.68 -44.37 97.08 Favored 'General case' 0 N--CA 1.446 -0.639 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.901 -179.142 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.503 HD12 ' CG1' ' A' ' 53' ' ' ILE . 3.4 mt -64.02 -43.78 97.65 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.109 0 C-N-CA 120.174 -0.611 . . . . 0.0 109.833 -179.406 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 95.8 m-20 -64.14 -14.84 57.76 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.65 -179.345 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 21.1 tttt -79.48 153.54 29.53 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.519 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -92.74 -9.44 40.65 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.777 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -63.2 -18.26 63.3 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.427 179.961 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 10.9 t -69.3 134.17 30.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.144 -179.732 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 96' ' ' ASN . . . . . 0.564 ' O ' ' N ' ' A' ' 98' ' ' GLN . 0.7 OUTLIER -55.42 161.23 3.04 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.889 -179.579 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_exo -42.61 -12.93 0.04 OUTLIER 'Trans proline' 0 N--CA 1.491 1.346 0 C-N-CA 123.006 2.471 . . . . 0.0 112.23 178.995 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 98' ' ' GLN . . . . . 0.564 ' N ' ' O ' ' A' ' 96' ' ' ASN . 2.2 pt20 . . . . . 0 C--N 1.321 -0.642 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.425 -179.672 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 58.6 p . . . . . 0 C--O 1.231 0.097 0 CA-C-O 120.766 0.317 . . . . 0.0 110.619 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 85.1 mt-10 -132.71 167.95 19.2 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.044 -179.741 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 108' ' ' GLU . . . . . 0.497 ' OE1' ' N ' ' A' ' 108' ' ' GLU . 57.1 mp0 -101.39 121.38 41.81 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.77 -0.456 . . . . 0.0 109.77 179.096 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 45.0 pt -46.34 -17.06 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.202 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.463 ' N ' ' C ' ' A' ' 108' ' ' GLU . 34.1 mt -63.82 -42.12 97.72 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.297 179.685 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 111' ' ' LYS . . . . . 0.433 ' O ' ' O ' ' A' ' 114' ' ' SER . 88.6 tttt -63.84 -44.28 93.67 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.527 179.437 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 112' ' ' SER . . . . . 0.423 ' O ' ' O ' ' A' ' 111' ' ' LYS . 1.2 p 38.66 -161.44 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.877 179.921 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 113' ' ' ASN . . . . . 0.42 ' N ' ' OG ' ' A' ' 112' ' ' SER . 94.2 m-20 -63.62 -43.12 97.78 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.745 -179.52 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 114' ' ' SER . . . . . 0.433 ' O ' ' O ' ' A' ' 111' ' ' LYS . 6.4 m -93.9 129.05 40.49 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.277 179.96 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 84.9 mt-30 -86.92 34.58 0.67 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.838 0.351 . . . . 0.0 110.309 -179.776 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 64.1 p -65.75 -31.14 71.96 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.409 -179.858 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 97.0 m-20 . . . . . 0 C--N 1.327 -0.387 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.527 179.777 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.675 0 N-CA-C 110.873 -0.891 . . . . 0.0 110.873 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 86.7 mt-30 -63.72 -34.1 77.13 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.807 0.337 . . . . 0.0 110.709 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -46.96 -24.34 0.59 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.677 179.926 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 34.6 tp -48.99 -34.19 12.57 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-O 121.103 0.478 . . . . 0.0 110.232 -179.55 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 46.5 m -54.66 -37.78 66.13 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.115 179.871 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 97.5 mm-40 -62.79 -32.06 73.16 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.375 179.804 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 59.8 t-80 -60.63 -43.89 96.99 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.933 0.397 . . . . 0.0 110.376 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 81.2 tt0 -60.59 -51.28 70.1 Favored 'General case' 0 C--O 1.244 0.808 0 CA-C-O 121.335 0.588 . . . . 0.0 110.105 179.729 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.413 ' O ' ' CB ' ' A' ' 14' ' ' GLN . 76.3 mtt-85 -62.56 -31.52 72.33 Favored 'General case' 0 C--O 1.211 -0.938 0 CA-C-N 115.897 -0.592 . . . . 0.0 109.458 179.513 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.461 ' OH ' ' CD2' ' A' ' 89' ' ' LEU . 36.5 t80 -60.23 -37.59 80.81 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 120.936 -0.306 . . . . 0.0 110.326 -179.52 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 2.4 t -62.75 -49.69 82.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 C-N-CA 120.056 -0.657 . . . . 0.0 110.914 -179.803 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 95.6 mt-10 -79.25 -35.9 40.77 Favored 'General case' 0 C--N 1.326 -0.436 0 C-N-CA 120.398 -0.521 . . . . 0.0 111.682 -179.302 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' GLN . . . . . 0.413 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 70.9 tp60 -69.15 -52.39 28.58 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.199 -178.941 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.613 HD13 ' O ' ' A' ' 15' ' ' LEU . 0.3 OUTLIER -61.73 -45.64 93.05 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 -179.406 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.486 ' HB3' HG11 ' A' ' 26' ' ' VAL . 63.9 mttm -55.51 -35.94 66.15 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 120.482 -0.487 . . . . 0.0 110.156 179.486 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 77.3 mt-30 -71.87 -42.0 67.36 Favored 'General case' 0 C--O 1.241 0.641 0 CA-C-O 121.264 0.554 . . . . 0.0 110.552 178.64 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.59 ' O ' HG22 ' A' ' 21' ' ' THR . . . -54.23 -45.18 72.25 Favored 'General case' 0 C--O 1.223 -0.31 0 CA-C-N 115.788 -0.642 . . . . 0.0 109.599 179.93 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.503 ' O ' ' N ' ' A' ' 22' ' ' ARG . 4.4 mt -65.62 -37.9 87.88 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.856 0.36 . . . . 0.0 110.511 178.666 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 77.0 tttt -44.07 -36.74 2.69 Favored 'General case' 0 C--N 1.321 -0.637 0 C-N-CA 120.537 -0.465 . . . . 0.0 109.848 -179.44 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' THR . . . . . 0.59 HG22 ' O ' ' A' ' 18' ' ' ALA . 1.2 t -63.27 -32.06 73.37 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.215 179.318 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.503 ' N ' ' O ' ' A' ' 19' ' ' LEU . 26.3 mmt-85 -73.46 19.53 0.1 Allowed 'General case' 0 N--CA 1.462 0.162 0 CA-C-O 120.959 0.409 . . . . 0.0 110.546 -179.715 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' GLY . . . . . 0.488 ' H ' ' C ' ' A' ' 21' ' ' THR . . . 81.45 15.34 76.49 Favored Glycine 0 CA--C 1.524 0.609 0 N-CA-C 110.625 -0.99 . . . . 0.0 110.625 179.974 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.451 HG12 ' H ' ' A' ' 25' ' ' LYS . 3.4 t -92.61 167.53 1.62 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 N-CA-C 110.097 -0.334 . . . . 0.0 110.097 -179.795 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.451 ' H ' HG12 ' A' ' 24' ' ' VAL . 55.5 mtmt -128.56 133.21 48.31 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 110.143 -0.317 . . . . 0.0 110.143 179.71 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.486 HG11 ' HB3' ' A' ' 16' ' ' LYS . 2.1 m -133.37 110.54 14.98 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.333 0 CA-C-N 116.62 -0.264 . . . . 0.0 110.512 179.854 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 25.7 pttt -108.92 165.15 11.79 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-O 120.615 0.245 . . . . 0.0 110.459 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 76.3 m-85 -48.52 -39.57 23.78 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.043 0.449 . . . . 0.0 110.318 179.941 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.421 ' HA ' HD12 ' A' ' 32' ' ' LEU . . . -55.69 -23.17 27.07 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.073 179.516 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.428 ' O ' ' CB ' ' A' ' 34' ' ' PHE . 44.7 t0 -62.14 -44.41 96.69 Favored 'General case' 0 C--O 1.221 -0.395 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.641 -179.719 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.483 ' O ' ' CB ' ' A' ' 35' ' ' PHE . 5.2 mp -68.08 -40.06 82.75 Favored 'General case' 0 C--O 1.218 -0.558 0 CA-C-O 121.099 0.476 . . . . 0.0 110.11 179.24 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.421 HD12 ' HA ' ' A' ' 29' ' ' ALA . 46.0 mt -58.84 -44.61 90.98 Favored 'General case' 0 C--N 1.317 -0.84 0 C-N-CA 119.856 -0.738 . . . . 0.0 110.862 -178.634 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.619 ' NZ ' ' CE2' ' A' ' 67' ' ' TYR . 88.3 tttt -85.61 -49.09 8.29 Favored 'General case' 0 C--N 1.321 -0.631 0 C-N-CA 120.741 -0.384 . . . . 0.0 111.704 -179.325 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 34' ' ' PHE . . . . . 0.428 ' CB ' ' O ' ' A' ' 30' ' ' ASP . 54.1 t80 -61.34 -50.52 72.6 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.927 -178.682 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.483 ' CB ' ' O ' ' A' ' 31' ' ' LEU . 6.1 t80 -61.83 -46.95 87.26 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.339 -179.685 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 90.8 m-20 -64.37 -36.18 83.31 Favored 'General case' 0 C--N 1.341 0.202 0 CA-C-O 120.747 0.308 . . . . 0.0 111.478 -179.617 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 1.8 m-85 -58.33 -45.47 88.02 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.854 -179.176 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.542 ' O ' ' N ' ' A' ' 42' ' ' CYS . 19.7 m -79.48 -39.05 20.26 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.871 179.97 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 85.9 tttt -55.21 -28.45 53.2 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.775 -179.229 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 96.5 m-20 -50.41 -63.28 1.17 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.389 -0.368 . . . . 0.0 111.134 -179.43 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.445 ' O ' ' SG ' ' A' ' 42' ' ' CYS . 22.9 p -114.51 4.48 15.23 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.983 -179.87 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' CYS . . . . . 0.542 ' N ' ' O ' ' A' ' 38' ' ' VAL . 19.5 p 41.29 54.68 7.9 Favored Pre-proline 0 C--N 1.331 -0.214 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.679 -179.109 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' PRO . . . . . 0.461 ' C ' ' H ' ' A' ' 45' ' ' PHE . 57.8 Cg_endo -72.93 -25.16 16.78 Favored 'Trans proline' 0 N--CA 1.491 1.352 0 C-N-CA 122.469 2.113 . . . . 0.0 112.142 -179.996 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 1.2 t-105 -61.53 -1.41 0.56 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.526 -179.52 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.461 ' H ' ' C ' ' A' ' 43' ' ' PRO . 4.8 t80 50.02 54.36 15.61 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-O 121.021 0.438 . . . . 0.0 110.087 -179.856 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.461 ' CD ' ' N ' ' A' ' 45' ' ' PHE . 29.5 Cg_endo -65.21 -10.55 26.24 Favored 'Trans proline' 0 C--N 1.308 -1.584 0 C-N-CA 122.863 2.375 . . . . 0.0 112.117 179.948 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 86.9 mt-30 -58.44 -52.39 65.84 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.248 -179.613 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 50.2 tt0 -88.81 -13.76 38.61 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.172 179.472 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 72.53 65.58 2.29 Favored Glycine 0 CA--C 1.522 0.528 0 N-CA-C 110.494 -1.042 . . . . 0.0 110.494 -179.3 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' THR . . . . . 0.543 ' OG1' ' NE2' ' A' ' 98' ' ' GLN . 2.4 t -136.76 155.88 49.25 Favored 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 120.998 -0.281 . . . . 0.0 110.775 -179.536 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.5 mt -85.24 140.74 15.53 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-O 121.074 0.464 . . . . 0.0 110.537 179.308 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -110.78 121.47 45.43 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.474 -0.785 . . . . 0.0 110.995 179.378 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.473 ' CG1' HD12 ' A' ' 90' ' ' ILE . 32.6 mm -94.81 -56.53 5.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.203 179.324 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 68.6 mmtt -74.07 -49.04 25.82 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.359 -179.522 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 78.1 mtp85 -61.07 -35.17 76.23 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.212 -179.742 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 22.8 t-105 -61.94 -38.54 88.83 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.791 179.407 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 61.7 ttt85 -62.86 -39.05 93.23 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.276 -179.901 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -59.23 -50.75 72.82 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 120.89 -0.324 . . . . 0.0 111.103 -179.345 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 6.4 p -73.54 -36.85 48.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-O 120.84 0.352 . . . . 0.0 110.825 179.748 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' GLY . . . . . 0.428 ' O ' ' CB ' ' A' ' 64' ' ' GLN . . . -64.06 -54.85 27.66 Favored Glycine 0 C--O 1.223 -0.59 0 N-CA-C 111.438 -0.665 . . . . 0.0 111.438 -179.104 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 62.5 m-20 -63.35 -35.86 81.8 Favored 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 120.828 -0.349 . . . . 0.0 110.581 -179.536 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 3.8 m -64.01 -62.57 1.55 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.841 0.353 . . . . 0.0 111.355 -179.509 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 21.1 m-85 -63.5 -41.97 98.52 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.972 -179.701 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' GLN . . . . . 0.59 ' HG2' HD22 ' A' ' 68' ' ' ASN . 56.7 tt0 -62.92 -42.21 99.72 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.877 -179.582 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 24.5 t0 -54.7 -56.75 15.85 Favored 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 120.476 -0.49 . . . . 0.0 110.944 -179.61 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 65.2 m-85 -64.46 -41.47 96.49 Favored 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 120.678 -0.409 . . . . 0.0 110.787 179.846 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' TYR . . . . . 0.619 ' CE2' ' NZ ' ' A' ' 33' ' ' LYS . 65.6 t80 -57.61 -41.0 80.4 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.618 -179.403 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 68' ' ' ASN . . . . . 0.59 HD22 ' HG2' ' A' ' 64' ' ' GLN . 26.4 m-20 -62.15 -43.82 97.99 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.122 -179.075 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 81.1 p -77.69 -18.64 56.42 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.238 -179.812 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 34.9 m-85 -109.73 16.09 22.32 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.381 179.933 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -160.41 -108.32 0.23 Allowed Glycine 0 CA--C 1.532 1.147 0 C-N-CA 120.539 -0.838 . . . . 0.0 111.213 -179.947 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 65.3 Cg_endo -73.71 141.49 30.84 Favored 'Trans proline' 0 N--CA 1.497 1.715 0 C-N-CA 121.98 1.787 . . . . 0.0 113.211 -179.487 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 81.5 tt0 -86.44 -43.38 12.84 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.548 179.343 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.664 ' CD ' ' H ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -82.75 -26.67 31.67 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 115.892 -0.595 . . . . 0.0 111.326 -179.46 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.535 ' H ' ' HD3' ' A' ' 74' ' ' LYS . 87.5 t 57.38 115.57 0.02 OUTLIER Pre-proline 0 N--CA 1.45 -0.436 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.683 -179.554 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_exo -53.73 127.84 27.1 Favored 'Trans proline' 0 N--CA 1.495 1.576 0 C-N-CA 121.473 1.449 . . . . 0.0 111.697 179.74 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.523 ' O ' HG12 ' A' ' 77' ' ' VAL . 61.1 t -82.65 -7.42 10.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.98 179.827 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 68.2 p -48.95 -22.02 0.77 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.549 -179.455 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.06 -27.06 68.63 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.532 179.722 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 34.6 t80 -60.95 -40.44 93.34 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.147 -179.815 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 20.9 m -57.98 -42.08 84.35 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.527 -179.687 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 13.5 m-85 -57.35 -53.8 54.03 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.772 -0.371 . . . . 0.0 110.621 -179.968 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 83' ' ' TRP . . . . . 0.484 ' C ' ' CD1' ' A' ' 83' ' ' TRP . 9.0 t-105 -56.39 -40.55 74.81 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.499 -179.983 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 83.8 m-20 -61.27 -45.41 94.61 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 120.484 -0.486 . . . . 0.0 111.111 -179.01 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 42.4 tp -72.83 -57.62 3.94 Favored 'General case' 0 C--O 1.218 -0.567 0 C-N-CA 120.337 -0.545 . . . . 0.0 110.574 179.84 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -53.75 -26.41 13.68 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 C-N-CA 120.733 -0.387 . . . . 0.0 110.379 179.452 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.415 ' CB ' ' O ' ' A' ' 83' ' ' TRP . 64.2 tttt -65.44 -50.93 63.56 Favored 'General case' 0 C--N 1.322 -0.608 0 C-N-CA 120.404 -0.519 . . . . 0.0 110.393 179.938 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 88' ' ' GLU . . . . . 0.434 ' O ' ' OD1' ' A' ' 91' ' ' ASP . 1.1 pp20? -80.75 -19.71 44.33 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.774 179.954 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.461 ' CD2' ' OH ' ' A' ' 11' ' ' TYR . 12.6 tp -62.17 -43.76 98.12 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.322 -178.746 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.473 HD12 ' CG1' ' A' ' 53' ' ' ILE . 3.1 mt -63.69 -45.47 97.33 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 C-N-CA 120.271 -0.572 . . . . 0.0 110.847 -178.783 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 91' ' ' ASP . . . . . 0.434 ' OD1' ' O ' ' A' ' 88' ' ' GLU . 4.4 p30 -81.64 -4.92 57.45 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.433 -0.348 . . . . 0.0 111.075 -178.757 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 92' ' ' LYS . . . . . 0.471 ' O ' ' CB ' ' A' ' 93' ' ' LYS . 86.4 tttt -57.24 -15.71 6.59 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.633 -179.904 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 93' ' ' LYS . . . . . 0.471 ' CB ' ' O ' ' A' ' 92' ' ' LYS . 59.4 tttt 79.63 -68.11 0.13 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.731 179.805 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 70.3 tt0 -73.94 54.7 0.52 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.057 0.456 . . . . 0.0 110.005 -179.741 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.441 ' O ' ' O ' ' A' ' 96' ' ' ASN . 1.9 t -87.46 164.76 2.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.4 -179.636 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 96' ' ' ASN . . . . . 0.601 ' O ' ' N ' ' A' ' 98' ' ' GLN . 0.0 OUTLIER -42.19 167.04 0.07 OUTLIER Pre-proline 0 C--N 1.327 -0.395 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.353 179.731 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 77.0 Cg_exo -40.38 -14.01 0.03 OUTLIER 'Trans proline' 0 C--N 1.312 -1.386 0 C-N-CA 122.844 2.363 . . . . 0.0 112.485 179.174 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 98' ' ' GLN . . . . . 0.601 ' N ' ' O ' ' A' ' 96' ' ' ASN . 12.1 tt0 . . . . . 0 C--N 1.322 -0.629 0 C-N-CA 120.799 -0.361 . . . . 0.0 110.174 179.17 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 45.3 p . . . . . 0 N--CA 1.458 -0.072 0 CA-C-O 120.865 0.364 . . . . 0.0 110.698 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 46.4 mm-40 -74.93 155.02 37.88 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.605 -179.836 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 108' ' ' GLU . . . . . 0.553 ' C ' ' H ' ' A' ' 110' ' ' LEU . 99.3 mt-10 -89.85 135.11 33.83 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.177 179.536 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 47.3 pt -59.14 0.77 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 115.965 -0.562 . . . . 0.0 110.201 179.564 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.553 ' H ' ' C ' ' A' ' 108' ' ' GLU . 96.6 mt -100.73 -9.43 21.8 Favored 'General case' 0 C--N 1.334 -0.097 0 C-N-CA 120.592 -0.443 . . . . 0.0 110.507 -179.857 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 111' ' ' LYS . . . . . 0.454 ' O ' ' O ' ' A' ' 114' ' ' SER . 86.3 tttt -71.3 -13.38 61.87 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.676 179.927 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 11.7 t -58.93 -45.38 90.53 Favored 'General case' 0 C--N 1.326 -0.45 0 C-N-CA 120.724 -0.391 . . . . 0.0 110.613 -179.895 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 88.3 m-20 -64.54 -41.89 96.07 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.867 -179.785 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 114' ' ' SER . . . . . 0.454 ' O ' ' O ' ' A' ' 111' ' ' LYS . 35.5 t -158.5 177.99 10.63 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.468 -179.815 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 95.5 mt-30 -53.5 -41.52 66.37 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.945 0.402 . . . . 0.0 110.467 -179.812 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 62.8 p -146.75 162.88 37.63 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.571 179.749 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 . . . . . 0 C--N 1.33 -0.268 0 C-N-CA 120.92 -0.312 . . . . 0.0 110.517 179.452 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.695 0 N-CA-C 111.134 -0.787 . . . . 0.0 111.134 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 99.3 mm-40 -56.92 -28.43 62.01 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.819 0.342 . . . . 0.0 110.34 -179.799 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 4' ' ' GLU . . . . . 0.499 ' O ' ' N ' ' A' ' 7' ' ' GLN . 91.0 mt-10 -57.67 -21.54 40.74 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.563 179.853 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 49.9 tp -40.46 -30.3 0.11 Allowed 'General case' 0 C--O 1.234 0.279 0 CA-C-O 121.004 0.431 . . . . 0.0 110.358 -179.31 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 16.3 t -59.88 -42.43 93.74 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 120.693 -0.403 . . . . 0.0 109.924 179.42 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' GLN . . . . . 0.499 ' N ' ' O ' ' A' ' 4' ' ' GLU . 87.0 mt-30 -61.39 -35.42 77.43 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.666 179.689 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 63.3 t60 -57.33 -44.1 83.95 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.059 -179.822 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 81.0 mm-40 -61.33 -45.22 95.35 Favored 'General case' 0 C--O 1.241 0.651 0 CA-C-O 121.061 0.457 . . . . 0.0 110.007 179.648 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.427 ' O ' ' CB ' ' A' ' 14' ' ' GLN . 64.5 mtp85 -64.41 -33.25 75.43 Favored 'General case' 0 C--O 1.212 -0.871 0 N-CA-C 109.22 -0.659 . . . . 0.0 109.22 179.636 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.478 ' CE1' HD23 ' A' ' 15' ' ' LEU . 53.4 t80 -60.09 -37.77 80.93 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 120.554 -0.458 . . . . 0.0 110.365 -179.52 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 4.5 t -61.62 -49.44 84.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 C-N-CA 120.056 -0.658 . . . . 0.0 111.048 179.935 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 80.9 mm-40 -80.72 -43.05 20.89 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 120.33 -0.548 . . . . 0.0 111.659 -179.33 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' GLN . . . . . 0.427 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 69.1 tp60 -61.36 -52.75 63.34 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.881 -0.6 . . . . 0.0 111.325 -178.977 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.595 HD13 ' O ' ' A' ' 15' ' ' LEU . 0.2 OUTLIER -63.21 -45.27 92.45 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 120.649 -0.42 . . . . 0.0 110.086 -179.613 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.532 ' HB3' HG11 ' A' ' 26' ' ' VAL . 92.0 mttt -58.16 -33.57 69.36 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 120.674 -0.411 . . . . 0.0 110.527 179.236 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 76.8 mt-30 -71.95 -41.68 67.48 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.178 0.513 . . . . 0.0 110.446 178.664 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.543 ' O ' HG22 ' A' ' 21' ' ' THR . . . -55.12 -42.98 73.68 Favored 'General case' 0 C--O 1.222 -0.368 0 CA-C-N 116.074 -0.512 . . . . 0.0 109.69 179.843 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.453 ' O ' ' N ' ' A' ' 22' ' ' ARG . 5.0 mt -66.62 -37.96 85.94 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.995 0.426 . . . . 0.0 110.703 178.579 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 61.6 tttm -45.61 -37.36 5.52 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 -179.62 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' THR . . . . . 0.543 HG22 ' O ' ' A' ' 18' ' ' ALA . 1.0 OUTLIER -61.14 -33.18 73.0 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.01 179.392 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.453 ' N ' ' O ' ' A' ' 19' ' ' LEU . 10.3 mmm180 -72.93 15.63 0.19 Allowed 'General case' 0 N--CA 1.464 0.266 0 CA-C-O 120.868 0.366 . . . . 0.0 110.41 -179.633 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' GLY . . . . . 0.471 ' H ' ' C ' ' A' ' 21' ' ' THR . . . 84.41 13.67 72.94 Favored Glycine 0 CA--C 1.525 0.696 0 N-CA-C 110.561 -1.016 . . . . 0.0 110.561 -179.872 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.549 HG12 ' N ' ' A' ' 25' ' ' LYS . 11.7 t -88.01 167.65 1.69 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 N-CA-C 110.314 -0.254 . . . . 0.0 110.314 179.993 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.549 ' N ' HG12 ' A' ' 24' ' ' VAL . 88.8 tttt -130.0 129.85 44.25 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.214 179.616 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.532 HG11 ' HB3' ' A' ' 16' ' ' LYS . 3.6 m -128.15 108.56 17.99 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.307 0 CA-C-N 116.503 -0.317 . . . . 0.0 110.543 -179.884 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.564 ' HD3' ' H ' ' A' ' 29' ' ' ALA . 12.5 tmtt? -109.49 165.22 11.82 Favored 'General case' 0 CA--C 1.527 0.074 0 N-CA-C 109.959 -0.385 . . . . 0.0 109.959 -179.824 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 89.8 m-85 -47.06 -35.94 7.5 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.923 0.392 . . . . 0.0 110.246 -179.973 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.564 ' H ' ' HD3' ' A' ' 27' ' ' LYS . . . -57.95 -24.03 56.25 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 121.185 0.517 . . . . 0.0 110.042 179.452 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 65.9 t0 -60.66 -48.36 82.14 Favored 'General case' 0 C--O 1.222 -0.367 0 CA-C-N 115.606 -0.724 . . . . 0.0 110.594 -179.697 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.539 ' H ' HD12 ' A' ' 31' ' ' LEU . 5.4 mp -63.72 -42.09 97.98 Favored 'General case' 0 C--O 1.217 -0.631 0 CA-C-O 121.048 0.452 . . . . 0.0 110.155 179.448 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.418 ' H ' ' HG ' ' A' ' 32' ' ' LEU . 30.4 mt -59.29 -44.95 92.45 Favored 'General case' 0 C--N 1.31 -1.119 0 C-N-CA 119.332 -0.947 . . . . 0.0 110.423 -178.892 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.465 ' O ' ' CD1' ' A' ' 37' ' ' PHE . 99.7 mttt -73.96 -41.68 61.62 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.075 -0.511 . . . . 0.0 112.366 -179.189 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' PHE . . . . . 0.863 ' O ' HG22 ' A' ' 38' ' ' VAL . 5.1 m-85 -83.07 -61.59 1.82 Allowed 'General case' 0 CA--C 1.511 -0.534 0 C-N-CA 120.738 -0.385 . . . . 0.0 111.214 -178.664 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.504 ' CB ' ' O ' ' A' ' 31' ' ' LEU . 17.1 t80 -41.98 -45.91 3.97 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.198 -179.322 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 80.1 m-20 -72.74 -41.49 65.08 Favored 'General case' 0 CA--C 1.529 0.164 0 C-N-CA 120.291 -0.564 . . . . 0.0 111.809 -179.44 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.465 ' CD1' ' O ' ' A' ' 33' ' ' LYS . 3.5 m-30 -63.34 -51.13 67.26 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 111.975 0.361 . . . . 0.0 111.975 -178.037 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.863 HG22 ' O ' ' A' ' 34' ' ' PHE . 6.5 m -67.68 -42.65 86.64 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.716 -179.563 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -65.47 -30.57 71.37 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.137 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 57.2 t0 -54.21 -49.23 69.88 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 120.84 -0.344 . . . . 0.0 110.544 -179.233 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 9.5 p -109.2 -8.67 15.09 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.037 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' CYS . . . . . 0.536 ' N ' ' O ' ' A' ' 38' ' ' VAL . 16.9 m 42.43 55.9 10.3 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.498 -179.526 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' PRO . . . . . 0.53 ' C ' ' H ' ' A' ' 45' ' ' PHE . 74.3 Cg_endo -78.33 -26.63 5.99 Favored 'Trans proline' 0 N--CA 1.491 1.361 0 C-N-CA 122.491 2.127 . . . . 0.0 112.997 -179.358 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 44' ' ' TRP . . . . . 0.413 ' CH2' ' CE3' ' A' ' 56' ' ' TRP . 0.0 OUTLIER -71.78 22.49 0.05 OUTLIER 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.968 -179.624 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.53 ' H ' ' C ' ' A' ' 43' ' ' PRO . 33.6 t80 40.03 61.63 6.16 Favored Pre-proline 0 C--N 1.326 -0.423 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.214 -179.091 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.468 ' HD3' ' N ' ' A' ' 45' ' ' PHE . 32.4 Cg_exo -60.39 -12.1 19.11 Favored 'Trans proline' 0 N--CA 1.496 1.657 0 C-N-CA 122.654 2.236 . . . . 0.0 112.257 -179.68 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 88.6 mt-30 -53.31 -53.96 43.32 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 120.534 -0.466 . . . . 0.0 110.45 -179.01 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 34.0 tp10 -88.93 -29.46 19.55 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.886 -0.413 . . . . 0.0 109.886 178.819 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 83.9 61.77 1.82 Allowed Glycine 0 CA--C 1.528 0.847 0 N-CA-C 110.01 -1.236 . . . . 0.0 110.01 -178.33 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 13.8 t -131.2 169.91 15.29 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-O 120.664 0.269 . . . . 0.0 110.524 -179.115 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.1 mt -87.02 132.14 33.21 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.314 0 C-N-CA 120.709 -0.397 . . . . 0.0 110.228 178.939 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -118.37 121.0 39.29 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.221 179.54 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 16.8 mm -91.74 -47.07 14.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.195 -179.578 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.449 ' HA ' ' HE ' ' A' ' 57' ' ' ARG . 88.3 tttt -64.11 -48.93 74.22 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-O 121.01 0.433 . . . . 0.0 111.152 -179.398 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 78.6 mmt-85 -64.7 -33.58 76.29 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.116 -179.745 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' TRP . . . . . 0.413 ' CE3' ' CH2' ' A' ' 44' ' ' TRP . 37.5 t-105 -59.81 -39.87 86.46 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-O 120.955 0.407 . . . . 0.0 110.269 -179.803 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.449 ' HE ' ' HA ' ' A' ' 54' ' ' LYS . 87.7 mtm180 -64.67 -38.34 90.67 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.453 -179.922 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 68.4 mmt-85 -60.59 -51.69 68.34 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.824 -0.35 . . . . 0.0 111.218 -179.643 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 3.5 p -66.16 -35.52 75.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.329 179.707 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -66.96 -45.03 87.07 Favored Glycine 0 CA--C 1.526 0.733 0 N-CA-C 111.246 -0.742 . . . . 0.0 111.246 179.867 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 99.8 m-20 -63.34 -43.84 96.57 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.718 0.294 . . . . 0.0 111.28 -179.577 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 74.8 m -64.14 -47.42 80.01 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.012 0.434 . . . . 0.0 110.557 -179.738 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 8.0 m-85 -66.4 -33.85 76.63 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.534 179.55 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 70.4 tp60 -57.69 -43.07 84.84 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.843 0.354 . . . . 0.0 110.295 -179.831 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -62.92 -52.8 61.65 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.922 0.391 . . . . 0.0 110.542 179.612 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' TYR . . . . . 0.413 ' O ' ' OG1' ' A' ' 69' ' ' THR . 38.7 m-85 -65.03 -25.23 67.75 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.476 179.399 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 61.5 t80 -65.5 -45.13 84.78 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.424 -179.912 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 88.6 m-20 -64.4 -39.45 93.87 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.592 -179.523 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.413 ' OG1' ' O ' ' A' ' 66' ' ' TYR . 82.2 p -49.77 -35.62 23.06 Favored 'General case' 0 C--N 1.324 -0.53 0 C-N-CA 120.578 -0.449 . . . . 0.0 111.159 -179.039 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 14.9 m-85 -67.36 -46.56 73.01 Favored 'General case' 0 C--N 1.321 -0.653 0 C-N-CA 119.888 -0.725 . . . . 0.0 111.056 -179.09 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' GLY . . . . . 0.509 ' H ' ' HD3' ' A' ' 72' ' ' PRO . . . 112.6 71.91 0.6 Allowed Glycine 0 N--CA 1.471 1.003 0 N-CA-C 110.952 -0.859 . . . . 0.0 110.952 -179.933 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 72' ' ' PRO . . . . . 0.509 ' HD3' ' H ' ' A' ' 71' ' ' GLY . 25.1 Cg_exo -62.02 143.69 95.36 Favored 'Trans proline' 0 N--CA 1.498 1.766 0 C-N-CA 123.247 2.631 . . . . 0.0 111.379 179.809 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 83.5 tt0 -74.93 -49.79 18.99 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-O 120.874 0.368 . . . . 0.0 110.544 -179.728 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.513 ' HD3' ' H ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -138.46 4.42 2.4 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.594 -179.547 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 63.8 t 57.42 92.97 0.06 OUTLIER Pre-proline 0 CA--C 1.534 0.331 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.068 -178.632 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_exo -54.15 125.71 19.71 Favored 'Trans proline' 0 N--CA 1.491 1.348 0 C-N-CA 121.722 1.615 . . . . 0.0 112.303 -178.982 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.456 ' O ' ' N ' ' A' ' 80' ' ' PHE . 43.6 t -84.67 -20.22 8.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.773 179.313 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 57.9 p -41.54 -27.49 0.1 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.585 -179.031 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' ALA . . . . . 0.409 ' N ' ' O ' ' A' ' 77' ' ' VAL . . . -62.39 -39.91 94.78 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.12 0.486 . . . . 0.0 110.64 179.839 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 80' ' ' PHE . . . . . 0.456 ' N ' ' O ' ' A' ' 77' ' ' VAL . 3.3 m-85 -62.19 -35.89 80.22 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.428 179.907 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 54.2 p -60.22 -40.04 88.74 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.244 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 13.7 m-85 -60.6 -53.4 57.95 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 120.696 -0.402 . . . . 0.0 110.707 179.816 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 83' ' ' TRP . . . . . . . . . . . . . 31.0 t90 -58.25 -38.68 77.4 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.738 179.806 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 82.3 m-20 -62.01 -45.7 92.43 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 120.684 -0.406 . . . . 0.0 110.957 -179.536 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 43.5 tp -71.45 -54.0 12.11 Favored 'General case' 0 C--O 1.218 -0.561 0 C-N-CA 120.439 -0.505 . . . . 0.0 110.466 179.606 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -57.23 -26.36 25.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-O 120.794 0.33 . . . . 0.0 110.61 179.622 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 66.4 tttt -65.59 -50.84 63.59 Favored 'General case' 0 C--N 1.32 -0.692 0 C-N-CA 120.32 -0.552 . . . . 0.0 110.107 -179.839 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 88' ' ' GLU . . . . . 0.438 ' OE1' ' O ' ' A' ' 88' ' ' GLU . 1.0 OUTLIER -80.38 -20.03 45.0 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.84 -179.815 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.419 HD12 ' HA ' ' A' ' 89' ' ' LEU . 14.1 tp -61.42 -44.42 97.17 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.47 -179.245 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 3.2 mt -63.52 -43.47 98.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 C-N-CA 120.25 -0.58 . . . . 0.0 109.841 -179.66 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 68.0 t0 -53.0 -43.46 66.49 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.751 -178.739 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 68.2 mmtt -62.5 134.91 57.07 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.954 0.406 . . . . 0.0 110.413 -179.779 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 93' ' ' LYS . . . . . 0.443 ' C ' ' H ' ' A' ' 95' ' ' VAL . 98.6 mttt -72.52 -9.87 59.09 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.539 -179.921 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 80.3 mm-40 -72.34 43.56 0.11 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.561 179.904 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.443 ' H ' ' C ' ' A' ' 93' ' ' LYS . 5.7 m -120.03 132.43 69.73 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.19 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.42 179.874 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 96' ' ' ASN . . . . . . . . . . . . . 7.2 m-20 -49.21 158.82 0.68 Allowed Pre-proline 0 C--N 1.327 -0.389 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.493 -179.628 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -60.55 -12.64 21.79 Favored 'Trans proline' 0 N--CA 1.495 1.59 0 C-N-CA 122.829 2.353 . . . . 0.0 112.061 179.543 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 8.6 pt20 . . . . . 0 C--N 1.323 -0.56 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.785 -179.711 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 75.2 p . . . . . 0 N--CA 1.46 0.071 0 CA-C-O 120.905 0.383 . . . . 0.0 110.762 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 107' ' ' GLU . . . . . 0.525 ' OE1' ' N ' ' A' ' 107' ' ' GLU . 44.3 mp0 -139.71 167.26 22.5 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.349 -179.752 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 108' ' ' GLU . . . . . 0.461 ' C ' ' N ' ' A' ' 110' ' ' LEU . 81.2 mm-40 -94.21 128.86 40.91 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.071 179.49 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 45.4 pt -47.23 -15.85 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.187 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.461 ' N ' ' C ' ' A' ' 108' ' ' GLU . 34.8 mt -64.01 -42.86 97.01 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.367 179.767 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -70.52 -32.33 69.75 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.542 179.692 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 14.2 t -58.91 -45.77 89.51 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.908 -178.973 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 32.0 t30 -66.37 -46.59 76.17 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.871 0.367 . . . . 0.0 110.858 179.801 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 31.2 p -162.28 158.81 24.78 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.61 179.785 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 33.8 mt-30 -99.06 13.04 34.22 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.79 0.329 . . . . 0.0 110.382 179.769 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 14.8 m -59.23 -47.59 84.8 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.147 -179.751 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 99.4 m-20 . . . . . 0 C--N 1.329 -0.285 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.568 179.543 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.682 0 N-CA-C 111.033 -0.827 . . . . 0.0 111.033 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 87.6 mt-30 -61.78 -23.22 66.05 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.902 0.382 . . . . 0.0 110.315 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 34.1 tp10 -51.92 -21.68 3.21 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.519 179.898 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.48 ' O ' ' OE1' ' A' ' 9' ' ' GLU . 33.6 tp -41.07 -39.59 1.27 Allowed 'General case' 0 C--O 1.235 0.312 0 CA-C-O 121.026 0.441 . . . . 0.0 110.284 -179.348 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 89.9 p -47.53 -36.76 10.9 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 120.758 -0.377 . . . . 0.0 110.244 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 72.3 tp60 -63.77 -32.46 73.97 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.467 179.608 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 53.9 t60 -59.24 -44.8 92.35 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 120.664 -0.414 . . . . 0.0 110.235 -179.932 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.48 ' OE1' ' O ' ' A' ' 5' ' ' LEU . 56.5 mp0 -61.73 -49.19 77.44 Favored 'General case' 0 C--O 1.244 0.77 0 C-N-CA 120.36 -0.536 . . . . 0.0 110.342 179.707 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.442 ' O ' ' CB ' ' A' ' 14' ' ' GLN . 75.3 mtm-85 -63.8 -31.73 73.0 Favored 'General case' 0 C--O 1.211 -0.968 0 C-N-CA 120.19 -0.604 . . . . 0.0 109.429 179.485 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 31.5 t80 -59.86 -36.69 77.4 Favored 'General case' 0 C--N 1.323 -0.575 0 C-N-CA 120.889 -0.324 . . . . 0.0 110.315 -179.664 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 4.0 t -63.78 -49.34 82.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 C-N-CA 120.077 -0.649 . . . . 0.0 111.196 179.924 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -81.22 -34.28 32.3 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 120.438 -0.505 . . . . 0.0 111.874 -179.265 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' GLN . . . . . 0.442 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 70.5 tp60 -70.39 -52.98 18.51 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.049 -178.93 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.573 HD13 ' O ' ' A' ' 15' ' ' LEU . 0.2 OUTLIER -62.7 -47.01 85.49 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 109.988 -0.375 . . . . 0.0 109.988 -179.501 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.431 ' HB3' HG11 ' A' ' 26' ' ' VAL . 97.0 mttt -57.32 -32.73 66.99 Favored 'General case' 0 C--N 1.33 -0.257 0 C-N-CA 120.667 -0.413 . . . . 0.0 110.143 179.355 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 56.1 tt0 -71.05 -37.6 72.53 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.98 0.419 . . . . 0.0 110.467 179.304 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -58.14 -36.97 73.75 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.184 -179.858 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.4 mt -82.16 -27.04 32.91 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.01 0.433 . . . . 0.0 110.48 179.376 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -55.77 -37.73 68.93 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.072 -179.783 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' THR . . . . . 0.424 HG22 ' H ' ' A' ' 21' ' ' THR . 1.3 t -76.56 -20.82 56.44 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.633 179.817 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 61.0 mmt-85 -73.7 -3.31 27.52 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 120.769 0.318 . . . . 0.0 110.308 179.67 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 107.0 19.67 9.37 Favored Glycine 0 CA--C 1.526 0.747 0 N-CA-C 110.728 -0.949 . . . . 0.0 110.728 -179.601 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.613 HG12 ' N ' ' A' ' 25' ' ' LYS . 26.2 t -105.35 167.43 3.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 N-CA-C 110.327 -0.249 . . . . 0.0 110.327 -179.934 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.613 ' N ' HG12 ' A' ' 24' ' ' VAL . 99.6 mttt -125.86 131.99 52.28 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.348 179.359 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.431 HG11 ' HB3' ' A' ' 16' ' ' LYS . 1.7 m -134.79 108.94 11.09 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.289 0 CA-C-N 116.506 -0.315 . . . . 0.0 110.355 179.838 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.6 ' HD3' ' H ' ' A' ' 29' ' ' ALA . 14.5 tmtt? -109.25 161.72 14.97 Favored 'General case' 0 C--O 1.221 -0.398 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 179.976 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.478 ' CE2' HD21 ' A' ' 32' ' ' LEU . 58.0 t80 -40.58 -29.58 0.09 Allowed 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.095 0.474 . . . . 0.0 110.966 179.588 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.6 ' H ' ' HD3' ' A' ' 27' ' ' LYS . . . -60.65 -24.44 65.56 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.835 -179.797 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.84 -45.77 91.05 Favored 'General case' 0 C--O 1.221 -0.426 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.406 -179.335 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.494 ' H ' HD12 ' A' ' 31' ' ' LEU . 5.5 mp -64.77 -41.03 96.17 Favored 'General case' 0 C--O 1.216 -0.693 0 CA-C-O 120.989 0.423 . . . . 0.0 110.156 179.591 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.478 HD21 ' CE2' ' A' ' 28' ' ' TYR . 56.2 mt -55.34 -46.1 76.4 Favored 'General case' 0 C--N 1.316 -0.869 0 C-N-CA 119.453 -0.899 . . . . 0.0 111.118 -178.765 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 63.9 tttm -84.68 -50.45 7.63 Favored 'General case' 0 C--N 1.32 -0.676 0 C-N-CA 120.496 -0.482 . . . . 0.0 111.771 -179.25 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' PHE . . . . . 0.441 ' O ' HG22 ' A' ' 38' ' ' VAL . 74.9 t80 -61.16 -50.42 73.25 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.312 -178.786 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.485 ' CB ' ' O ' ' A' ' 31' ' ' LEU . 17.7 t80 -60.75 -46.12 91.66 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.29 -179.36 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 91.7 m-20 -70.17 -25.27 63.36 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 120.601 -0.44 . . . . 0.0 111.339 -179.541 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -65.03 -53.43 46.05 Favored 'General case' 0 N--CA 1.462 0.143 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.593 -179.074 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.505 ' O ' ' N ' ' A' ' 42' ' ' CYS . 2.6 m -72.86 -39.46 58.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 C-N-CA 120.481 -0.488 . . . . 0.0 111.037 -179.579 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 25.1 mmtt -57.93 -25.82 61.4 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.724 -179.528 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 85.3 m-20 -49.84 -63.6 1.06 Allowed 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 120.684 -0.406 . . . . 0.0 111.004 179.933 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.4 ' C ' ' SG ' ' A' ' 42' ' ' CYS . 1.6 p -114.59 -11.01 12.45 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.538 -0.301 . . . . 0.0 111.319 -179.939 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 42' ' ' CYS . . . . . 0.505 ' N ' ' O ' ' A' ' 38' ' ' VAL . 1.5 m 63.72 47.35 0.77 Allowed Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.697 -179.385 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' PRO . . . . . 0.499 ' CD ' ' N ' ' A' ' 42' ' ' CYS . 57.9 Cg_endo -72.23 -30.45 13.03 Favored 'Trans proline' 0 N--CA 1.493 1.458 0 C-N-CA 122.699 2.266 . . . . 0.0 112.432 179.928 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' TRP . . . . . 0.429 ' HE1' ' HA ' ' A' ' 51' ' ' ILE . 2.0 t-105 -58.32 -3.41 0.27 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.433 -179.643 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.494 ' H ' ' C ' ' A' ' 43' ' ' PRO . 2.9 t80 50.45 53.45 14.06 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.168 0.508 . . . . 0.0 110.16 -179.837 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.477 ' CD ' ' N ' ' A' ' 45' ' ' PHE . 38.3 Cg_endo -67.94 -12.35 35.01 Favored 'Trans proline' 0 C--N 1.308 -1.602 0 C-N-CA 122.835 2.357 . . . . 0.0 112.065 179.846 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 52.9 tt0 -59.11 -46.43 88.35 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.194 -179.688 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 44.9 tt0 -89.27 -18.03 27.82 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.029 0.443 . . . . 0.0 110.332 179.584 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 77.11 66.56 1.79 Allowed Glycine 0 CA--C 1.525 0.696 0 N-CA-C 110.247 -1.141 . . . . 0.0 110.247 -178.921 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' THR . . . . . 0.506 ' OG1' ' NE2' ' A' ' 98' ' ' GLN . 2.9 t -138.0 155.67 48.61 Favored 'General case' 0 C--N 1.33 -0.282 0 C-N-CA 121.043 -0.263 . . . . 0.0 110.658 -179.548 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.429 ' HA ' ' HE1' ' A' ' 44' ' ' TRP . 1.5 mt -87.7 140.6 15.54 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.2 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.305 179.3 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 52' ' ' ASP . . . . . 0.432 ' OD2' ' O ' ' A' ' 43' ' ' PRO . 69.8 m-20 -111.14 120.12 41.25 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.191 179.631 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.511 ' CG1' HD12 ' A' ' 90' ' ' ILE . 24.9 mm -94.78 -56.07 5.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.893 179.215 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -78.0 -49.41 14.12 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.561 -179.464 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.569 ' CG ' HH21 ' A' ' 58' ' ' ARG . 83.8 mtt85 -59.95 -32.59 70.95 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.132 -0.486 . . . . 0.0 109.958 -179.708 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 56' ' ' TRP . . . . . 0.748 ' HE1' ' HE1' ' A' ' 83' ' ' TRP . 18.2 t-105 -62.89 -39.9 95.91 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.52 179.359 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 83.6 mtp180 -63.48 -35.24 79.8 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.444 -179.794 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' ARG . . . . . 0.569 HH21 ' CG ' ' A' ' 55' ' ' ARG . 43.6 mtm-85 -60.16 -50.92 71.77 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 120.509 -0.476 . . . . 0.0 111.006 -179.96 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.405 HG13 ' N ' ' A' ' 60' ' ' GLY . 7.4 p -73.96 -39.48 51.39 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.377 0 C-N-CA 120.861 -0.335 . . . . 0.0 110.644 179.581 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 60' ' ' GLY . . . . . 0.433 ' O ' ' CB ' ' A' ' 64' ' ' GLN . . . -63.07 -49.21 73.67 Favored Glycine 0 C--O 1.222 -0.634 0 N-CA-C 111.353 -0.699 . . . . 0.0 111.353 -179.225 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 66.2 t0 -61.82 -44.87 95.99 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 120.625 0.25 . . . . 0.0 111.156 -179.497 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' CYS . . . . . 0.436 ' SG ' ' O ' ' A' ' 58' ' ' ARG . 73.3 m -62.9 -55.83 22.57 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.207 -179.227 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 12.6 m-85 -64.22 -43.23 95.63 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.1 -179.821 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' GLN . . . . . 0.585 ' HG2' HD22 ' A' ' 68' ' ' ASN . 61.3 tt0 -62.37 -39.82 94.43 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.651 -179.45 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -57.01 -54.07 50.93 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 120.765 -0.374 . . . . 0.0 110.849 -179.865 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 66.4 m-85 -67.86 -39.77 83.72 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.706 179.764 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' TYR . . . . . 0.523 ' O ' ' N ' ' A' ' 71' ' ' GLY . 57.1 t80 -58.75 -41.88 87.52 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.427 -179.501 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 68' ' ' ASN . . . . . 0.585 HD22 ' HG2' ' A' ' 64' ' ' GLN . 39.9 m-20 -62.79 -45.29 93.35 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.331 -178.964 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 24.6 p -74.98 -20.12 59.8 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 120.608 -0.437 . . . . 0.0 109.985 -179.433 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 47.6 m-85 -114.11 16.28 18.14 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.401 179.945 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' GLY . . . . . 0.523 ' N ' ' O ' ' A' ' 67' ' ' TYR . . . -154.18 -111.03 0.41 Allowed Glycine 0 CA--C 1.534 1.239 0 N-CA-C 111.06 -0.816 . . . . 0.0 111.06 -179.984 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -73.06 140.1 30.78 Favored 'Trans proline' 0 N--CA 1.494 1.548 0 C-N-CA 121.989 1.793 . . . . 0.0 113.177 -179.34 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 80.7 mm-40 -86.28 -42.84 13.41 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.487 179.326 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.694 ' CD ' ' H ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -80.78 -24.63 38.48 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.027 179.933 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.498 ' H ' ' HD3' ' A' ' 74' ' ' LYS . 75.2 t 53.91 101.04 0.03 OUTLIER Pre-proline 0 N--CA 1.449 -0.481 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.189 -179.719 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 44.5 Cg_exo -55.05 129.28 34.44 Favored 'Trans proline' 0 N--CA 1.492 1.413 0 C-N-CA 121.666 1.578 . . . . 0.0 111.758 179.845 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.504 ' O ' HG12 ' A' ' 77' ' ' VAL . 48.3 t -82.31 -6.81 10.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.835 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 43.2 p -44.26 -23.23 0.09 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.64 -179.817 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' ALA . . . . . 0.407 ' N ' ' C ' ' A' ' 77' ' ' VAL . . . -57.62 -28.91 64.09 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.079 0.466 . . . . 0.0 110.431 179.73 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 48.8 t80 -61.19 -39.63 90.9 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.153 179.529 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 66.9 m -56.14 -40.14 73.36 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.391 -179.9 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 14.2 m-85 -60.99 -48.94 79.49 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 120.737 -0.385 . . . . 0.0 110.792 179.65 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 83' ' ' TRP . . . . . 0.748 ' HE1' ' HE1' ' A' ' 56' ' ' TRP . 40.5 m0 -57.72 -36.11 71.58 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.57 -179.652 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 78.7 m-20 -62.77 -47.47 83.37 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 120.388 -0.525 . . . . 0.0 110.899 -179.863 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 36.7 tp -71.25 -52.47 18.84 Favored 'General case' 0 C--O 1.219 -0.524 0 C-N-CA 120.333 -0.547 . . . . 0.0 110.588 179.611 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -58.42 -26.68 31.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 C-N-CA 120.804 -0.358 . . . . 0.0 110.552 -179.889 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.405 ' CB ' ' O ' ' A' ' 83' ' ' TRP . 63.4 tttt -65.97 -49.65 67.12 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.634 179.884 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.1 pp20? -80.07 -20.72 44.53 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.007 -179.665 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.538 ' O ' HD13 ' A' ' 89' ' ' LEU . 0.2 OUTLIER -61.49 -47.12 87.11 Favored 'General case' 0 N--CA 1.443 -0.793 0 C-N-CA 120.172 -0.611 . . . . 0.0 110.322 -179.111 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.511 HD12 ' CG1' ' A' ' 53' ' ' ILE . 3.4 mt -64.4 -44.4 97.11 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.156 0 C-N-CA 120.174 -0.611 . . . . 0.0 109.775 -179.815 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 91' ' ' ASP . . . . . 0.458 ' O ' ' OD1' ' A' ' 91' ' ' ASP . 64.6 t0 -62.19 -37.22 84.46 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.063 -179.16 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 92' ' ' LYS . . . . . 0.639 ' O ' HG23 ' A' ' 95' ' ' VAL . 26.6 tttm -42.12 145.57 0.36 Allowed 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.929 0.395 . . . . 0.0 110.363 -179.58 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 57.5 mttp -79.43 -17.09 55.01 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.669 -179.637 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 71.1 mm-40 -109.64 53.14 0.7 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.642 -179.777 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.639 HG23 ' O ' ' A' ' 92' ' ' LYS . 44.9 t -73.09 148.08 9.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-O 120.911 0.386 . . . . 0.0 110.431 179.696 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 96' ' ' ASN . . . . . 0.614 ' O ' ' N ' ' A' ' 98' ' ' GLN . 0.0 OUTLIER -41.91 166.81 0.07 OUTLIER Pre-proline 0 C--N 1.327 -0.402 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.291 179.971 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_exo -39.59 -13.16 0.02 OUTLIER 'Trans proline' 0 N--CA 1.493 1.471 0 C-N-CA 123.079 2.52 . . . . 0.0 112.713 178.868 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 98' ' ' GLN . . . . . 0.614 ' N ' ' O ' ' A' ' 96' ' ' ASN . 8.8 tt0 . . . . . 0 C--N 1.323 -0.556 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.101 179.197 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 11.0 m . . . . . 0 N--CA 1.457 -0.106 0 CA-C-O 120.721 0.296 . . . . 0.0 110.329 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 94.4 mt-10 -117.54 141.33 48.49 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.498 -179.794 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 108' ' ' GLU . . . . . 0.551 ' C ' ' H ' ' A' ' 110' ' ' LEU . 95.2 mt-10 -66.45 133.12 49.78 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 120.644 -0.423 . . . . 0.0 110.132 179.325 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 42.2 pt -55.39 -2.14 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.19 179.466 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.551 ' H ' ' C ' ' A' ' 108' ' ' GLU . 95.6 mt -96.45 5.96 49.75 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-O 120.806 0.336 . . . . 0.0 110.463 -179.762 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -114.45 129.68 56.67 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.385 179.904 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 30.2 p -136.86 -119.94 0.15 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.273 179.884 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 113' ' ' ASN . . . . . 0.416 ' C ' ' OD1' ' A' ' 113' ' ' ASN . 43.4 t-20 -64.39 -41.39 96.7 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.371 179.8 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 68.6 m -134.27 154.8 51.08 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.61 -179.848 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 87.4 mt-30 -87.08 85.42 7.23 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.391 179.9 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 7.3 m -63.58 -45.26 91.23 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.63 -179.771 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 72.7 m-20 . . . . . 0 C--N 1.331 -0.216 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.763 -179.397 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 2' ' ' GLY . . . . . 0.526 ' O ' ' N ' ' A' ' 6' ' ' SER . . . . . . . . 0 CA--C 1.523 0.592 0 N-CA-C 110.464 -1.054 . . . . 0.0 110.464 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 20.6 pt20 -43.09 -24.94 0.09 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.847 0.356 . . . . 0.0 110.658 -179.679 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 4' ' ' GLU . . . . . 0.415 ' N ' ' O ' ' A' ' 2' ' ' GLY . 98.0 mt-10 -73.8 -64.69 0.95 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.69 -179.862 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.734 HD12 ' N ' ' A' ' 6' ' ' SER . 4.0 pp -83.83 -41.07 17.9 Favored 'General case' 0 C--O 1.223 -0.32 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.246 -179.944 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 6' ' ' SER . . . . . 0.734 ' N ' HD12 ' A' ' 5' ' ' LEU . 16.5 m -49.95 -45.91 51.77 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 120.823 -0.351 . . . . 0.0 110.695 -178.7 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 7' ' ' GLN . . . . . 0.583 ' NE2' ' O ' ' A' ' 46' ' ' PRO . 25.2 mt-30 -62.14 -29.18 70.16 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 120.751 -0.38 . . . . 0.0 110.536 179.483 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 8' ' ' HIS . . . . . 0.489 ' O ' HG23 ' A' ' 12' ' ' VAL . 33.3 m170 -80.15 -53.41 6.71 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.807 0.336 . . . . 0.0 111.616 -179.408 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 80.4 mm-40 -65.78 -43.7 87.98 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.282 -179.096 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.536 ' O ' ' N ' ' A' ' 14' ' ' GLN . 96.1 mtt-85 -68.98 -55.24 11.52 Favored 'General case' 0 C--O 1.216 -0.668 0 C-N-CA 120.531 -0.468 . . . . 0.0 110.582 -179.369 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 46.3 t80 -46.68 -38.7 10.18 Favored 'General case' 0 C--N 1.319 -0.759 0 C-N-CA 119.793 -0.763 . . . . 0.0 110.903 -179.215 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.489 HG23 ' O ' ' A' ' 8' ' ' HIS . 73.9 t -71.41 -60.15 2.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 N-CA-C 112.337 0.495 . . . . 0.0 112.337 -179.389 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.477 ' O ' ' CB ' ' A' ' 17' ' ' GLN . 95.3 mt-10 -80.16 -47.68 14.34 Favored 'General case' 0 C--O 1.213 -0.861 0 C-N-CA 120.804 -0.359 . . . . 0.0 111.431 -178.77 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' GLN . . . . . 0.536 ' N ' ' O ' ' A' ' 10' ' ' ARG . 51.5 tp60 -50.9 -44.16 59.94 Favored 'General case' 0 C--N 1.317 -0.83 0 C-N-CA 120.794 -0.363 . . . . 0.0 110.577 -179.192 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.5 HD13 ' O ' ' A' ' 15' ' ' LEU . 0.2 OUTLIER -78.01 -59.15 2.9 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 120.123 -0.631 . . . . 0.0 111.896 -179.041 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.667 ' HB3' HG11 ' A' ' 26' ' ' VAL . 98.5 mttt -56.8 -35.49 68.8 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.882 -178.54 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' GLN . . . . . 0.477 ' CB ' ' O ' ' A' ' 13' ' ' GLU . 60.3 tt0 -71.61 -40.24 69.95 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.499 179.885 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -55.64 -32.8 63.48 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 -179.783 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.444 HD13 ' CZ ' ' A' ' 82' ' ' TYR . 3.5 mt -86.09 -31.81 21.7 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.151 179.132 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -51.62 -43.97 62.73 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.933 -178.696 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' THR . . . . . 0.462 HG22 ' H ' ' A' ' 21' ' ' THR . 0.2 OUTLIER -64.96 -30.45 71.44 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.577 179.91 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 78.5 mmt-85 -67.7 -7.56 28.01 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.318 -179.772 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 107.17 19.52 9.4 Favored Glycine 0 CA--C 1.525 0.683 0 N-CA-C 111.121 -0.792 . . . . 0.0 111.121 179.696 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.63 HG12 ' N ' ' A' ' 25' ' ' LYS . 38.8 t -101.82 167.95 2.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 N-CA-C 110.212 -0.292 . . . . 0.0 110.212 179.897 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.63 ' N ' HG12 ' A' ' 24' ' ' VAL . 99.0 mttt -132.74 144.63 50.41 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.399 179.57 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.667 HG11 ' HB3' ' A' ' 16' ' ' LYS . 30.0 m -132.12 130.55 60.93 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.354 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.699 179.91 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 14.3 pttp -109.81 163.78 13.2 Favored 'General case' 0 C--O 1.228 -0.056 0 CA-C-O 120.741 0.305 . . . . 0.0 110.499 179.66 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 93.6 m-85 -49.77 -32.13 13.14 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.959 0.409 . . . . 0.0 110.519 179.999 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -55.12 -24.35 25.6 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.39 179.84 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.46 ' O ' ' CB ' ' A' ' 34' ' ' PHE . 99.0 m-20 -64.44 -46.1 84.62 Favored 'General case' 0 C--O 1.22 -0.492 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.808 -179.987 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.478 ' O ' ' CB ' ' A' ' 35' ' ' PHE . 5.3 mp -63.53 -40.42 96.99 Favored 'General case' 0 C--N 1.315 -0.902 0 C-N-CA 120.23 -0.588 . . . . 0.0 110.407 -179.747 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 30.8 mt -58.8 -49.78 76.39 Favored 'General case' 0 C--N 1.313 -0.98 0 C-N-CA 119.634 -0.826 . . . . 0.0 111.549 -178.179 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -87.75 -51.19 6.0 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 112.591 0.589 . . . . 0.0 112.591 -178.58 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' PHE . . . . . 0.682 ' O ' HG22 ' A' ' 38' ' ' VAL . 9.7 t80 -59.68 -50.25 74.56 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.805 -178.344 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.478 ' CB ' ' O ' ' A' ' 31' ' ' LEU . 10.0 t80 -63.47 -47.91 79.82 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.499 -0.48 . . . . 0.0 110.666 -179.966 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 55.1 t0 -67.69 -29.19 68.39 Favored 'General case' 0 N--CA 1.456 -0.145 0 C-N-CA 120.426 -0.51 . . . . 0.0 111.176 -179.418 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.572 ' CZ ' HG22 ' A' ' 59' ' ' VAL . 9.9 t80 -66.34 -51.53 56.25 Favored 'General case' 0 C--N 1.332 -0.173 0 C-N-CA 120.642 -0.423 . . . . 0.0 111.611 -178.255 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.682 HG22 ' O ' ' A' ' 34' ' ' PHE . 9.1 m -76.47 -39.14 33.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.95 -179.708 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -62.74 -26.78 68.86 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.596 -179.555 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 40.5 t0 -52.97 -52.95 56.43 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.856 -179.299 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 12.0 p -114.07 -6.65 13.1 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.143 179.947 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' CYS . . . . . 0.522 ' N ' ' O ' ' A' ' 38' ' ' VAL . 3.3 m 43.44 56.52 12.22 Favored Pre-proline 0 CA--C 1.532 0.267 0 CA-C-O 120.885 0.374 . . . . 0.0 110.28 -178.967 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' PRO . . . . . 0.539 ' C ' ' H ' ' A' ' 45' ' ' PHE . 61.2 Cg_endo -79.34 -15.19 12.76 Favored 'Trans proline' 0 C--N 1.313 -1.304 0 C-N-CA 122.378 2.052 . . . . 0.0 112.428 -179.795 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 44' ' ' TRP . . . . . 0.503 ' CZ3' ' CE3' ' A' ' 56' ' ' TRP . 0.0 OUTLIER -69.71 22.06 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.474 -179.238 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.539 ' H ' ' C ' ' A' ' 43' ' ' PRO . 18.1 t80 36.25 68.86 1.33 Allowed Pre-proline 0 C--O 1.233 0.191 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.343 179.981 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.583 ' O ' ' NE2' ' A' ' 7' ' ' GLN . 48.9 Cg_endo -75.18 -0.45 10.04 Favored 'Trans proline' 0 C--N 1.305 -1.751 0 C-N-CA 122.69 2.26 . . . . 0.0 112.189 -179.252 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 86.9 mt-30 -60.31 -52.83 63.6 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 120.604 -0.438 . . . . 0.0 110.538 -179.797 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 58.9 tt0 -89.23 -14.49 35.83 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.778 0.323 . . . . 0.0 110.448 179.717 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' GLY . . . . . 0.471 ' O ' ' CB ' ' A' ' 98' ' ' GLN . . . 72.94 58.02 5.0 Favored Glycine 0 CA--C 1.524 0.63 0 N-CA-C 110.336 -1.106 . . . . 0.0 110.336 -178.929 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 2.6 t -132.54 169.2 16.94 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.886 0.374 . . . . 0.0 110.79 -179.331 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.478 ' CD1' HD23 ' A' ' 89' ' ' LEU . 1.4 mt -85.02 142.17 13.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.434 179.345 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 80.0 m-20 -111.25 121.54 45.53 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.648 -0.705 . . . . 0.0 111.246 179.468 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.459 ' CG1' HD12 ' A' ' 90' ' ' ILE . 31.1 mm -94.11 -55.0 6.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.28 179.231 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -71.96 -55.23 7.83 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-O 120.873 0.368 . . . . 0.0 111.796 -178.708 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 86.5 mtm-85 -57.51 -30.49 65.18 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.178 -0.465 . . . . 0.0 109.999 -179.607 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' TRP . . . . . 0.503 ' CE3' ' CZ3' ' A' ' 44' ' ' TRP . 12.5 t-105 -62.73 -41.36 99.13 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.727 178.856 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 96.5 mtt-85 -63.24 -33.57 75.77 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.453 -179.835 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' ARG . . . . . 0.489 ' O ' ' SG ' ' A' ' 62' ' ' CYS . 96.7 mtt180 -63.14 -51.77 65.15 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.552 -0.459 . . . . 0.0 111.285 -179.384 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.572 HG22 ' CZ ' ' A' ' 37' ' ' PHE . 3.3 p -66.24 -35.52 75.17 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.333 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.678 179.84 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -73.22 -48.87 17.74 Favored Glycine 0 CA--C 1.528 0.861 0 C-N-CA 120.911 -0.662 . . . . 0.0 111.778 -179.674 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 95.8 m-20 -62.92 -44.51 95.88 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.669 0.271 . . . . 0.0 111.473 -179.074 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' CYS . . . . . 0.489 ' SG ' ' O ' ' A' ' 58' ' ' ARG . 74.6 m -60.73 -58.93 6.36 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.877 0.37 . . . . 0.0 110.877 -179.356 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 24.7 m-85 -61.64 -41.0 96.88 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.81 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 53.9 tt0 -60.59 -39.29 87.56 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.5 -0.318 . . . . 0.0 111.055 -179.873 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.472 ' O ' ' OD1' ' A' ' 68' ' ' ASN . 20.2 t0 -58.25 -52.1 67.01 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 120.943 0.402 . . . . 0.0 110.68 -179.704 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 83.6 m-85 -73.18 -41.14 64.18 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 120.473 -0.491 . . . . 0.0 111.309 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 62.6 t80 -57.55 -47.39 82.16 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.803 -178.78 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' ASN . . . . . 0.472 ' OD1' ' O ' ' A' ' 65' ' ' ASP . 0.2 OUTLIER -62.8 -41.65 99.37 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.676 -179.853 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.468 ' N ' ' ND2' ' A' ' 68' ' ' ASN . 40.8 p -66.43 -17.97 65.09 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.268 179.972 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 7.9 m-85 -98.8 14.87 27.28 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.547 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 166.22 -87.71 0.1 OUTLIER Glycine 0 CA--C 1.535 1.328 0 C-N-CA 120.764 -0.731 . . . . 0.0 111.734 179.53 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' PRO . . . . . 0.423 ' O ' ' O ' ' A' ' 68' ' ' ASN . 33.7 Cg_exo -51.13 126.59 19.38 Favored 'Trans proline' 0 N--CA 1.496 1.624 0 C-N-CA 121.866 1.711 . . . . 0.0 112.592 179.938 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.521 ' N ' ' OE1' ' A' ' 73' ' ' GLU . 58.4 mp0 -86.82 -43.93 12.11 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.905 -0.588 . . . . 0.0 110.506 179.286 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.628 ' CD ' ' H ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -104.26 -7.57 19.95 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.108 -179.695 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.419 ' N ' ' HD3' ' A' ' 74' ' ' LYS . 30.2 t 59.41 133.38 0.03 OUTLIER Pre-proline 0 N--CA 1.448 -0.551 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.718 -178.978 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -53.43 129.21 32.58 Favored 'Trans proline' 0 N--CA 1.493 1.459 0 C-N-CA 121.535 1.49 . . . . 0.0 111.238 178.043 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.425 ' O ' ' N ' ' A' ' 80' ' ' PHE . 59.6 t -80.85 -16.54 12.47 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.687 179.891 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 65.7 p -45.94 -22.82 0.23 Allowed 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.945 0.402 . . . . 0.0 110.072 -179.931 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -67.6 -34.8 77.74 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.68 179.403 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 80' ' ' PHE . . . . . 0.425 ' N ' ' O ' ' A' ' 77' ' ' VAL . 10.2 m-85 -57.74 -35.38 70.63 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.33 -179.633 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 94.9 p -60.36 -40.29 90.22 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.355 179.87 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 82' ' ' TYR . . . . . 0.444 ' CZ ' HD13 ' A' ' 19' ' ' LEU . 13.8 m-85 -60.17 -49.39 77.81 Favored 'General case' 0 C--O 1.223 -0.29 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.797 179.81 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 83' ' ' TRP . . . . . 0.519 ' N ' ' CD1' ' A' ' 83' ' ' TRP . 9.6 m0 -59.12 -40.39 85.24 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.311 179.956 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 78.0 m-20 -62.68 -43.23 99.33 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 120.691 -0.404 . . . . 0.0 110.572 -179.923 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -70.25 -55.43 9.29 Favored 'General case' 0 C--O 1.221 -0.416 0 N-CA-C 110.215 -0.291 . . . . 0.0 110.215 179.409 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -60.88 -25.52 35.95 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.884 0 C-N-CA 120.959 -0.296 . . . . 0.0 110.717 -179.66 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.426 ' CB ' ' O ' ' A' ' 83' ' ' TRP . 42.2 tttp -65.26 -50.16 66.83 Favored 'General case' 0 C--N 1.317 -0.807 0 C-N-CA 120.467 -0.493 . . . . 0.0 110.555 179.716 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.1 pp20? -80.34 -19.69 45.91 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.679 -179.891 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.478 HD23 ' CD1' ' A' ' 51' ' ' ILE . 14.5 tp -61.5 -45.02 96.0 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.354 -179.015 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.459 HD12 ' CG1' ' A' ' 53' ' ' ILE . 3.6 mt -65.04 -43.86 95.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 C-N-CA 120.293 -0.563 . . . . 0.0 109.956 -179.778 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 94.1 m-20 -65.16 -8.02 15.15 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.841 -178.938 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 84.7 tttt -66.9 146.13 54.73 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.42 179.91 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -61.7 -41.64 97.87 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.661 -179.843 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 94' ' ' GLU . . . . . 0.46 ' O ' ' C ' ' A' ' 95' ' ' VAL . 97.9 mt-10 -77.66 6.94 6.34 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.828 -179.82 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.46 ' C ' ' O ' ' A' ' 94' ' ' GLU . 2.7 m 30.72 -110.62 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.283 0 O-C-N 123.692 0.62 . . . . 0.0 110.707 -179.806 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 96' ' ' ASN . . . . . 0.531 ' O ' ' N ' ' A' ' 98' ' ' GLN . 0.8 OUTLIER -153.32 160.86 30.43 Favored Pre-proline 0 N--CA 1.45 -0.438 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.568 179.356 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_exo -44.5 -12.23 0.05 OUTLIER 'Trans proline' 0 C--N 1.31 -1.473 0 C-N-CA 122.689 2.259 . . . . 0.0 112.146 178.974 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 98' ' ' GLN . . . . . 0.531 ' N ' ' O ' ' A' ' 96' ' ' ASN . 6.0 pt20 . . . . . 0 C--N 1.323 -0.57 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.896 -179.861 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 24.1 p . . . . . 0 C--O 1.231 0.1 0 CA-C-O 120.84 0.352 . . . . 0.0 110.623 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 85.4 mt-10 -56.99 142.52 41.62 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.385 -179.587 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 108' ' ' GLU . . . . . 0.555 ' C ' ' H ' ' A' ' 110' ' ' LEU . 92.2 mt-10 -65.4 136.25 56.26 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.768 -0.373 . . . . 0.0 110.201 179.626 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 45.3 pt -61.14 4.14 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.364 179.622 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.555 ' H ' ' C ' ' A' ' 108' ' ' GLU . 96.4 mt -101.73 -5.98 24.26 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.892 0.377 . . . . 0.0 110.538 -179.735 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 63.2 tttm -102.37 128.77 48.81 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.683 -179.969 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 112' ' ' SER . . . . . 0.532 ' OG ' ' N ' ' A' ' 113' ' ' ASN . 3.1 p -87.57 -147.13 0.14 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.463 -179.875 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 113' ' ' ASN . . . . . 0.532 ' N ' ' OG ' ' A' ' 112' ' ' SER . 90.5 m-20 -62.09 -42.32 99.09 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.385 -179.442 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 92.9 p -153.86 -5.74 0.17 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.582 179.941 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 94.9 mm-40 -70.82 150.3 45.96 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.422 -179.695 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 73.1 p -72.8 169.73 16.14 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.405 -179.873 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 88.8 m-20 . . . . . 0 C--N 1.33 -0.258 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.47 -179.69 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.752 0 N-CA-C 110.984 -0.846 . . . . 0.0 110.984 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 88.1 mt-30 -64.24 -38.97 92.95 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.779 0.323 . . . . 0.0 110.733 179.997 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 4' ' ' GLU . . . . . 0.412 ' O ' ' N ' ' A' ' 7' ' ' GLN . 90.4 mt-10 -47.96 -22.95 0.66 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.509 -179.969 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 51.8 tp -41.97 -34.57 0.71 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.26 -179.55 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 42.6 m -55.09 -42.05 72.34 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.077 0.465 . . . . 0.0 110.327 -179.899 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' GLN . . . . . 0.412 ' N ' ' O ' ' A' ' 4' ' ' GLU . 95.2 mt-30 -61.1 -30.8 70.57 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.883 -0.598 . . . . 0.0 110.689 179.614 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 59.4 t-80 -62.1 -41.72 98.5 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.023 0.439 . . . . 0.0 110.117 179.72 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 80.1 mm-40 -60.27 -46.65 89.07 Favored 'General case' 0 C--O 1.245 0.819 0 CA-C-O 121.562 0.696 . . . . 0.0 110.026 179.937 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.41 ' O ' ' CB ' ' A' ' 14' ' ' GLN . 24.5 mtm180 -63.48 -29.02 70.37 Favored 'General case' 0 C--O 1.217 -0.608 0 C-N-CA 120.241 -0.583 . . . . 0.0 109.799 179.506 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 37.8 t80 -62.86 -36.71 84.16 Favored 'General case' 0 C--N 1.328 -0.327 0 O-C-N 123.562 0.539 . . . . 0.0 109.888 179.902 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 3.7 t -62.66 -48.32 88.71 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 C-N-CA 119.837 -0.745 . . . . 0.0 110.834 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 79.8 mm-40 -80.87 -38.9 27.31 Favored 'General case' 0 C--N 1.322 -0.595 0 C-N-CA 119.935 -0.706 . . . . 0.0 111.767 -179.173 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' GLN . . . . . 0.41 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 63.9 tp60 -65.38 -53.05 48.92 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.538 -0.755 . . . . 0.0 110.865 -179.171 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.577 HD13 ' O ' ' A' ' 15' ' ' LEU . 0.3 OUTLIER -63.12 -45.86 90.02 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.453 -0.499 . . . . 0.0 109.917 -179.126 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 53.8 mttp -54.82 -32.5 60.48 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 120.204 -0.599 . . . . 0.0 110.503 179.79 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 59.9 tt0 -67.16 -41.32 86.19 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.556 179.994 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -57.58 -30.35 65.2 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.617 -0.72 . . . . 0.0 109.763 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.2 mt -86.44 -28.82 23.28 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.253 0.549 . . . . 0.0 110.651 178.848 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -51.12 -43.02 61.06 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.779 -178.784 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.73 -28.87 69.89 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.55 179.762 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 82.8 mmt-85 -71.01 -6.34 38.21 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.353 -179.831 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 108.04 20.12 8.57 Favored Glycine 0 CA--C 1.524 0.65 0 N-CA-C 111.16 -0.776 . . . . 0.0 111.16 179.93 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.609 HG12 ' N ' ' A' ' 25' ' ' LYS . 18.3 t -102.29 169.38 1.88 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 N-CA-C 110.345 -0.243 . . . . 0.0 110.345 179.857 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.609 ' N ' HG12 ' A' ' 24' ' ' VAL . 99.4 mttt -115.43 146.69 41.38 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.368 179.803 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.474 ' O ' HG23 ' A' ' 26' ' ' VAL . 2.3 m -115.31 23.4 5.34 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.272 0 CA-C-O 120.996 0.427 . . . . 0.0 110.662 -179.584 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.517 ' N ' ' OD2' ' A' ' 30' ' ' ASP . 33.5 pttt -51.97 163.58 0.34 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.219 -179.712 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 75.8 m-85 -58.15 -35.83 72.12 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.819 -0.352 . . . . 0.0 110.654 -179.727 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.42 ' HB3' ' HD2' ' A' ' 27' ' ' LYS . . . -53.84 -23.8 13.6 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.691 -179.953 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.517 ' OD2' ' N ' ' A' ' 27' ' ' LYS . 59.3 m-20 -63.5 -46.68 84.97 Favored 'General case' 0 C--O 1.223 -0.335 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.685 -179.509 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.502 ' H ' HD12 ' A' ' 31' ' ' LEU . 5.4 mp -67.28 -41.09 86.03 Favored 'General case' 0 C--O 1.221 -0.446 0 CA-C-O 121.251 0.548 . . . . 0.0 110.487 179.575 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.411 HD12 ' HA ' ' A' ' 29' ' ' ALA . 55.7 mt -56.73 -44.84 82.06 Favored 'General case' 0 C--N 1.314 -0.948 0 C-N-CA 119.546 -0.862 . . . . 0.0 111.057 -178.927 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 86.5 tttt -86.09 -49.38 7.82 Favored 'General case' 0 C--N 1.32 -0.714 0 C-N-CA 120.475 -0.49 . . . . 0.0 111.421 -178.922 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 58.0 t80 -61.93 -49.88 74.36 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.237 -178.687 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.482 ' CB ' ' O ' ' A' ' 31' ' ' LEU . 7.9 t80 -62.96 -46.9 85.57 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.189 -179.827 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 94.4 m-20 -65.31 -34.32 78.07 Favored 'General case' 0 C--N 1.347 0.477 0 CA-C-O 120.721 0.296 . . . . 0.0 111.167 -179.432 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.458 ' CE2' ' CD2' ' A' ' 63' ' ' PHE . 1.9 m-85 -60.53 -47.85 84.35 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.919 0.39 . . . . 0.0 111.111 -179.053 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.529 ' O ' ' N ' ' A' ' 42' ' ' CYS . 27.8 m -77.82 -40.2 26.98 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.592 -179.704 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.43 ' N ' HG23 ' A' ' 38' ' ' VAL . 88.2 tttt -56.59 -26.93 56.78 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.635 -179.847 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 93.2 m-20 -54.4 -62.38 1.69 Allowed 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 120.748 -0.381 . . . . 0.0 111.292 -179.043 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.478 ' O ' ' SG ' ' A' ' 42' ' ' CYS . 45.8 p -114.0 5.53 16.14 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.101 -179.506 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' CYS . . . . . 0.529 ' N ' ' O ' ' A' ' 38' ' ' VAL . 28.1 p 37.5 57.97 4.28 Favored Pre-proline 0 N--CA 1.465 0.288 0 CA-C-O 120.772 0.32 . . . . 0.0 110.341 -179.235 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 69.3 Cg_endo -75.79 -11.92 20.04 Favored 'Trans proline' 0 C--N 1.312 -1.343 0 C-N-CA 122.779 2.32 . . . . 0.0 112.339 -179.312 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' TRP . . . . . 0.404 ' O ' ' C ' ' A' ' 45' ' ' PHE . 0.0 OUTLIER -82.5 12.48 4.51 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.024 -179.569 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.454 ' CE1' ' OE1' ' A' ' 47' ' ' GLN . 21.3 t80 39.85 54.59 5.99 Favored Pre-proline 0 C--N 1.331 -0.206 0 CA-C-O 120.864 0.364 . . . . 0.0 110.227 179.882 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.438 ' CD ' ' N ' ' A' ' 45' ' ' PHE . 19.1 Cg_endo -58.88 -2.62 1.18 Allowed 'Trans proline' 0 C--N 1.308 -1.598 0 C-N-CA 122.898 2.399 . . . . 0.0 112.256 -179.522 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.454 ' OE1' ' CE1' ' A' ' 45' ' ' PHE . 88.2 mt-30 -60.73 -52.62 64.33 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.238 179.933 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 76.9 tt0 -89.09 -21.92 23.15 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-O 121.053 0.454 . . . . 0.0 110.397 179.104 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 78.89 63.24 2.11 Favored Glycine 0 CA--C 1.523 0.554 0 N-CA-C 110.534 -1.026 . . . . 0.0 110.534 -179.486 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' THR . . . . . 0.427 ' OG1' ' NE2' ' A' ' 98' ' ' GLN . 11.2 t -137.19 160.8 37.96 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.836 0.351 . . . . 0.0 110.748 -179.411 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.3 mt -83.53 133.53 28.95 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.425 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.521 179.603 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -116.95 120.83 39.64 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.373 -0.83 . . . . 0.0 110.345 179.298 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 20.3 mm -91.43 -48.13 13.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.922 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -63.17 -44.98 93.91 Favored 'General case' 0 C--O 1.238 0.46 0 CA-C-O 121.255 0.55 . . . . 0.0 110.66 -179.399 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 85.0 mtt85 -64.14 -34.36 77.89 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.115 -0.493 . . . . 0.0 109.903 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 29.4 t-105 -59.39 -39.13 82.38 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-O 121.125 0.488 . . . . 0.0 110.4 -179.466 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 83.7 mtp180 -64.12 -39.08 93.26 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.347 179.949 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' ARG . . . . . 0.442 ' O ' ' OD2' ' A' ' 61' ' ' ASP . 83.9 mtt85 -60.88 -52.06 66.64 Favored 'General case' 0 C--N 1.331 -0.228 0 C-N-CA 120.715 -0.394 . . . . 0.0 111.209 -179.972 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 5.9 p -69.01 -31.05 48.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.13 179.179 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -67.71 -44.58 80.61 Favored Glycine 0 CA--C 1.526 0.74 0 N-CA-C 111.344 -0.703 . . . . 0.0 111.344 -179.819 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' ASP . . . . . 0.442 ' OD2' ' O ' ' A' ' 58' ' ' ARG . 0.5 OUTLIER -65.87 -38.01 87.66 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.779 0.323 . . . . 0.0 110.609 -179.42 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 76.1 m -64.98 -49.57 69.78 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.04 0.448 . . . . 0.0 110.678 -179.45 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' PHE . . . . . 0.458 ' CD2' ' CE2' ' A' ' 37' ' ' PHE . 12.0 m-85 -67.29 -28.94 68.43 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.282 179.626 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 56.9 tt0 -61.48 -45.42 94.32 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 120.658 -0.417 . . . . 0.0 110.967 -179.872 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 24.4 t0 -62.97 -51.83 65.37 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.005 0.431 . . . . 0.0 110.595 179.699 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 54.1 m-85 -62.34 -32.81 73.64 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.037 -0.528 . . . . 0.0 110.234 179.819 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' TYR . . . . . 0.416 ' OH ' ' CD ' ' A' ' 76' ' ' PRO . 58.2 t80 -61.83 -40.2 94.46 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.312 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 88.6 m-20 -63.96 -39.92 95.23 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.343 -179.626 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 61.4 p -49.3 -34.3 15.17 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.693 -179.31 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 69.1 m-85 -65.58 -47.0 77.25 Favored 'General case' 0 C--N 1.322 -0.609 0 C-N-CA 120.075 -0.65 . . . . 0.0 111.134 -179.906 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' GLY . . . . . 0.497 ' H ' ' HD3' ' A' ' 72' ' ' PRO . . . 110.91 71.48 0.64 Allowed Glycine 0 N--CA 1.472 1.036 0 N-CA-C 110.853 -0.899 . . . . 0.0 110.853 -179.545 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 72' ' ' PRO . . . . . 0.497 ' HD3' ' H ' ' A' ' 71' ' ' GLY . 24.5 Cg_exo -62.78 142.06 87.46 Favored 'Trans proline' 0 C--N 1.305 -1.74 0 C-N-CA 123.241 2.628 . . . . 0.0 111.891 -179.861 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 97.6 mt-10 -83.2 -46.29 12.88 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-O 121.047 0.451 . . . . 0.0 110.206 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.548 ' HD3' ' H ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -137.14 3.87 2.66 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.573 -0.739 . . . . 0.0 111.861 -179.72 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 54.1 t 57.1 100.11 0.04 OUTLIER Pre-proline 0 C--N 1.325 -0.486 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.485 -178.248 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' PRO . . . . . 0.416 ' CD ' ' OH ' ' A' ' 67' ' ' TYR . 48.6 Cg_exo -53.38 126.8 22.84 Favored 'Trans proline' 0 N--CA 1.494 1.556 0 C-N-CA 122.032 1.821 . . . . 0.0 112.176 -179.647 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.477 ' O ' ' N ' ' A' ' 79' ' ' ALA . 45.3 t -84.01 -20.81 8.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.875 179.497 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 71.5 p -40.75 -24.99 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.464 -179.262 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' ALA . . . . . 0.477 ' N ' ' O ' ' A' ' 77' ' ' VAL . . . -65.5 -41.83 92.79 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.144 0.497 . . . . 0.0 110.868 179.597 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 80' ' ' PHE . . . . . 0.454 ' N ' ' O ' ' A' ' 77' ' ' VAL . 2.4 m-85 -62.77 -39.37 93.96 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.644 179.853 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 73.4 p -54.17 -42.39 69.58 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.355 -179.725 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 9.5 m-85 -61.05 -54.24 47.22 Favored 'General case' 0 CA--C 1.52 -0.208 0 C-N-CA 120.847 -0.341 . . . . 0.0 110.659 179.832 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 83' ' ' TRP . . . . . . . . . . . . . 37.7 t90 -56.78 -36.7 70.15 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.543 179.724 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 92.6 m-20 -62.86 -48.54 78.56 Favored 'General case' 0 C--O 1.235 0.327 0 C-N-CA 120.775 -0.37 . . . . 0.0 111.155 -179.409 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 33.1 tp -70.41 -51.53 28.86 Favored 'General case' 0 N--CA 1.447 -0.62 0 C-N-CA 120.532 -0.467 . . . . 0.0 110.376 179.676 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -58.22 -27.35 32.1 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 C-N-CA 120.511 -0.475 . . . . 0.0 110.513 -179.766 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 64.5 tttt -65.11 -48.9 72.0 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.666 -178.898 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.2 pp20? -80.48 -21.33 42.11 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.739 -179.876 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.537 ' O ' HD13 ' A' ' 89' ' ' LEU . 0.2 OUTLIER -62.11 -43.09 99.59 Favored 'General case' 0 N--CA 1.447 -0.625 0 C-N-CA 120.046 -0.662 . . . . 0.0 110.113 -178.68 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 2.2 mt -63.33 -43.12 98.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 C-N-CA 119.949 -0.7 . . . . 0.0 110.052 -179.618 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 -55.57 -17.1 4.81 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.764 -178.478 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 75.3 tttt -61.52 134.28 56.68 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.315 179.635 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -62.37 -41.22 98.46 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.683 -179.806 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 94' ' ' GLU . . . . . 0.448 ' O ' ' C ' ' A' ' 95' ' ' VAL . 81.0 mm-40 -74.85 -2.22 25.78 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.971 -179.603 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.448 ' C ' ' O ' ' A' ' 94' ' ' GLU . 1.9 m 30.55 -106.71 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.29 0 O-C-N 123.831 0.707 . . . . 0.0 110.442 179.939 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 96' ' ' ASN . . . . . 0.439 ' O ' ' N ' ' A' ' 98' ' ' GLN . 0.5 OUTLIER -152.63 164.43 20.33 Favored Pre-proline 0 C--N 1.322 -0.596 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.658 179.047 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -46.07 -13.28 0.09 OUTLIER 'Trans proline' 0 N--CA 1.494 1.52 0 C-N-CA 122.797 2.332 . . . . 0.0 112.464 179.079 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 98' ' ' GLN . . . . . 0.439 ' N ' ' O ' ' A' ' 96' ' ' ASN . 3.5 pt20 . . . . . 0 C--N 1.323 -0.571 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.856 179.951 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 19.4 m . . . . . 0 C--O 1.23 0.079 0 CA-C-O 120.489 0.185 . . . . 0.0 110.691 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 93.8 mt-10 -125.18 163.28 22.8 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.485 -179.709 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 108' ' ' GLU . . . . . 0.536 ' OE1' ' N ' ' A' ' 108' ' ' GLU . 54.5 mp0 -90.41 120.19 31.32 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.061 -0.518 . . . . 0.0 109.937 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 42.4 pt -43.1 -19.15 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.491 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.514 ' N ' ' O ' ' A' ' 108' ' ' GLU . 35.1 mt -63.61 -42.04 98.25 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.429 -179.821 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 66.4 tttm -67.57 -38.34 83.92 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.449 179.895 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 51.2 m -59.47 -47.29 86.05 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.79 -179.211 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 90.1 m-20 -65.82 -42.51 90.54 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.633 179.823 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 114' ' ' SER . . . . . 0.701 ' OG ' HG23 ' A' ' 116' ' ' THR . 23.1 t -158.23 139.12 13.04 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.526 179.78 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 75.2 mt-30 -89.44 20.72 3.72 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.805 179.824 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 116' ' ' THR . . . . . 0.701 HG23 ' OG ' ' A' ' 114' ' ' SER . 41.3 p -63.37 -32.51 73.96 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.44 179.873 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 65.6 t0 . . . . . 0 C--N 1.328 -0.363 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.677 179.832 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.71 0 N-CA-C 110.887 -0.885 . . . . 0.0 110.887 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 99.2 mm-40 -61.81 -39.79 92.99 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.825 0.345 . . . . 0.0 110.573 179.803 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -55.52 -22.4 21.15 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.517 179.765 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 51.2 tp -42.31 -34.14 0.74 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.564 -179.999 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 56.2 m -54.21 -37.48 64.6 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.568 179.362 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 97.8 mm-40 -62.49 -37.3 85.48 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.588 179.741 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 59.1 t-80 -56.03 -43.93 78.28 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.585 179.689 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 81.9 tt0 -59.85 -53.16 61.18 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.563 179.114 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.479 ' O ' ' N ' ' A' ' 14' ' ' GLN . 86.8 mtt180 -60.61 -31.65 70.82 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.597 179.085 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.501 ' O ' ' HB2' ' A' ' 15' ' ' LEU . 51.1 t80 -60.66 -36.47 78.77 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.563 -179.601 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 3.0 t -63.24 -48.66 86.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.604 -179.198 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -83.49 -41.97 17.41 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.629 -179.571 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' GLN . . . . . 0.479 ' N ' ' O ' ' A' ' 10' ' ' ARG . 67.6 tp60 -61.39 -52.87 62.83 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.602 -179.119 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.708 HD13 ' O ' ' A' ' 15' ' ' LEU . 0.3 OUTLIER -61.25 -47.43 86.08 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.575 -179.976 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.478 ' HB3' HG11 ' A' ' 26' ' ' VAL . 87.0 mttt -56.29 -35.28 67.32 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.59 179.487 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 80.0 mt-30 -72.94 -36.08 67.13 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.622 178.636 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.416 ' O ' HG23 ' A' ' 21' ' ' THR . . . -57.22 -32.59 66.68 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.58 179.512 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.1 mt -85.59 -33.34 21.71 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.576 177.997 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -46.97 -42.37 17.79 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.529 -179.541 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' THR . . . . . 0.512 ' C ' ' H ' ' A' ' 23' ' ' GLY . 0.2 OUTLIER -71.43 -25.75 62.45 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.581 -179.578 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 82.6 mmt-85 -72.88 19.52 0.09 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.562 179.674 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' GLY . . . . . 0.512 ' H ' ' C ' ' A' ' 21' ' ' THR . . . 86.31 18.26 59.3 Favored Glycine 0 CA--C 1.524 0.627 0 N-CA-C 110.934 -0.866 . . . . 0.0 110.934 -179.604 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.634 HG12 ' N ' ' A' ' 25' ' ' LYS . 22.8 t -105.39 168.85 2.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 120.787 0.327 . . . . 0.0 110.622 -179.927 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.634 ' N ' HG12 ' A' ' 24' ' ' VAL . 63.1 mttp -131.01 136.43 48.5 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.524 179.305 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.478 HG11 ' HB3' ' A' ' 16' ' ' LYS . 4.8 m -134.37 108.3 10.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.545 -179.459 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.477 ' O ' ' N ' ' A' ' 30' ' ' ASP . 13.0 ttmt -107.4 158.78 16.9 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.541 178.867 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.422 ' H ' ' HG2' ' A' ' 27' ' ' LYS . 97.9 m-85 -39.01 -34.22 0.15 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.534 179.39 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -60.19 -25.48 65.61 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.575 -179.706 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.487 ' O ' ' CB ' ' A' ' 34' ' ' PHE . 1.0 OUTLIER -60.06 -46.3 90.01 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.614 -179.028 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.566 ' H ' HD12 ' A' ' 31' ' ' LEU . 5.8 mp -63.68 -42.68 97.99 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.493 -179.959 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 36.8 mt -58.49 -46.11 87.34 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.588 -178.465 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.461 ' NZ ' ' CZ ' ' A' ' 37' ' ' PHE . 65.3 tttm -87.53 -49.22 7.33 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.52 -177.038 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 34' ' ' PHE . . . . . 0.487 ' CB ' ' O ' ' A' ' 30' ' ' ASP . 43.0 t80 -60.9 -50.25 74.16 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.53 -178.182 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.521 ' CB ' ' O ' ' A' ' 31' ' ' LEU . 7.1 t80 -61.84 -46.09 90.98 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.614 -178.938 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 86.1 m-20 -65.39 -35.2 80.23 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.574 -179.248 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.544 ' CE2' ' CD2' ' A' ' 63' ' ' PHE . 1.9 m-85 -60.89 -46.74 89.44 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.569 -179.191 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.622 ' O ' ' N ' ' A' ' 42' ' ' CYS . 25.8 m -76.52 -37.46 30.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.532 -178.825 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -62.56 -29.67 70.75 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.584 -179.633 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 81.3 m-20 -59.14 -44.84 92.09 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.557 -178.588 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.524 ' C ' ' SG ' ' A' ' 42' ' ' CYS . 41.6 p -115.06 -3.25 12.63 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.58 -178.849 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 42' ' ' CYS . . . . . 0.622 ' N ' ' O ' ' A' ' 38' ' ' VAL . 1.8 p 36.19 60.48 3.15 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.572 -179.608 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 43' ' ' PRO . . . . . 0.402 ' HD3' ' N ' ' A' ' 42' ' ' CYS . 57.1 Cg_endo -77.7 -40.22 0.43 Allowed 'Trans proline' 0 C--N 1.305 -1.717 0 C-N-CA 122.796 2.331 . . . . 0.0 112.115 -179.334 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 44' ' ' TRP . . . . . 0.801 ' HE1' ' H ' ' A' ' 52' ' ' ASP . 0.0 OUTLIER -73.43 3.44 6.02 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.552 -179.633 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.558 ' O ' ' N ' ' A' ' 47' ' ' GLN . 64.0 m-85 54.91 50.49 6.34 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.577 -179.527 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.528 ' CD ' ' N ' ' A' ' 45' ' ' PHE . 52.9 Cg_exo -40.1 -16.77 0.04 OUTLIER 'Trans proline' 0 C--N 1.305 -1.747 0 C-N-CA 122.835 2.357 . . . . 0.0 112.165 179.116 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.558 ' N ' ' O ' ' A' ' 45' ' ' PHE . 71.9 tp60 -63.84 -48.5 76.52 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.542 -179.532 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 51.6 tp10 -89.41 -45.22 9.62 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.636 179.867 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' GLY . . . . . 0.486 ' O ' ' NE2' ' A' ' 98' ' ' GLN . . . 96.61 68.45 0.98 Allowed Glycine 0 CA--C 1.524 0.616 0 N-CA-C 110.956 -0.857 . . . . 0.0 110.956 -179.306 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 7.0 t -130.03 170.2 14.3 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.842 0.353 . . . . 0.0 110.556 -179.333 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.3 mt -103.75 132.14 50.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.665 178.814 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' ASP . . . . . 0.801 ' H ' ' HE1' ' A' ' 44' ' ' TRP . 96.3 m-20 -118.51 121.42 40.23 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.549 179.04 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 22.0 mm -91.51 -53.86 8.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.584 -179.167 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 88.9 tttt -64.17 -48.27 76.61 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.564 -179.78 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 22.9 ttm-85 -61.53 -40.67 95.49 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.627 -179.611 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' TRP . . . . . 0.598 ' CE3' ' CH2' ' A' ' 44' ' ' TRP . 36.0 t-105 -51.74 -37.28 50.47 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.577 179.706 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -66.61 -38.92 87.97 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.596 -179.959 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 94.2 mtt-85 -61.53 -52.5 64.21 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.586 -179.857 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.443 HG13 ' N ' ' A' ' 60' ' ' GLY . 2.8 p -63.34 -43.62 98.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.628 179.879 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 60' ' ' GLY . . . . . 0.443 ' N ' HG13 ' A' ' 59' ' ' VAL . . . -64.53 -33.46 87.29 Favored Glycine 0 CA--C 1.525 0.697 0 N-CA-C 110.938 -0.865 . . . . 0.0 110.938 -179.709 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 10.9 m-20 -66.1 -37.01 84.7 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.788 0.327 . . . . 0.0 110.615 -179.701 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 84.0 m -63.45 -53.67 48.48 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.572 -179.82 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' PHE . . . . . 0.544 ' CD2' ' CE2' ' A' ' 37' ' ' PHE . 56.2 m-85 -67.66 -30.37 69.9 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.572 -179.608 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 60.0 tt0 -60.72 -42.26 96.92 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.579 179.382 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 29.5 t0 -63.18 -53.8 47.53 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.525 179.581 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' TYR . . . . . 0.457 ' O ' ' OG1' ' A' ' 69' ' ' THR . 60.6 m-85 -63.17 -35.55 80.68 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.518 179.615 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 62.5 t80 -57.9 -38.36 75.7 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.61 179.788 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 98.8 m-20 -66.66 -38.82 87.63 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.553 -179.896 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.457 ' OG1' ' O ' ' A' ' 66' ' ' TYR . 58.1 p -61.38 -29.74 70.1 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.618 -179.337 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -65.81 -40.94 92.33 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.572 -179.718 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' GLY . . . . . 0.506 ' H ' ' HD3' ' A' ' 72' ' ' PRO . . . 104.38 71.75 0.85 Allowed Glycine 0 CA--C 1.525 0.705 0 N-CA-C 110.937 -0.865 . . . . 0.0 110.937 179.665 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 72' ' ' PRO . . . . . 0.506 ' HD3' ' H ' ' A' ' 71' ' ' GLY . 19.3 Cg_exo -65.37 144.49 80.34 Favored 'Trans proline' 0 C--N 1.305 -1.721 0 C-N-CA 122.788 2.325 . . . . 0.0 112.173 179.326 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -76.29 -50.32 14.66 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.572 -179.806 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.519 ' HD3' ' H ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -138.88 6.08 2.4 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.56 -179.495 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 52.0 t 56.06 94.32 0.05 OUTLIER Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.612 -179.775 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -52.38 124.22 14.53 Favored 'Trans proline' 0 C--N 1.304 -1.767 0 C-N-CA 122.796 2.331 . . . . 0.0 112.143 -179.755 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.412 ' O ' ' N ' ' A' ' 80' ' ' PHE . 41.7 t -84.18 -15.43 11.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.565 -179.467 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 69.0 p -42.17 -27.18 0.12 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.546 179.927 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.87 -41.67 98.14 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.596 179.613 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 80' ' ' PHE . . . . . 0.412 ' N ' ' O ' ' A' ' 77' ' ' VAL . 2.3 m-85 -66.4 -33.28 75.35 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.547 -179.984 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 41.8 t -60.56 -42.52 96.78 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.568 179.802 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 7.6 m-85 -59.92 -52.23 66.3 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.553 179.445 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 83' ' ' TRP . . . . . 0.4 ' O ' ' CB ' ' A' ' 87' ' ' LYS . 41.1 t90 -59.03 -36.49 75.08 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.612 179.855 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 78.2 m-20 -62.02 -46.99 86.74 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.576 -179.559 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.402 ' O ' ' HG3' ' A' ' 88' ' ' GLU . 30.9 tp -70.64 -56.96 5.27 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.609 179.506 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -54.93 -24.97 15.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.563 179.547 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.4 ' CB ' ' O ' ' A' ' 83' ' ' TRP . 55.0 tttt -68.89 -47.6 65.46 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.581 -179.825 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 88' ' ' GLU . . . . . 0.463 ' OE1' ' O ' ' A' ' 88' ' ' GLU . 1.3 pp20? -82.71 -18.71 39.88 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.569 -179.802 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.601 ' O ' HD13 ' A' ' 89' ' ' LEU . 0.2 OUTLIER -61.99 -46.15 90.51 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.526 179.504 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 2.7 mt -62.73 -40.68 89.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.606 179.561 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 51.3 t0 -50.72 -42.56 57.41 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.59 -179.943 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 97.2 mttt -68.03 143.63 55.46 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.604 179.888 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -75.5 9.02 2.4 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.622 -179.818 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 40.4 tp10 -59.34 -33.72 71.48 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.499 179.859 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.413 ' H ' HG22 ' A' ' 95' ' ' VAL . 8.3 m -67.18 133.26 31.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.501 179.826 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 96' ' ' ASN . . . . . 0.541 ' O ' ' N ' ' A' ' 98' ' ' GLN . 1.1 m-20 -85.54 162.82 46.84 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.588 -179.624 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_exo -42.64 -13.45 0.04 OUTLIER 'Trans proline' 0 C--N 1.305 -1.763 0 C-N-CA 122.896 2.397 . . . . 0.0 112.101 179.271 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 98' ' ' GLN . . . . . 0.541 ' N ' ' O ' ' A' ' 96' ' ' ASN . 5.0 pt20 . . . . . 0 C--N 1.33 -0.263 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.573 -179.81 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 82.0 p . . . . . 0 C--O 1.232 0.156 0 CA-C-O 120.783 0.325 . . . . 0.0 110.619 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 92.2 mt-10 54.26 -164.18 0.11 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.508 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 108' ' ' GLU . . . . . 0.577 ' C ' ' H ' ' A' ' 110' ' ' LEU . 72.7 mm-40 -90.04 125.85 35.55 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.589 179.22 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 44.0 pt -58.86 2.26 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.577 -179.976 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.577 ' H ' ' C ' ' A' ' 108' ' ' GLU . 91.6 mt -95.18 -5.65 43.47 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.628 179.871 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 86.5 tttt -121.48 127.13 50.74 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.594 179.948 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 112' ' ' SER . . . . . 0.436 ' OG ' ' N ' ' A' ' 113' ' ' ASN . 95.4 p -148.52 -113.02 0.07 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.563 -179.962 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 113' ' ' ASN . . . . . 0.436 ' N ' ' OG ' ' A' ' 112' ' ' SER . 77.4 m-20 -62.17 -34.79 77.09 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.618 179.617 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 62.4 p -153.07 160.2 42.92 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.53 179.735 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 86.4 mt-30 -90.15 129.65 36.4 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.581 179.993 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 116' ' ' THR . . . . . 0.406 ' OG1' ' N ' ' A' ' 117' ' ' ASP . 67.5 p -108.68 -74.46 0.66 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.602 179.874 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 117' ' ' ASP . . . . . 0.406 ' N ' ' OG1' ' A' ' 116' ' ' THR . 92.5 m-20 . . . . . 0 C--N 1.329 -0.317 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.616 179.827 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.717 0 N-CA-C 110.95 -0.86 . . . . 0.0 110.95 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 99.4 mm-40 -62.61 -36.9 84.23 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.955 0.407 . . . . 0.0 110.369 -179.987 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 93.7 mt-10 -51.21 -21.75 2.24 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.483 179.846 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 41.5 tp -42.98 -34.86 1.06 Allowed 'General case' 0 C--O 1.236 0.348 0 CA-C-O 120.998 0.427 . . . . 0.0 110.429 -179.625 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' SER . . . . . 0.589 ' CB ' HH12 ' A' ' 10' ' ' ARG . 50.2 m -54.15 -35.18 61.96 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 120.493 -0.483 . . . . 0.0 109.958 179.789 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 71.3 tp60 -64.71 -33.24 75.5 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.96 -0.563 . . . . 0.0 110.44 179.504 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 86.3 t60 -59.16 -45.11 91.84 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-O 120.95 0.405 . . . . 0.0 110.069 -179.947 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -60.51 -43.38 97.13 Favored 'General case' 0 C--O 1.241 0.649 0 CA-C-N 116.034 -0.53 . . . . 0.0 109.874 179.478 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.589 HH12 ' CB ' ' A' ' 6' ' ' SER . 80.2 mtt85 -66.22 -37.31 85.24 Favored 'General case' 0 C--O 1.21 -0.974 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 179.61 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -53.28 -38.76 63.38 Favored 'General case' 0 C--N 1.319 -0.753 0 C-N-CA 120.445 -0.502 . . . . 0.0 110.172 -179.967 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 2.3 t -65.67 -52.93 44.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 C-N-CA 119.932 -0.707 . . . . 0.0 111.497 -179.868 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 77.0 tt0 -80.49 -48.64 12.5 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 120.403 -0.519 . . . . 0.0 112.004 -178.73 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' GLN . . . . . 0.501 ' N ' ' O ' ' A' ' 10' ' ' ARG . 60.9 tp60 -53.64 -53.0 58.12 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.909 -178.848 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.582 HD13 ' O ' ' A' ' 15' ' ' LEU . 0.4 OUTLIER -63.26 -49.29 74.7 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.35 -0.54 . . . . 0.0 110.121 -179.589 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 62.8 mttm -53.25 -33.81 54.55 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 120.499 -0.48 . . . . 0.0 110.268 179.319 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 89.3 mm-40 -75.42 -35.66 60.94 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.566 179.183 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -57.06 -34.44 68.25 Favored 'General case' 0 C--O 1.223 -0.296 0 CA-C-N 116.044 -0.526 . . . . 0.0 109.956 -179.931 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.9 mt -85.42 -33.48 21.93 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.096 0.474 . . . . 0.0 110.564 179.243 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -47.46 -43.28 24.05 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.541 -179.129 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' THR . . . . . 0.493 ' C ' ' H ' ' A' ' 23' ' ' GLY . 0.1 OUTLIER -72.02 -24.07 61.5 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.555 -179.908 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 71.8 mmt-85 -74.69 24.08 0.09 Allowed 'General case' 0 C--O 1.233 0.187 0 CA-C-O 120.945 0.402 . . . . 0.0 110.435 179.906 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' GLY . . . . . 0.493 ' H ' ' C ' ' A' ' 21' ' ' THR . . . 82.49 17.96 67.43 Favored Glycine 0 CA--C 1.526 0.724 0 N-CA-C 110.89 -0.884 . . . . 0.0 110.89 179.876 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.593 HG12 ' N ' ' A' ' 25' ' ' LYS . 21.9 t -105.42 167.12 3.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 N-CA-C 110.294 -0.261 . . . . 0.0 110.294 -179.901 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.593 ' N ' HG12 ' A' ' 24' ' ' VAL . 69.9 mmtt -129.43 132.26 46.94 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.26 179.518 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.688 HG23 ' O ' ' A' ' 26' ' ' VAL . 30.8 m -127.83 105.22 13.26 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.252 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.239 -179.956 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.423 ' N ' ' OD1' ' A' ' 30' ' ' ASP . 8.3 pttm -104.89 163.39 12.56 Favored 'General case' 0 C--O 1.218 -0.579 0 N-CA-C 109.806 -0.442 . . . . 0.0 109.806 179.812 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 84.2 m-85 -42.86 -34.89 1.03 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.961 0.41 . . . . 0.0 110.782 179.981 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -56.85 -23.27 42.91 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.819 179.839 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.423 ' OD1' ' N ' ' A' ' 27' ' ' LYS . 1.1 m-20 -61.91 -46.97 87.04 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.613 -179.159 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.5 ' O ' ' CB ' ' A' ' 35' ' ' PHE . 5.8 mp -67.24 -41.56 85.42 Favored 'General case' 0 C--O 1.215 -0.73 0 CA-C-O 120.943 0.401 . . . . 0.0 110.393 179.738 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 42.3 mt -57.27 -45.86 83.64 Favored 'General case' 0 C--N 1.314 -0.973 0 C-N-CA 119.419 -0.913 . . . . 0.0 111.03 -178.359 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -84.32 -50.17 8.07 Favored 'General case' 0 C--N 1.32 -0.696 0 C-N-CA 120.472 -0.491 . . . . 0.0 111.909 -179.089 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' PHE . . . . . 0.858 ' O ' HG22 ' A' ' 38' ' ' VAL . 42.0 t80 -62.47 -49.56 74.92 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.461 -178.531 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.5 ' CB ' ' O ' ' A' ' 31' ' ' LEU . 22.4 t80 -61.22 -44.56 97.08 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.103 -179.567 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -69.37 -40.56 77.39 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 120.275 -0.57 . . . . 0.0 111.663 179.975 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.573 ' CE2' ' CE1' ' A' ' 63' ' ' PHE . 3.0 m-85 -62.08 -48.66 79.22 Favored 'General case' 0 CA--C 1.518 -0.278 0 CA-C-O 120.858 0.361 . . . . 0.0 111.887 -178.281 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.858 HG22 ' O ' ' A' ' 34' ' ' PHE . 17.1 m -70.03 -41.62 79.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.467 -179.745 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -63.04 -31.7 72.89 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.506 -0.316 . . . . 0.0 110.95 -179.732 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 98.8 m-20 -56.66 -49.71 74.24 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 120.906 -0.317 . . . . 0.0 111.113 -179.169 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.46 ' O ' ' SG ' ' A' ' 42' ' ' CYS . 15.4 p -106.64 -7.61 17.29 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.545 -0.298 . . . . 0.0 110.954 -179.741 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 42' ' ' CYS . . . . . 0.554 ' N ' ' O ' ' A' ' 38' ' ' VAL . 28.6 p 38.04 57.52 4.8 Favored Pre-proline 0 N--CA 1.463 0.186 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.303 -179.234 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -75.95 -31.42 5.06 Favored 'Trans proline' 0 C--N 1.314 -1.257 0 C-N-CA 122.551 2.167 . . . . 0.0 112.582 -179.4 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' TRP . . . . . 0.631 ' CH2' ' CE3' ' A' ' 56' ' ' TRP . 0.0 OUTLIER -77.76 13.75 1.25 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.89 -179.646 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.532 ' CD2' ' OD2' ' A' ' 52' ' ' ASP . 6.1 m-85 39.56 53.58 5.06 Favored Pre-proline 0 C--O 1.232 0.142 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.076 -179.874 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.444 ' CD ' ' N ' ' A' ' 45' ' ' PHE . 11.1 Cg_endo -53.38 -5.7 0.28 Allowed 'Trans proline' 0 C--N 1.31 -1.488 0 C-N-CA 122.714 2.276 . . . . 0.0 112.004 -179.688 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.462 ' H ' ' C ' ' A' ' 45' ' ' PHE . 64.1 tp60 -64.17 -48.79 74.6 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.333 -179.448 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -89.42 -30.24 18.47 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-O 120.908 0.385 . . . . 0.0 110.531 179.155 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 87.65 75.19 1.28 Allowed Glycine 0 CA--C 1.523 0.573 0 N-CA-C 110.844 -0.902 . . . . 0.0 110.844 -179.445 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 13.6 t -144.11 165.22 28.43 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.623 0.249 . . . . 0.0 110.653 -179.792 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.1 mt -98.96 133.85 40.05 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.265 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 179.283 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' ASP . . . . . 0.611 ' H ' ' HE1' ' A' ' 44' ' ' TRP . 73.7 m-20 -117.91 121.17 40.0 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.276 179.083 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 18.5 mm -87.32 -46.49 16.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.825 179.998 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -66.22 -45.84 79.29 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-O 121.108 0.48 . . . . 0.0 111.283 -179.775 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 77.3 mmt-85 -63.72 -33.97 76.84 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.908 -0.587 . . . . 0.0 109.909 -179.507 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' TRP . . . . . 0.631 ' CE3' ' CH2' ' A' ' 44' ' ' TRP . 50.3 t-105 -59.29 -36.79 76.21 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-O 121.3 0.572 . . . . 0.0 110.049 179.994 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 44.0 ttm180 -65.21 -41.33 94.58 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.308 179.55 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 95.2 mtt-85 -61.75 -53.07 61.01 Favored 'General case' 0 N--CA 1.466 0.334 0 C-N-CA 120.793 -0.363 . . . . 0.0 111.562 -179.491 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.499 HG13 ' N ' ' A' ' 60' ' ' GLY . 4.8 p -63.16 -45.93 97.26 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.391 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.198 179.632 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 60' ' ' GLY . . . . . 0.499 ' N ' HG13 ' A' ' 59' ' ' VAL . . . -63.04 -36.72 93.85 Favored Glycine 0 CA--C 1.524 0.615 0 N-CA-C 111.05 -0.82 . . . . 0.0 111.05 179.903 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 53.9 m-20 -65.24 -35.74 82.0 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.652 0.263 . . . . 0.0 110.692 -179.479 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 80.9 m -64.29 -55.33 22.09 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.821 0.344 . . . . 0.0 110.718 -179.93 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' PHE . . . . . 0.573 ' CE1' ' CE2' ' A' ' 37' ' ' PHE . 59.4 m-85 -64.47 -33.99 77.17 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.427 179.47 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 57.9 tt0 -60.0 -42.89 95.26 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 120.891 -0.324 . . . . 0.0 110.614 -179.88 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 20.8 t0 -61.1 -51.71 68.0 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.825 179.834 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 41.3 m-85 -65.97 -35.03 79.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.739 179.735 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 56.9 t80 -59.57 -44.41 93.31 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.291 -179.424 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 39.6 t30 -64.37 -40.33 95.62 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.579 179.941 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 41.0 p -66.1 -22.5 66.4 Favored 'General case' 0 CA--C 1.516 -0.332 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.342 179.933 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -70.04 -46.85 64.14 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 120.009 -0.676 . . . . 0.0 110.995 179.911 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 71' ' ' GLY . . . . . 0.509 ' H ' ' HD3' ' A' ' 72' ' ' PRO . . . 113.29 70.73 0.55 Allowed Glycine 0 CA--C 1.532 1.101 0 N-CA-C 110.698 -0.961 . . . . 0.0 110.698 -179.494 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 72' ' ' PRO . . . . . 0.509 ' HD3' ' H ' ' A' ' 71' ' ' GLY . 23.6 Cg_exo -63.93 147.34 92.01 Favored 'Trans proline' 0 N--CA 1.499 1.822 0 C-N-CA 123.029 2.486 . . . . 0.0 112.068 179.979 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -80.8 -49.52 11.0 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-O 120.953 0.406 . . . . 0.0 110.338 179.63 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.492 ' HD3' ' H ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -137.46 2.62 2.49 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.654 -179.481 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 68.8 t 57.7 93.5 0.05 OUTLIER Pre-proline 0 C--N 1.325 -0.48 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.211 -178.805 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -53.58 126.66 22.5 Favored 'Trans proline' 0 N--CA 1.495 1.59 0 C-N-CA 121.805 1.67 . . . . 0.0 111.786 -179.583 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.466 ' O ' ' N ' ' A' ' 80' ' ' PHE . 40.8 t -83.25 -20.53 9.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.679 179.822 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 63.6 p -41.55 -26.34 0.07 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.265 -179.27 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 79' ' ' ALA . . . . . 0.433 ' N ' ' O ' ' A' ' 77' ' ' VAL . . . -64.02 -42.69 97.04 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.546 179.654 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 80' ' ' PHE . . . . . 0.466 ' N ' ' O ' ' A' ' 77' ' ' VAL . 10.8 m-85 -64.5 -35.45 80.98 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.143 179.694 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 37.3 m -59.89 -42.09 93.01 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.353 179.814 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 4.1 m-85 -60.17 -51.36 69.91 Favored 'General case' 0 C--N 1.331 -0.215 0 C-N-CA 120.88 -0.328 . . . . 0.0 110.609 -179.951 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 83' ' ' TRP . . . . . . . . . . . . . 47.2 t90 -59.23 -39.01 81.39 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.645 179.66 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 12.4 m120 -61.86 -44.14 97.43 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.562 -179.651 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 25.0 tp -72.14 -59.32 2.8 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 120.358 -0.537 . . . . 0.0 110.135 179.359 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -50.74 -28.79 6.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-O 120.895 0.379 . . . . 0.0 110.395 179.709 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 66.0 tttt -65.26 -50.99 63.67 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.9 -179.293 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.1 pp20? -79.96 -20.1 46.35 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.801 -179.683 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.528 ' O ' HD13 ' A' ' 89' ' ' LEU . 0.2 OUTLIER -61.85 -46.24 90.31 Favored 'General case' 0 N--CA 1.443 -0.815 0 C-N-CA 120.158 -0.617 . . . . 0.0 110.486 -178.771 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 3.2 mt -63.67 -44.21 98.37 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 C-N-CA 119.891 -0.723 . . . . 0.0 109.937 -179.605 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 -64.88 -12.29 47.2 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.785 -178.988 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 68.1 tttt -74.04 139.83 44.98 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.377 179.736 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -74.86 -10.22 59.29 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.84 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 80.3 mm-40 -86.47 52.31 2.46 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.562 179.857 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 27.1 m -115.89 131.71 67.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.485 179.915 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 96' ' ' ASN . . . . . 0.445 ' OD1' ' N ' ' A' ' 96' ' ' ASN . 0.0 OUTLIER -58.76 161.88 7.73 Favored Pre-proline 0 C--N 1.324 -0.528 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.474 179.777 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -58.98 -13.22 17.86 Favored 'Trans proline' 0 N--CA 1.495 1.597 0 C-N-CA 122.821 2.347 . . . . 0.0 112.153 179.682 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 98' ' ' GLN . . . . . 0.43 ' OE1' ' OD1' ' A' ' 96' ' ' ASN . 0.9 OUTLIER . . . . . 0 C--N 1.321 -0.659 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.557 179.818 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 28.3 m . . . . . 0 N--CA 1.46 0.045 0 CA-C-O 120.695 0.284 . . . . 0.0 110.704 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -130.31 179.51 5.87 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.57 -179.97 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 108' ' ' GLU . . . . . 0.496 ' C ' ' N ' ' A' ' 110' ' ' LEU . 98.7 mt-10 -108.64 122.82 47.9 Favored 'General case' 0 CA--C 1.513 -0.445 0 CA-C-N 115.943 -0.571 . . . . 0.0 109.895 179.132 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 38.3 pt -49.45 -11.63 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.036 179.779 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.496 ' N ' ' C ' ' A' ' 108' ' ' GLU . 36.3 mt -68.16 -40.88 82.25 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.725 179.779 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -68.47 -39.98 81.16 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.357 -179.921 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 16.2 t -62.52 -44.42 96.4 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.856 -179.549 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 69.8 m-20 -63.03 -40.82 98.86 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.539 -179.941 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 35.6 p -158.04 160.92 37.93 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.593 179.872 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 14.8 pt20 -100.88 7.66 43.54 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.377 179.89 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 11.4 m -60.75 -44.63 96.46 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.395 -179.676 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 59.7 t0 . . . . . 0 C--N 1.328 -0.328 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.842 -179.962 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.646 0 N-CA-C 110.987 -0.845 . . . . 0.0 110.987 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 3' ' ' GLN . . . . . 0.489 ' O ' ' N ' ' A' ' 5' ' ' LEU . 89.3 mt-30 -65.37 -22.08 66.76 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.819 0.342 . . . . 0.0 110.576 -179.828 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 4' ' ' GLU . . . . . 0.496 ' O ' ' N ' ' A' ' 7' ' ' GLN . 91.2 mt-10 -43.09 -20.52 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.558 179.912 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.489 ' N ' ' O ' ' A' ' 3' ' ' GLN . 59.6 tp -41.42 -37.47 1.05 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.602 179.671 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 96.3 p -59.09 -37.0 76.07 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.611 179.675 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' GLN . . . . . 0.496 ' N ' ' O ' ' A' ' 4' ' ' GLU . 58.3 tt0 -65.11 -37.01 86.1 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.552 179.05 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 78.8 t60 -53.83 -45.81 70.99 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.519 179.636 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -60.77 -46.24 91.22 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.553 179.688 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.487 ' O ' ' CB ' ' A' ' 14' ' ' GLN . 88.5 mtt-85 -64.91 -32.28 73.91 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.566 179.496 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.584 ' CE1' HD23 ' A' ' 15' ' ' LEU . 48.1 t80 -59.72 -35.19 74.03 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.529 179.854 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 4.2 t -65.21 -48.27 84.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.53 -178.935 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -83.79 -32.71 25.22 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.563 -179.82 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' GLN . . . . . 0.487 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 60.8 tp60 -73.58 -50.27 22.11 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.562 -178.186 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.68 HD13 ' O ' ' A' ' 15' ' ' LEU . 0.3 OUTLIER -63.45 -47.6 81.2 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.521 179.761 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.452 ' HB3' HG11 ' A' ' 26' ' ' VAL . 92.7 mttt -57.33 -32.76 67.04 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.582 179.086 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 60.1 tt0 -73.12 -37.52 66.64 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.598 178.461 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -56.76 -32.98 66.13 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.533 179.442 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.416 ' O ' ' N ' ' A' ' 22' ' ' ARG . 2.8 mt -85.73 -33.13 21.55 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.597 178.569 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 63.9 tttm -44.44 -42.65 7.18 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.559 -179.928 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' THR . . . . . 0.576 ' C ' ' H ' ' A' ' 23' ' ' GLY . 0.2 OUTLIER -75.39 -27.7 59.19 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.516 -179.706 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.416 ' N ' ' O ' ' A' ' 19' ' ' LEU . 77.8 mmt-85 -68.9 21.64 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.536 -179.874 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' GLY . . . . . 0.576 ' H ' ' C ' ' A' ' 21' ' ' THR . . . 87.56 14.11 64.1 Favored Glycine 0 CA--C 1.525 0.7 0 N-CA-C 110.887 -0.885 . . . . 0.0 110.887 -179.567 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.558 HG12 ' N ' ' A' ' 25' ' ' LYS . 11.3 t -104.89 167.19 2.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-O 120.871 0.367 . . . . 0.0 110.538 179.726 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.558 ' N ' HG12 ' A' ' 24' ' ' VAL . 99.3 mttt -135.23 120.95 19.53 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.534 179.62 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.466 HG23 ' O ' ' A' ' 26' ' ' VAL . 17.2 m -120.53 116.12 49.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.551 -179.769 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 29.9 pttt -108.67 166.93 10.43 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.541 179.953 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 98.4 m-85 -47.29 -40.01 15.86 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.551 179.384 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -57.99 -23.38 53.7 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.609 179.547 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 54.9 t0 -62.08 -43.79 98.08 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.548 -179.647 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.525 ' O ' ' CB ' ' A' ' 35' ' ' PHE . 5.6 mp -66.48 -43.45 85.38 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.588 179.545 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.431 ' O ' ' OD2' ' A' ' 36' ' ' ASP . 35.4 mt -58.4 -42.44 87.18 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.508 -177.852 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 85.3 tttt -86.33 -51.69 6.08 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.577 -178.229 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 57.6 t80 -61.7 -49.53 76.11 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.543 -177.669 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.525 ' CB ' ' O ' ' A' ' 31' ' ' LEU . 6.7 t80 -62.26 -44.83 95.66 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.593 -178.398 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 36' ' ' ASP . . . . . 0.431 ' OD2' ' O ' ' A' ' 32' ' ' LEU . 98.4 m-20 -66.95 -35.45 80.0 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.45 -179.644 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 2.3 m-85 -61.18 -52.56 64.29 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.558 -178.642 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.561 ' O ' ' N ' ' A' ' 42' ' ' CYS . 23.0 m -68.06 -38.89 80.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.623 -178.442 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -61.62 -25.94 67.67 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.517 -179.067 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 67.3 t0 -55.61 -55.3 33.69 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.49 -178.693 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.506 ' O ' ' SG ' ' A' ' 42' ' ' CYS . 15.5 p -115.35 -2.65 12.58 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.561 -178.517 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 42' ' ' CYS . . . . . 0.561 ' N ' ' O ' ' A' ' 38' ' ' VAL . 23.1 p 38.25 59.25 5.05 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.558 -179.418 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 43' ' ' PRO . . . . . 0.418 ' C ' ' H ' ' A' ' 45' ' ' PHE . 64.8 Cg_endo -77.12 -23.97 9.99 Favored 'Trans proline' 0 C--N 1.305 -1.72 0 C-N-CA 122.871 2.38 . . . . 0.0 112.142 -179.57 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 44' ' ' TRP . . . . . 0.534 ' CZ3' ' CE3' ' A' ' 56' ' ' TRP . 0.0 OUTLIER -69.36 5.1 1.41 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.569 -179.477 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.418 ' H ' ' C ' ' A' ' 43' ' ' PRO . 38.4 t80 48.2 57.56 17.97 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.572 179.79 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 23.2 Cg_endo -61.0 -7.09 7.18 Favored 'Trans proline' 0 C--N 1.305 -1.74 0 C-N-CA 122.758 2.305 . . . . 0.0 112.16 -178.777 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 82.6 mt-30 -54.7 -52.91 60.95 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.541 -179.796 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 43.8 tp10 -89.68 -27.69 19.95 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.619 179.317 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 85.73 66.04 1.43 Allowed Glycine 0 CA--C 1.525 0.671 0 N-CA-C 110.978 -0.849 . . . . 0.0 110.978 -178.847 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 10.7 t -132.77 170.2 15.61 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.788 0.327 . . . . 0.0 110.584 -179.449 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.8 mt -93.66 141.55 14.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.549 179.532 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' ASP . . . . . 0.522 ' H ' ' HE1' ' A' ' 44' ' ' TRP . 1.2 m-20 -114.51 122.76 47.56 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.542 179.784 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.47 ' CG1' HD12 ' A' ' 90' ' ' ILE . 25.2 mm -96.16 -55.75 5.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.648 179.648 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 67.8 mttm -73.34 -49.26 28.29 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.569 -178.978 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -62.16 -32.01 72.58 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.561 -178.555 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' TRP . . . . . 0.534 ' CE3' ' CZ3' ' A' ' 44' ' ' TRP . 13.0 t-105 -62.86 -38.28 90.2 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.557 179.304 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -64.31 -36.4 83.98 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.523 -179.728 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 94.6 mtt180 -60.54 -53.4 57.93 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.591 -179.294 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.429 HG13 ' N ' ' A' ' 60' ' ' GLY . 2.6 p -66.96 -42.72 89.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.629 -179.862 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 60' ' ' GLY . . . . . 0.429 ' N ' HG13 ' A' ' 59' ' ' VAL . . . -62.72 -37.77 95.37 Favored Glycine 0 CA--C 1.525 0.707 0 N-CA-C 110.915 -0.874 . . . . 0.0 110.915 179.695 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 95.4 m-20 -65.88 -40.37 91.55 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.878 0.371 . . . . 0.0 110.602 -179.238 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 76.7 m -63.34 -57.18 11.2 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.568 -178.927 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 37.8 m-85 -64.4 -42.67 95.96 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.62 -179.153 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 55.8 tt0 -63.92 -34.43 77.95 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.558 -179.345 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.401 ' O ' HG23 ' A' ' 69' ' ' THR . 41.2 t0 -60.33 -53.44 57.62 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.597 -179.945 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 65.7 m-85 -69.81 -39.19 76.67 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.507 179.962 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 69.5 t80 -60.55 -41.07 93.77 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.586 -179.844 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' ASN . . . . . 0.452 ' OD1' ' O ' ' A' ' 72' ' ' PRO . 51.2 t-20 -65.36 -45.52 83.83 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.536 -179.387 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.401 HG23 ' O ' ' A' ' 65' ' ' ASP . 80.4 p -68.87 -16.78 63.86 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.594 -179.185 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 2.3 m-85 -76.02 -5.66 47.45 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.596 -179.325 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' GLY . . . . . 0.493 ' O ' ' N ' ' A' ' 73' ' ' GLU . . . 153.94 -67.14 0.31 Allowed Glycine 0 CA--C 1.525 0.715 0 N-CA-C 110.912 -0.875 . . . . 0.0 110.912 179.535 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 72' ' ' PRO . . . . . 0.452 ' O ' ' OD1' ' A' ' 68' ' ' ASN . 38.6 Cg_exo -39.69 88.12 0.01 OUTLIER 'Trans proline' 0 C--N 1.304 -1.812 0 C-N-CA 122.815 2.344 . . . . 0.0 112.114 -176.874 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.493 ' N ' ' O ' ' A' ' 71' ' ' GLY . 83.2 tt0 -66.24 -34.65 78.49 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.576 179.589 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.7 ' CD ' ' H ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -97.0 -16.72 20.46 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.549 179.9 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.511 ' O ' ' O ' ' A' ' 74' ' ' LYS . 19.8 t 57.4 132.04 0.02 OUTLIER Pre-proline 0 C--N 1.329 -0.323 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.526 179.447 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 41.1 Cg_exo -50.44 123.65 11.68 Favored 'Trans proline' 0 C--N 1.305 -1.737 0 C-N-CA 122.864 2.376 . . . . 0.0 112.101 178.352 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.417 ' O ' ' N ' ' A' ' 80' ' ' PHE . 40.6 t -81.79 -20.33 10.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.531 -179.795 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 78' ' ' THR . . . . . 0.41 ' O ' ' OG ' ' A' ' 81' ' ' SER . 22.7 p -43.1 -24.8 0.09 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.585 178.815 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.91 -37.74 86.88 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.534 179.92 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 80' ' ' PHE . . . . . 0.417 ' N ' ' O ' ' A' ' 77' ' ' VAL . 2.5 m-85 -63.1 -37.17 86.16 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.601 -179.263 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 81' ' ' SER . . . . . 0.41 ' OG ' ' O ' ' A' ' 78' ' ' THR . 93.3 p -58.62 -39.6 80.94 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.574 -179.727 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 11.2 m-85 -61.17 -47.73 84.82 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.601 179.688 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 83' ' ' TRP . . . . . 0.422 ' O ' ' CB ' ' A' ' 87' ' ' LYS . 40.0 t90 -59.19 -37.82 78.35 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.568 -179.528 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 97.5 m-20 -61.24 -47.04 87.87 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.549 -178.598 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 25.4 tp -72.27 -55.44 7.17 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.563 179.782 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -56.11 -25.37 19.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.567 179.506 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.422 ' CB ' ' O ' ' A' ' 83' ' ' TRP . 57.1 tttt -67.56 -50.78 56.89 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.61 179.467 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 88' ' ' GLU . . . . . 0.469 ' C ' ' CD ' ' A' ' 88' ' ' GLU . 0.9 OUTLIER -78.96 -20.17 49.89 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.551 -179.873 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.581 ' O ' HD13 ' A' ' 89' ' ' LEU . 0.2 OUTLIER -60.29 -49.42 77.66 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.535 179.845 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.47 HD12 ' CG1' ' A' ' 53' ' ' ILE . 3.3 mt -63.79 -41.09 91.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.56 179.21 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 97.5 m-20 -69.18 -16.43 63.62 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.572 -179.409 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 70.4 tttt -68.4 140.97 55.83 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.561 -179.886 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -70.9 -4.56 25.05 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.488 -179.522 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 27.5 tp10 -84.57 46.78 1.27 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.562 -179.579 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 34.1 m -125.83 132.91 70.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.519 -179.807 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 96' ' ' ASN . . . . . 0.587 ' O ' ' N ' ' A' ' 98' ' ' GLN . 10.1 m-20 -87.18 157.58 53.54 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.548 -179.249 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_exo -41.35 -13.24 0.03 OUTLIER 'Trans proline' 0 C--N 1.305 -1.733 0 C-N-CA 122.812 2.341 . . . . 0.0 112.147 178.785 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 98' ' ' GLN . . . . . 0.587 ' N ' ' O ' ' A' ' 96' ' ' ASN . 6.9 pt20 . . . . . 0 C--N 1.33 -0.262 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.554 179.951 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 28.9 m . . . . . 0 C--O 1.231 0.11 0 CA-C-O 120.82 0.343 . . . . 0.0 110.556 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 86.9 mt-10 -124.19 -175.61 3.29 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.519 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 108' ' ' GLU . . . . . 0.55 ' O ' ' N ' ' A' ' 110' ' ' LEU . 73.8 mm-40 -106.58 122.45 46.34 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.553 179.373 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 109' ' ' ILE . . . . . 0.418 ' O ' ' OG ' ' A' ' 112' ' ' SER . 43.8 pt -45.49 -12.87 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.595 179.869 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.55 ' N ' ' O ' ' A' ' 108' ' ' GLU . 25.6 mt -67.11 -44.94 78.68 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.509 179.843 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 62.4 tttm -65.34 -33.86 76.96 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.566 -179.605 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 112' ' ' SER . . . . . 0.418 ' OG ' ' O ' ' A' ' 109' ' ' ILE . 97.0 p -63.57 -46.83 84.09 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.551 -179.813 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 31.7 t30 -65.57 -42.45 91.79 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.588 179.608 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 114' ' ' SER . . . . . 0.444 ' C ' ' H ' ' A' ' 116' ' ' THR . 22.8 t -164.51 132.57 3.38 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.552 179.994 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 86.6 mt-30 -77.94 27.65 0.18 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.54 179.984 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 116' ' ' THR . . . . . 0.444 ' H ' ' C ' ' A' ' 114' ' ' SER . 7.8 m -61.22 -41.3 96.62 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.557 179.914 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 95.0 m-20 . . . . . 0 C--N 1.329 -0.299 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.592 179.656 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.704 0 N-CA-C 110.941 -0.864 . . . . 0.0 110.941 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 52.3 tt0 -63.14 -29.38 70.75 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.871 0.367 . . . . 0.0 110.444 -179.827 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 95.2 mt-10 -55.97 -22.98 29.52 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.651 179.811 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 43.2 tp -44.23 -35.3 2.2 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.511 -179.525 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 78.2 p -55.03 -35.14 64.13 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.641 -0.423 . . . . 0.0 109.92 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 68.2 tp60 -64.11 -35.57 81.17 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.181 179.561 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 83.2 t60 -60.28 -44.62 95.18 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.257 179.988 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -58.78 -46.53 87.3 Favored 'General case' 0 C--O 1.241 0.613 0 C-N-CA 120.522 -0.471 . . . . 0.0 110.183 -179.923 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.443 ' O ' ' CB ' ' A' ' 14' ' ' GLN . 87.2 mtt-85 -67.21 -36.53 81.92 Favored 'General case' 0 C--O 1.21 -1.008 0 N-CA-C 109.322 -0.622 . . . . 0.0 109.322 179.607 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.445 ' OH ' HD11 ' A' ' 51' ' ' ILE . 20.3 t80 -57.87 -27.9 63.67 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 120.878 -0.329 . . . . 0.0 110.313 -179.433 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 6.7 t -73.8 -51.16 25.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 C-N-CA 120.241 -0.584 . . . . 0.0 111.109 179.69 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -81.49 -23.72 37.17 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.084 0.469 . . . . 0.0 111.635 -179.329 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' GLN . . . . . 0.443 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 66.5 tp60 -77.49 -53.57 7.47 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.978 -179.117 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.572 HD13 ' O ' ' A' ' 15' ' ' LEU . 0.2 OUTLIER -63.47 -45.4 90.98 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-O 120.896 0.379 . . . . 0.0 110.062 -179.907 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.552 ' HB3' HG11 ' A' ' 26' ' ' VAL . 98.3 mttt -59.99 -36.22 76.7 Favored 'General case' 0 C--O 1.232 0.145 0 C-N-CA 120.617 -0.433 . . . . 0.0 109.953 179.568 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 73.9 mt-30 -72.94 -40.33 65.48 Favored 'General case' 0 C--O 1.238 0.453 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.632 178.738 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -57.33 -26.57 61.14 Favored 'General case' 0 CA--C 1.518 -0.256 0 CA-C-N 115.918 -0.583 . . . . 0.0 109.97 179.935 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 4.2 mt -84.71 -40.96 16.71 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.846 -0.342 . . . . 0.0 110.452 178.949 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 28.8 mtmt -45.45 -44.2 12.04 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.124 -178.885 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' THR . . . . . 0.447 ' H ' HG22 ' A' ' 21' ' ' THR . 0.1 OUTLIER -58.5 -34.33 70.82 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 120.422 -0.511 . . . . 0.0 110.425 -179.5 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 84.2 mmt-85 -66.56 -7.09 17.72 Favored 'General case' 0 C--N 1.332 -0.195 0 C-N-CA 120.656 -0.418 . . . . 0.0 110.295 -179.881 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 107.22 23.7 6.87 Favored Glycine 0 CA--C 1.526 0.778 0 N-CA-C 111.021 -0.832 . . . . 0.0 111.021 -179.721 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.66 HG12 ' N ' ' A' ' 25' ' ' LYS . 38.6 t -102.89 169.32 1.96 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 N-CA-C 110.337 -0.246 . . . . 0.0 110.337 -179.991 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.66 ' N ' HG12 ' A' ' 24' ' ' VAL . 99.0 mttt -134.65 131.82 38.22 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.985 -0.376 . . . . 0.0 109.985 179.268 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.552 HG11 ' HB3' ' A' ' 16' ' ' LYS . 28.4 m -122.88 129.23 75.26 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.285 0 N-CA-C 109.989 -0.374 . . . . 0.0 109.989 179.887 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 23.7 ttmt -109.53 159.99 16.61 Favored 'General case' 0 N--CA 1.463 0.18 0 N-CA-C 110.065 -0.346 . . . . 0.0 110.065 179.585 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -50.61 -31.77 16.93 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.001 0.429 . . . . 0.0 109.867 179.341 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -55.34 -23.31 23.29 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.225 179.414 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.423 ' O ' ' CB ' ' A' ' 34' ' ' PHE . 86.0 m-20 -61.2 -48.15 82.84 Favored 'General case' 0 C--O 1.219 -0.512 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.56 -179.525 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.495 ' O ' ' CB ' ' A' ' 35' ' ' PHE . 5.3 mp -66.07 -41.45 90.74 Favored 'General case' 0 C--O 1.216 -0.708 0 C-N-CA 120.571 -0.452 . . . . 0.0 110.385 179.469 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 37.8 mt -58.97 -46.3 88.45 Favored 'General case' 0 C--N 1.313 -0.99 0 C-N-CA 119.468 -0.893 . . . . 0.0 111.176 -178.013 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.441 ' O ' ' CB ' ' A' ' 37' ' ' PHE . 87.9 tttt -85.49 -48.17 9.22 Favored 'General case' 0 C--N 1.319 -0.754 0 C-N-CA 120.553 -0.459 . . . . 0.0 112.091 -178.692 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 34' ' ' PHE . . . . . 0.825 ' O ' HG22 ' A' ' 38' ' ' VAL . 44.0 t80 -63.54 -48.07 79.04 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.376 -178.993 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.495 ' CB ' ' O ' ' A' ' 31' ' ' LEU . 18.4 t80 -61.85 -48.41 80.68 Favored 'General case' 0 C--N 1.33 -0.242 0 C-N-CA 120.475 -0.49 . . . . 0.0 110.363 -179.146 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 65.8 t0 -72.96 -34.8 66.72 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 120.474 -0.49 . . . . 0.0 111.462 -179.803 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.712 ' CZ ' HG22 ' A' ' 59' ' ' VAL . 4.3 t80 -60.99 -48.5 81.55 Favored 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 120.984 -0.286 . . . . 0.0 111.635 -178.296 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.825 HG22 ' O ' ' A' ' 34' ' ' PHE . 15.4 m -74.6 -36.93 42.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 C-N-CA 120.408 -0.517 . . . . 0.0 110.688 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -55.7 -29.79 60.02 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.867 -179.813 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 68.0 t0 -47.03 -61.49 1.85 Allowed 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 120.646 -0.421 . . . . 0.0 110.745 -179.744 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 13.9 p -114.8 2.01 14.27 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.345 -0.388 . . . . 0.0 111.049 179.822 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' CYS . . . . . 0.539 ' N ' ' O ' ' A' ' 38' ' ' VAL . 1.9 m 38.07 58.59 4.9 Favored Pre-proline 0 CA--C 1.534 0.364 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.831 -178.706 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 43' ' ' PRO . . . . . 0.49 ' C ' ' H ' ' A' ' 45' ' ' PHE . 26.9 Cg_exo -63.39 -36.97 52.32 Favored 'Trans proline' 0 N--CA 1.5 1.885 0 C-N-CA 122.617 2.211 . . . . 0.0 112.857 -179.069 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 44' ' ' TRP . . . . . 0.829 ' HE1' ' H ' ' A' ' 52' ' ' ASP . 0.0 OUTLIER -66.45 6.19 0.48 Allowed 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.62 -179.281 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.493 ' C ' ' H ' ' A' ' 47' ' ' GLN . 19.8 m-85 44.25 56.48 13.51 Favored Pre-proline 0 C--N 1.33 -0.24 0 N-CA-C 109.887 -0.412 . . . . 0.0 109.887 -179.832 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 10.2 Cg_endo -51.27 -6.34 0.12 Allowed 'Trans proline' 0 N--CA 1.493 1.445 0 C-N-CA 122.773 2.316 . . . . 0.0 111.917 179.929 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.493 ' H ' ' C ' ' A' ' 45' ' ' PHE . 95.9 mm-40 -62.72 -52.04 64.82 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.128 -179.913 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.482 ' N ' ' CD ' ' A' ' 48' ' ' GLU . 0.0 OUTLIER -88.0 -31.82 19.14 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-O 121.04 0.448 . . . . 0.0 110.169 178.973 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 85.7 66.18 1.42 Allowed Glycine 0 CA--C 1.523 0.554 0 N-CA-C 110.616 -0.994 . . . . 0.0 110.616 -178.731 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 14.8 t -125.98 170.24 11.91 Favored 'General case' 0 CA--C 1.517 -0.305 0 CA-C-O 120.679 0.276 . . . . 0.0 110.772 -179.502 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.445 HD11 ' OH ' ' A' ' 11' ' ' TYR . 1.3 mt -102.36 138.88 25.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.198 179.814 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 52' ' ' ASP . . . . . 0.829 ' H ' ' HE1' ' A' ' 44' ' ' TRP . 84.2 m-20 -114.28 122.15 45.84 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.726 179.644 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.504 ' CG1' HD12 ' A' ' 90' ' ' ILE . 29.9 mm -94.63 -55.86 5.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.506 179.735 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -78.01 -50.48 12.02 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-O 121.032 0.444 . . . . 0.0 111.707 -179.06 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 93.1 mtt-85 -59.47 -32.01 69.85 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.082 -0.508 . . . . 0.0 109.863 -179.64 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' TRP . . . . . 0.573 ' CE3' ' CH2' ' A' ' 44' ' ' TRP . 23.2 t-105 -60.7 -40.81 93.64 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.449 179.098 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 92.5 mtm-85 -63.28 -33.63 75.93 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 120.291 -0.564 . . . . 0.0 109.831 179.92 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 74.0 ttt180 -60.41 -52.47 65.1 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 120.315 -0.554 . . . . 0.0 110.853 -179.571 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.712 HG22 ' CZ ' ' A' ' 37' ' ' PHE . 4.3 p -69.0 -42.8 82.26 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.571 0 CA-C-O 120.71 0.29 . . . . 0.0 110.567 179.48 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 60' ' ' GLY . . . . . 0.435 ' O ' ' CB ' ' A' ' 64' ' ' GLN . . . -65.27 -47.58 78.72 Favored Glycine 0 CA--C 1.525 0.688 0 CA-C-N 116.297 -0.41 . . . . 0.0 112.337 -178.945 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 96.9 m-20 -60.98 -40.76 94.65 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.784 0.292 . . . . 0.0 111.296 -178.552 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 70.7 m -61.72 -59.92 4.45 Favored 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 120.708 -0.397 . . . . 0.0 111.467 -179.299 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 15.4 m-85 -65.72 -42.71 90.75 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.342 -179.805 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' GLN . . . . . 0.473 ' HG2' HD21 ' A' ' 68' ' ' ASN . 58.2 tt0 -61.17 -41.31 96.57 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.388 -179.458 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 24.8 t0 -55.46 -56.78 16.19 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.872 0.368 . . . . 0.0 110.906 -179.757 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 50.5 m-85 -64.57 -43.31 94.3 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 120.57 -0.452 . . . . 0.0 110.421 179.664 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 64.7 t80 -52.65 -42.33 64.58 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.596 -179.351 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' ASN . . . . . 0.473 HD21 ' HG2' ' A' ' 64' ' ' GLN . 19.3 m-20 -62.77 -42.51 99.72 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.421 -179.298 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 25.0 p -71.67 -16.46 62.25 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.495 -179.992 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -87.35 12.83 11.04 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.769 -179.632 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 152.06 -79.17 0.2 Allowed Glycine 0 CA--C 1.53 0.98 0 C-N-CA 120.384 -0.912 . . . . 0.0 112.322 179.039 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_exo -40.59 100.84 0.03 OUTLIER 'Trans proline' 0 C--N 1.307 -1.642 0 C-N-CA 122.712 2.275 . . . . 0.0 112.06 -178.514 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 80.2 mm-40 -73.47 -42.76 61.51 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.655 -0.702 . . . . 0.0 109.928 179.19 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.668 ' CD ' ' H ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -94.95 -13.39 25.38 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.091 179.779 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.485 ' O ' ' O ' ' A' ' 74' ' ' LYS . 36.4 t 56.22 123.77 0.01 OUTLIER Pre-proline 0 CA--C 1.544 0.715 0 O-C-N 123.143 0.277 . . . . 0.0 111.416 -179.938 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_exo -53.24 128.04 27.56 Favored 'Trans proline' 0 N--CA 1.495 1.616 0 C-N-CA 121.166 1.244 . . . . 0.0 112.251 179.232 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.453 ' O ' ' N ' ' A' ' 80' ' ' PHE . 59.8 t -82.84 -18.42 10.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 115.38 -0.827 . . . . 0.0 110.65 179.211 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 62.7 p -42.98 -24.23 0.06 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.924 0.392 . . . . 0.0 110.433 -179.621 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 79' ' ' ALA . . . . . 0.436 ' N ' ' O ' ' A' ' 77' ' ' VAL . . . -64.88 -37.88 89.09 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.784 179.642 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 80' ' ' PHE . . . . . 0.453 ' N ' ' O ' ' A' ' 77' ' ' VAL . 3.7 m-85 -58.94 -33.14 70.25 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.418 -179.744 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 39.0 t -60.3 -42.94 96.59 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.115 179.708 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 -59.69 -49.91 75.92 Favored 'General case' 0 CA--C 1.517 -0.311 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.586 179.722 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 83' ' ' TRP . . . . . 0.471 ' C ' ' CD1' ' A' ' 83' ' ' TRP . 8.3 t-105 -54.51 -40.38 68.51 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.733 -179.826 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 87.6 m-20 -61.98 -44.84 95.9 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 120.461 -0.496 . . . . 0.0 111.153 -179.404 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 29.9 tp -73.29 -55.08 6.9 Favored 'General case' 0 C--O 1.222 -0.377 0 C-N-CA 120.31 -0.556 . . . . 0.0 110.565 179.569 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -55.58 -25.77 18.54 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 C-N-CA 120.591 -0.444 . . . . 0.0 110.406 179.921 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 67.4 tttt -67.4 -50.68 58.49 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.656 179.648 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 88' ' ' GLU . . . . . 0.413 ' OE1' ' O ' ' A' ' 88' ' ' GLU . 1.1 pp20? -79.76 -20.02 47.3 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.745 -0.661 . . . . 0.0 111.113 -179.077 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.531 ' O ' HD13 ' A' ' 89' ' ' LEU . 0.2 OUTLIER -62.05 -46.3 89.76 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 120.66 -0.416 . . . . 0.0 110.227 -179.446 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.504 HD12 ' CG1' ' A' ' 53' ' ' ILE . 3.8 mt -64.69 -43.05 96.61 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.215 0 C-N-CA 120.184 -0.606 . . . . 0.0 109.85 -179.662 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -54.92 -42.83 72.7 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.974 -178.758 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 58.9 mmtt -48.32 131.13 16.71 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 120.668 -0.413 . . . . 0.0 110.4 -179.991 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -63.57 -37.43 87.29 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.603 179.854 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 70.5 tt0 -69.92 54.98 0.13 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.347 -179.625 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 35.5 m -70.44 155.51 7.58 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-O 120.946 0.403 . . . . 0.0 110.057 -179.948 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 96' ' ' ASN . . . . . . . . . . . . . 1.3 m-20 -59.28 160.42 12.63 Favored Pre-proline 0 C--N 1.325 -0.476 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.873 -179.289 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -60.02 -10.83 13.46 Favored 'Trans proline' 0 N--CA 1.494 1.503 0 C-N-CA 123.101 2.534 . . . . 0.0 111.941 179.391 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.321 -0.633 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.869 -179.412 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 3.6 t . . . . . 0 C--O 1.231 0.118 0 CA-C-O 120.711 0.291 . . . . 0.0 110.635 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 89.9 mt-10 -89.0 149.17 23.38 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.459 -179.822 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 108' ' ' GLU . . . . . 0.522 ' C ' ' H ' ' A' ' 110' ' ' LEU . 97.0 mt-10 -73.84 139.16 44.89 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 120.378 -0.529 . . . . 0.0 109.655 179.092 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 26.7 pt -54.86 -5.21 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.127 179.452 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.622 ' O ' HD12 ' A' ' 110' ' ' LEU . 3.4 pp -170.35 120.05 0.59 Allowed 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 116.251 -0.431 . . . . 0.0 109.99 179.789 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 111' ' ' LYS . . . . . 0.448 ' HG3' ' H ' ' A' ' 114' ' ' SER . 25.5 pttm -139.4 151.12 46.03 Favored 'General case' 0 C--O 1.231 0.124 0 CA-C-O 120.67 0.271 . . . . 0.0 110.377 -179.512 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 88.1 p -60.42 -22.28 63.21 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.667 -179.358 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 39.7 t30 -64.63 -40.81 96.11 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.682 179.73 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 114' ' ' SER . . . . . 0.448 ' H ' ' HG3' ' A' ' 111' ' ' LYS . 23.3 t -117.64 -68.0 0.95 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.917 179.991 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 9.3 mt-30 41.31 86.48 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.034 0.445 . . . . 0.0 110.744 -179.73 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 72.0 p -74.28 -22.86 59.11 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.009 -0.542 . . . . 0.0 110.353 179.869 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 97.7 m-20 . . . . . 0 C--N 1.329 -0.298 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.6 179.855 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.704 0 N-CA-C 110.958 -0.857 . . . . 0.0 110.958 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 77.5 mt-30 -58.27 -31.31 67.33 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.898 0.38 . . . . 0.0 110.624 -179.921 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 4' ' ' GLU . . . . . 0.431 ' OE1' ' OE1' ' A' ' 7' ' ' GLN . 78.0 mm-40 -51.91 -23.48 5.0 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.284 -179.945 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 37.2 tp -42.84 -27.2 0.17 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.439 -179.406 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 37.6 t -59.68 -41.64 91.14 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.15 179.661 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' GLN . . . . . 0.431 ' OE1' ' OE1' ' A' ' 4' ' ' GLU . 89.1 mt-30 -61.96 -30.19 70.75 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.569 179.827 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 84.5 t60 -63.46 -44.83 93.33 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.822 0.344 . . . . 0.0 110.359 179.932 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 80.5 tt0 -59.66 -50.13 75.04 Favored 'General case' 0 C--O 1.243 0.721 0 CA-C-O 121.361 0.6 . . . . 0.0 110.352 179.7 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.43 ' O ' ' CB ' ' A' ' 14' ' ' GLN . 86.2 mtt180 -62.44 -33.18 74.3 Favored 'General case' 0 C--O 1.211 -0.956 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 179.55 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 31.7 t80 -58.89 -36.4 74.59 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 110.175 -0.305 . . . . 0.0 110.175 -179.588 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.406 HG11 ' CD2' ' A' ' 31' ' ' LEU . 3.6 t -64.36 -49.66 79.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 C-N-CA 119.987 -0.685 . . . . 0.0 111.488 179.997 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -81.08 -30.74 34.62 Favored 'General case' 0 C--N 1.324 -0.523 0 C-N-CA 120.582 -0.447 . . . . 0.0 111.826 -179.357 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' GLN . . . . . 0.43 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 60.5 tp60 -74.23 -52.17 13.18 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.916 -0.583 . . . . 0.0 110.896 -178.982 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.568 HD13 ' O ' ' A' ' 15' ' ' LEU . 0.2 OUTLIER -62.91 -44.21 96.7 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 120.407 -0.517 . . . . 0.0 109.809 -179.557 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.662 ' HB3' HG21 ' A' ' 26' ' ' VAL . 66.0 mttm -59.53 -34.4 72.6 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.848 0.356 . . . . 0.0 110.198 179.091 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 35.8 mm-40 -66.58 -42.01 87.65 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.489 0.661 . . . . 0.0 110.022 179.038 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.624 ' O ' HG22 ' A' ' 21' ' ' THR . . . -61.39 -28.66 69.4 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.912 -0.585 . . . . 0.0 109.732 179.277 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.9 mt -74.19 -33.85 63.56 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.933 0.397 . . . . 0.0 110.652 178.651 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 67.8 mttm -54.56 -37.33 65.34 Favored 'General case' 0 C--N 1.323 -0.548 0 C-N-CA 120.188 -0.605 . . . . 0.0 109.883 -179.775 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' THR . . . . . 0.624 HG22 ' O ' ' A' ' 18' ' ' ALA . 1.2 t -60.57 -28.1 68.2 Favored 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 120.397 -0.521 . . . . 0.0 110.863 179.37 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 7.7 mmm180 -80.2 12.79 2.65 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-O 120.98 0.419 . . . . 0.0 110.584 -179.567 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 81.04 14.0 80.1 Favored Glycine 0 CA--C 1.522 0.514 0 N-CA-C 110.491 -1.044 . . . . 0.0 110.491 -179.8 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.581 HG12 ' N ' ' A' ' 25' ' ' LYS . 37.9 t -86.83 165.34 2.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 C-N-CA 120.981 -0.287 . . . . 0.0 110.446 -179.706 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.581 ' N ' HG12 ' A' ' 24' ' ' VAL . 99.1 mttt -139.12 129.61 25.76 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 120.916 -0.314 . . . . 0.0 110.235 179.429 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.662 HG21 ' HB3' ' A' ' 16' ' ' LYS . 13.7 m -126.74 130.89 71.57 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.239 0 N-CA-C 109.943 -0.391 . . . . 0.0 109.943 179.584 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.55 ' N ' ' OD2' ' A' ' 30' ' ' ASP . 10.9 ttmt -109.16 161.78 14.89 Favored 'General case' 0 C--O 1.221 -0.401 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 179.674 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.411 ' H ' ' HG2' ' A' ' 27' ' ' LYS . 98.4 m-85 -41.89 -33.28 0.51 Allowed 'General case' 0 C--O 1.236 0.392 0 CA-C-O 121.101 0.477 . . . . 0.0 110.796 179.646 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.401 ' HA ' HD12 ' A' ' 32' ' ' LEU . . . -55.7 -22.45 23.52 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.525 179.702 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.55 ' OD2' ' N ' ' A' ' 27' ' ' LYS . 3.2 m-20 -58.55 -49.48 77.27 Favored 'General case' 0 CA--C 1.516 -0.364 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.281 -179.396 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.5 ' O ' ' CB ' ' A' ' 35' ' ' PHE . 4.9 mp -67.21 -41.27 86.05 Favored 'General case' 0 C--O 1.215 -0.75 0 CA-C-O 120.985 0.421 . . . . 0.0 110.242 179.273 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.448 ' O ' ' OD1' ' A' ' 36' ' ' ASP . 40.8 mt -59.04 -44.97 91.84 Favored 'General case' 0 C--N 1.315 -0.927 0 C-N-CA 119.692 -0.803 . . . . 0.0 111.246 -178.238 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.527 ' O ' ' CD1' ' A' ' 37' ' ' PHE . 88.6 tttt -84.53 -37.79 20.82 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.939 -178.658 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 34' ' ' PHE . . . . . 0.581 ' O ' HG22 ' A' ' 38' ' ' VAL . 62.4 t80 -78.07 -51.03 10.93 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.393 -178.681 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.5 ' CB ' ' O ' ' A' ' 31' ' ' LEU . 12.9 t80 -60.07 -46.55 89.19 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.389 -179.327 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 36' ' ' ASP . . . . . 0.468 ' OD1' ' O ' ' A' ' 33' ' ' LYS . 3.7 p-10 -70.28 -31.37 68.7 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 120.216 -0.594 . . . . 0.0 111.198 -179.438 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.527 ' CD1' ' O ' ' A' ' 33' ' ' LYS . 1.4 m-85 -60.68 -55.62 31.07 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-O 120.73 0.3 . . . . 0.0 111.673 -179.037 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.581 HG22 ' O ' ' A' ' 34' ' ' PHE . 5.3 m -69.7 -37.65 74.38 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 C-N-CA 120.556 -0.458 . . . . 0.0 110.717 -179.565 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 65.5 tttm -56.92 -27.61 61.07 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.57 -179.822 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 93.4 m-20 -50.6 -62.98 1.27 Allowed 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 120.685 -0.406 . . . . 0.0 110.63 -179.546 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.492 ' O ' ' SG ' ' A' ' 42' ' ' CYS . 24.9 p -115.05 8.99 15.87 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.293 -179.943 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 42' ' ' CYS . . . . . 0.521 ' N ' ' O ' ' A' ' 38' ' ' VAL . 7.4 p 38.42 59.14 5.24 Favored Pre-proline 0 N--CA 1.465 0.279 0 CA-C-O 120.883 0.373 . . . . 0.0 110.679 -179.529 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 43' ' ' PRO . . . . . 0.49 ' C ' ' H ' ' A' ' 45' ' ' PHE . 57.5 Cg_endo -74.21 -28.1 10.99 Favored 'Trans proline' 0 C--N 1.31 -1.499 0 C-N-CA 122.79 2.327 . . . . 0.0 112.445 -179.619 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 44' ' ' TRP . . . . . 0.465 ' CD1' ' O ' ' A' ' 50' ' ' THR . 0.6 OUTLIER -62.28 1.37 0.33 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.603 -179.469 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.544 ' O ' ' N ' ' A' ' 47' ' ' GLN . 60.8 m-85 50.44 55.61 16.81 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.44 -179.277 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.425 ' CD ' ' N ' ' A' ' 45' ' ' PHE . 70.1 Cg_exo -42.14 -14.82 0.05 OUTLIER 'Trans proline' 0 C--N 1.307 -1.627 0 C-N-CA 122.849 2.366 . . . . 0.0 112.218 179.644 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.544 ' N ' ' O ' ' A' ' 45' ' ' PHE . 87.1 mt-30 -65.98 -53.07 43.64 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.248 -179.27 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 65.8 tt0 -88.87 -30.21 19.07 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.373 178.599 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 73.78 50.64 10.74 Favored Glycine 0 CA--C 1.526 0.764 0 N-CA-C 110.383 -1.087 . . . . 0.0 110.383 -179.239 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' THR . . . . . 0.465 ' O ' ' CD1' ' A' ' 44' ' ' TRP . 15.0 t -107.68 160.71 15.49 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.842 0.354 . . . . 0.0 110.744 -179.468 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.434 ' HB ' HD11 ' A' ' 90' ' ' ILE . 1.5 mt -89.71 137.35 21.59 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-O 121.143 0.497 . . . . 0.0 110.593 179.452 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 57.9 m-20 -108.18 120.77 43.29 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.435 -0.802 . . . . 0.0 111.328 179.227 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.475 ' CG1' HD12 ' A' ' 90' ' ' ILE . 30.2 mm -95.03 -57.01 4.68 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.255 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.17 179.166 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -77.09 -49.03 16.21 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-O 121.076 0.465 . . . . 0.0 111.215 -179.659 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 84.5 mtt85 -60.31 -32.47 71.25 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.01 -179.628 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 13.8 t-105 -61.87 -40.3 94.91 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.735 179.48 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 80.2 mtp85 -62.82 -38.55 91.16 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.531 -179.555 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 83.7 mtt85 -60.84 -52.65 64.16 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 120.593 -0.443 . . . . 0.0 111.385 -179.546 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.409 HG13 ' N ' ' A' ' 60' ' ' GLY . 3.2 p -66.55 -42.12 89.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.6 179.739 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 60' ' ' GLY . . . . . 0.409 ' N ' HG13 ' A' ' 59' ' ' VAL . . . -61.7 -45.37 96.4 Favored Glycine 0 CA--C 1.522 0.521 0 N-CA-C 111.229 -0.748 . . . . 0.0 111.229 -179.399 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 71.3 m-20 -64.67 -35.15 80.1 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 121.118 -0.233 . . . . 0.0 110.669 -179.444 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 72.4 m -64.21 -59.73 4.06 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.809 0.338 . . . . 0.0 111.144 -179.492 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 50.7 m-85 -65.4 -39.7 92.52 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.284 -0.417 . . . . 0.0 110.86 179.642 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' GLN . . . . . 0.402 ' CB ' ' O ' ' A' ' 60' ' ' GLY . 58.5 tt0 -63.91 -36.02 82.57 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.749 -179.65 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 31.4 t0 -60.75 -52.77 63.7 Favored 'General case' 0 C--N 1.323 -0.549 0 C-N-CA 120.709 -0.396 . . . . 0.0 110.497 179.957 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 69.8 m-85 -70.5 -42.73 70.94 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.911 179.69 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 65.0 t80 -57.99 -43.39 86.54 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.226 -179.457 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' ASN . . . . . 0.455 ' C ' ' OD1' ' A' ' 68' ' ' ASN . 21.2 t-20 -60.58 -44.32 96.35 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.28 -179.917 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 82.2 p -74.48 -18.36 60.63 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 120.555 -0.458 . . . . 0.0 110.111 -179.934 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 26.7 m-85 -109.04 16.5 22.53 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.261 179.736 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -167.7 -105.61 0.18 Allowed Glycine 0 CA--C 1.533 1.156 0 C-N-CA 120.579 -0.82 . . . . 0.0 111.126 -179.99 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' PRO . . . . . 0.585 ' HG2' HG22 ' A' ' 75' ' ' VAL . 67.7 Cg_endo -74.13 147.61 38.27 Favored 'Trans proline' 0 N--CA 1.494 1.558 0 C-N-CA 121.893 1.729 . . . . 0.0 113.093 -179.592 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 98.1 mt-10 -85.64 -47.49 9.77 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.286 179.541 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.704 ' CD ' ' H ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -95.84 -17.34 21.21 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.512 -178.821 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.585 HG22 ' HG2' ' A' ' 72' ' ' PRO . 26.7 t 59.2 131.87 0.02 OUTLIER Pre-proline 0 C--N 1.324 -0.505 0 CA-C-N 115.589 -0.732 . . . . 0.0 111.214 -179.186 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 49.4 Cg_exo -52.43 127.88 25.72 Favored 'Trans proline' 0 N--CA 1.494 1.536 0 C-N-CA 121.629 1.552 . . . . 0.0 111.358 179.045 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.458 ' O ' HG12 ' A' ' 77' ' ' VAL . 46.2 t -82.62 -8.5 11.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.898 179.988 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 73.7 p -48.22 -20.51 0.38 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.361 -179.707 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -60.45 -24.62 65.37 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.499 179.5 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 47.8 t80 -60.81 -39.25 88.26 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.436 -179.987 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 77.4 p -58.46 -40.52 82.88 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.529 -179.958 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 82' ' ' TYR . . . . . 0.43 ' OH ' HG11 ' A' ' 26' ' ' VAL . 23.5 m-85 -60.62 -52.3 65.75 Favored 'General case' 0 C--O 1.221 -0.412 0 C-N-CA 120.674 -0.41 . . . . 0.0 110.812 179.736 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 83' ' ' TRP . . . . . 0.405 ' O ' ' CB ' ' A' ' 87' ' ' LYS . 77.2 t90 -54.14 -39.67 66.69 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.431 -0.349 . . . . 0.0 110.638 -179.807 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 67.7 m-20 -63.28 -47.12 83.68 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.768 -0.373 . . . . 0.0 111.197 -179.813 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 32.7 tp -70.67 -54.39 12.07 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 120.21 -0.596 . . . . 0.0 110.705 179.399 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -56.53 -26.62 23.41 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.162 -179.81 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.405 ' CB ' ' O ' ' A' ' 83' ' ' TRP . 53.8 tttt -66.61 -49.18 67.14 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.841 -179.473 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.2 pp20? -79.6 -20.44 46.88 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.54 -179.788 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.516 ' O ' HD13 ' A' ' 89' ' ' LEU . 0.2 OUTLIER -62.36 -45.82 91.42 Favored 'General case' 0 N--CA 1.446 -0.64 0 C-N-CA 120.077 -0.649 . . . . 0.0 110.574 -179.224 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.475 HD12 ' CG1' ' A' ' 53' ' ' ILE . 3.5 mt -64.91 -43.57 96.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 C-N-CA 120.332 -0.547 . . . . 0.0 109.78 -179.936 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 91.1 m-20 -44.06 -36.86 2.72 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.844 -178.455 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -50.49 129.28 21.85 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 120.475 -0.49 . . . . 0.0 110.427 179.803 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -62.34 -40.72 97.29 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.652 -179.853 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 94' ' ' GLU . . . . . 0.468 ' O ' ' C ' ' A' ' 95' ' ' VAL . 97.7 mt-10 -71.33 -3.96 23.48 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.823 -179.607 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.468 ' C ' ' O ' ' A' ' 94' ' ' GLU . 2.4 m 29.58 -109.88 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.36 0 O-C-N 123.711 0.632 . . . . 0.0 110.403 -179.791 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 96' ' ' ASN . . . . . 0.595 ' OD1' ' NE2' ' A' ' 98' ' ' GLN . 0.0 OUTLIER -154.17 169.93 9.24 Favored Pre-proline 0 C--N 1.325 -0.461 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.482 178.962 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -48.56 -13.14 0.23 Allowed 'Trans proline' 0 N--CA 1.494 1.542 0 C-N-CA 122.705 2.27 . . . . 0.0 112.296 179.118 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 98' ' ' GLN . . . . . 0.595 ' NE2' ' OD1' ' A' ' 96' ' ' ASN . 0.1 OUTLIER . . . . . 0 C--N 1.323 -0.544 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.704 -179.908 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 87.1 m . . . . . 0 N--CA 1.458 -0.057 0 CA-C-O 120.798 0.333 . . . . 0.0 110.135 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 90.3 mt-10 49.85 -161.01 0.06 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.17 -179.845 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 108' ' ' GLU . . . . . 0.555 ' OE1' ' N ' ' A' ' 108' ' ' GLU . 56.3 mp0 -112.21 118.82 36.38 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 179.613 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 41.5 pt -48.82 -14.13 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.339 -179.853 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.47 ' N ' ' C ' ' A' ' 108' ' ' GLU . 30.9 mt -64.91 -41.23 95.75 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.395 179.467 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -68.36 -35.82 78.29 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.399 179.818 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 44.7 t -60.81 -47.63 85.49 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.668 -179.508 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 92.3 m-20 -65.57 -45.0 84.99 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.548 179.769 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 40.3 t -158.2 139.02 12.99 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.344 179.809 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 87.9 mt-30 -85.42 -4.63 59.22 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.384 179.843 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 15.0 m -62.5 -46.68 87.34 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.706 -179.631 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 . . . . . 0 C--N 1.329 -0.326 0 CA-C-O 120.962 0.41 . . . . 0.0 110.47 179.977 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.725 0 N-CA-C 111.096 -0.802 . . . . 0.0 111.096 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 99.4 mm-40 -62.86 -30.18 71.31 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.899 0.381 . . . . 0.0 110.483 -179.871 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 4' ' ' GLU . . . . . 0.427 ' O ' ' N ' ' A' ' 7' ' ' GLN . 80.0 mm-40 -56.01 -22.15 25.38 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.542 179.593 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 36.6 tp -41.38 -28.94 0.13 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.031 0.443 . . . . 0.0 110.266 -179.403 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 54.1 m -58.25 -41.27 83.86 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.963 0.411 . . . . 0.0 110.173 179.675 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' GLN . . . . . 0.427 ' N ' ' O ' ' A' ' 4' ' ' GLU . 88.1 mt-30 -64.26 -31.83 73.18 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.835 179.97 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 86.4 t60 -60.18 -45.67 92.31 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-O 120.913 0.387 . . . . 0.0 110.285 179.95 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 99.3 mt-10 -60.48 -43.96 96.42 Favored 'General case' 0 C--O 1.244 0.772 0 CA-C-O 121.243 0.544 . . . . 0.0 110.126 179.769 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.436 ' O ' ' CB ' ' A' ' 14' ' ' GLN . 92.2 mtt-85 -63.18 -34.09 76.88 Favored 'General case' 0 C--O 1.211 -0.969 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 179.578 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.495 ' CE1' HD23 ' A' ' 15' ' ' LEU . 37.4 t80 -59.11 -38.68 80.15 Favored 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 120.765 -0.374 . . . . 0.0 110.369 -179.636 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 2.2 t -60.55 -51.81 68.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 C-N-CA 119.624 -0.83 . . . . 0.0 110.983 -179.675 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 82.8 tt0 -79.56 -38.31 34.43 Favored 'General case' 0 C--N 1.322 -0.609 0 C-N-CA 120.14 -0.624 . . . . 0.0 112.053 -178.968 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' GLN . . . . . 0.436 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 69.0 tp60 -64.32 -50.5 67.57 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.847 -179.0 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.568 HD13 ' O ' ' A' ' 15' ' ' LEU . 0.2 OUTLIER -62.98 -46.39 87.94 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.487 -0.485 . . . . 0.0 110.073 -179.648 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 61.0 mttp -58.14 -31.6 67.36 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 120.746 -0.381 . . . . 0.0 110.203 179.482 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 75.5 mt-30 -75.73 -35.19 60.3 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.723 178.889 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -57.14 -35.99 70.16 Favored 'General case' 0 CA--C 1.519 -0.224 0 CA-C-N 115.727 -0.67 . . . . 0.0 110.01 -179.992 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.436 ' O ' ' N ' ' A' ' 22' ' ' ARG . 3.0 mt -84.97 -32.92 22.76 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.131 0.491 . . . . 0.0 110.587 179.172 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -46.02 -42.04 12.76 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.472 -179.121 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' THR . . . . . 0.499 ' C ' ' H ' ' A' ' 23' ' ' GLY . 0.1 OUTLIER -74.74 -23.5 58.57 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.693 -179.972 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.436 ' N ' ' O ' ' A' ' 19' ' ' LEU . 27.0 mmt180 -73.44 19.91 0.1 Allowed 'General case' 0 N--CA 1.463 0.224 0 CA-C-O 120.78 0.324 . . . . 0.0 110.4 179.987 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 23' ' ' GLY . . . . . 0.499 ' H ' ' C ' ' A' ' 21' ' ' THR . . . 87.75 16.84 59.25 Favored Glycine 0 CA--C 1.524 0.633 0 N-CA-C 110.941 -0.863 . . . . 0.0 110.941 -179.976 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.597 HG12 ' N ' ' A' ' 25' ' ' LYS . 21.7 t -106.4 167.97 3.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 120.635 0.255 . . . . 0.0 110.533 -179.873 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.597 ' N ' HG12 ' A' ' 24' ' ' VAL . 88.3 tttt -135.37 128.84 32.4 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 109.881 -0.414 . . . . 0.0 109.881 179.345 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.504 HG23 ' O ' ' A' ' 26' ' ' VAL . 26.5 m -125.48 118.46 52.49 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.16 0 N-CA-C 109.993 -0.373 . . . . 0.0 109.993 -179.925 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.513 ' HD3' ' H ' ' A' ' 29' ' ' ALA . 13.7 tmtt? -110.03 160.07 16.75 Favored 'General case' 0 C--O 1.222 -0.392 0 N-CA-C 109.716 -0.476 . . . . 0.0 109.716 179.614 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 88.7 m-85 -41.94 -28.99 0.19 Allowed 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.028 0.442 . . . . 0.0 110.968 179.841 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.513 ' H ' ' HD3' ' A' ' 27' ' ' LYS . . . -60.27 -24.62 65.07 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.828 -179.849 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.455 ' O ' ' CB ' ' A' ' 34' ' ' PHE . 13.0 m-20 -62.48 -44.73 95.68 Favored 'General case' 0 C--O 1.216 -0.658 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.564 -179.673 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.494 ' H ' HD12 ' A' ' 31' ' ' LEU . 5.7 mp -65.48 -40.89 93.66 Favored 'General case' 0 C--N 1.322 -0.619 0 C-N-CA 120.576 -0.449 . . . . 0.0 110.101 179.449 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 32.1 mt -59.84 -45.23 93.08 Favored 'General case' 0 C--N 1.317 -0.833 0 C-N-CA 119.433 -0.907 . . . . 0.0 111.122 -178.698 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.424 ' O ' ' CB ' ' A' ' 37' ' ' PHE . 48.7 tttp -85.57 -47.37 9.93 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 112.084 0.402 . . . . 0.0 112.084 -179.016 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 34' ' ' PHE . . . . . 0.844 ' O ' HG22 ' A' ' 38' ' ' VAL . 54.4 t80 -63.42 -50.41 69.91 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.976 -178.833 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.475 ' CB ' ' O ' ' A' ' 31' ' ' LEU . 9.3 t80 -62.69 -45.1 94.34 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.298 -179.673 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 56.7 t0 -73.1 -37.17 66.82 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 120.558 -0.457 . . . . 0.0 111.332 -179.508 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.562 ' CZ ' HG22 ' A' ' 59' ' ' VAL . 5.6 t80 -61.43 -47.87 83.79 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.332 -178.376 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.844 HG22 ' O ' ' A' ' 34' ' ' PHE . 19.6 m -72.26 -35.89 54.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 115.626 -0.716 . . . . 0.0 110.341 -179.869 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 65.1 tttm -58.57 -28.98 66.04 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.475 179.78 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 62.9 t0 -45.05 -59.65 2.49 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 120.58 -0.448 . . . . 0.0 110.606 -179.857 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 11.4 p -113.86 -5.28 13.24 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.744 0.307 . . . . 0.0 110.885 179.945 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' CYS . . . . . 0.548 ' N ' ' HD3' ' A' ' 43' ' ' PRO . 0.0 OUTLIER 48.65 54.36 15.91 Favored Pre-proline 0 CA--C 1.538 0.493 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.572 -178.738 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 43' ' ' PRO . . . . . 0.548 ' HD3' ' N ' ' A' ' 42' ' ' CYS . 27.0 Cg_exo -62.16 -38.97 51.95 Favored 'Trans proline' 0 N--CA 1.496 1.649 0 C-N-CA 122.051 1.834 . . . . 0.0 113.034 -179.075 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 44' ' ' TRP . . . . . 0.873 ' HE1' ' H ' ' A' ' 52' ' ' ASP . 0.0 OUTLIER -71.7 0.75 8.06 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.025 -178.911 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.566 ' O ' ' N ' ' A' ' 47' ' ' GLN . 33.9 m-85 53.37 48.51 5.13 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.664 -179.086 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.535 ' CD ' ' N ' ' A' ' 45' ' ' PHE . 44.7 Cg_exo -39.02 -17.83 0.04 OUTLIER 'Trans proline' 0 C--N 1.312 -1.394 0 C-N-CA 122.845 2.363 . . . . 0.0 112.348 179.11 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.566 ' N ' ' O ' ' A' ' 45' ' ' PHE . 83.6 mt-30 -58.25 -52.84 63.88 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.428 -179.642 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 47.1 tp10 -88.3 -34.22 17.74 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.821 -0.352 . . . . 0.0 110.236 178.975 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 87.29 71.7 1.29 Allowed Glycine 0 CA--C 1.526 0.723 0 N-CA-C 110.171 -1.172 . . . . 0.0 110.171 -178.514 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 12.4 t -129.76 171.78 12.32 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 110.4 -0.222 . . . . 0.0 110.4 -179.377 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.1 mt -102.19 142.59 16.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 120.982 0.42 . . . . 0.0 110.491 179.29 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' ASP . . . . . 0.873 ' H ' ' HE1' ' A' ' 44' ' ' TRP . 73.6 m-20 -122.41 121.66 37.17 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.46 -0.791 . . . . 0.0 111.465 179.343 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.484 ' CG1' HD12 ' A' ' 90' ' ' ILE . 23.5 mm -95.58 -56.19 5.43 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.352 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.24 178.964 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -74.15 -50.65 18.41 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-O 120.94 0.4 . . . . 0.0 111.438 -179.531 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 91.4 mtt-85 -61.04 -35.62 77.4 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.533 -179.891 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 56' ' ' TRP . . . . . 0.637 ' CE3' ' CH2' ' A' ' 44' ' ' TRP . 24.8 t-105 -59.38 -36.25 75.42 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.191 0.52 . . . . 0.0 110.452 179.102 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 61.4 ttp180 -66.41 -37.95 86.37 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.162 179.852 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 87.5 mtt180 -60.48 -51.85 67.7 Favored 'General case' 0 N--CA 1.466 0.375 0 C-N-CA 120.956 -0.298 . . . . 0.0 111.75 -178.866 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.562 HG22 ' CZ ' ' A' ' 37' ' ' PHE . 2.9 p -62.46 -42.49 95.9 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.459 0 CA-C-O 120.95 0.405 . . . . 0.0 110.153 -179.952 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -68.95 -39.4 85.15 Favored Glycine 0 CA--C 1.527 0.836 0 N-CA-C 111.452 -0.659 . . . . 0.0 111.452 179.865 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 12.7 m-20 -64.97 -42.1 94.85 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.734 0.302 . . . . 0.0 111.075 -179.191 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 5.4 m -60.04 -53.29 59.56 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.619 -179.263 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 13.8 m-85 -67.61 -37.18 82.15 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.785 179.586 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 53.3 tt0 -62.45 -41.09 98.5 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.717 -179.715 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.462 ' O ' HG23 ' A' ' 69' ' ' THR . 46.2 t0 -60.74 -52.51 64.79 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.756 -179.9 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 66' ' ' TYR . . . . . 0.478 ' O ' ' OG1' ' A' ' 69' ' ' THR . 25.5 m-85 -66.17 -30.58 71.08 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.362 179.482 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 76.8 t80 -68.04 -41.77 81.57 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.541 -179.859 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' ASN . . . . . 0.427 ' O ' ' N ' ' A' ' 71' ' ' GLY . 99.0 m-20 -63.56 -40.24 96.48 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.129 -179.44 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.478 ' OG1' ' O ' ' A' ' 66' ' ' TYR . 74.5 p -49.8 -17.76 0.4 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.515 -179.73 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 70' ' ' PHE . . . . . 0.401 ' N ' ' C ' ' A' ' 68' ' ' ASN . 59.5 m-85 -93.31 15.72 14.94 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.82 -179.953 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 71' ' ' GLY . . . . . 0.427 ' N ' ' O ' ' A' ' 68' ' ' ASN . . . 40.58 58.02 2.64 Favored Glycine 0 CA--C 1.53 0.999 0 N-CA-C 110.905 -0.878 . . . . 0.0 110.905 -179.295 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 72' ' ' PRO . . . . . 0.409 ' HD3' ' N ' ' A' ' 71' ' ' GLY . 56.5 Cg_endo -76.48 132.54 13.6 Favored 'Trans proline' 0 N--CA 1.495 1.606 0 C-N-CA 122.89 2.393 . . . . 0.0 112.13 179.715 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 83.5 tt0 -90.88 -19.94 22.8 Favored 'General case' 0 CA--C 1.507 -0.701 0 CA-C-O 121.408 0.623 . . . . 0.0 110.673 179.813 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.505 ' O ' ' C ' ' A' ' 75' ' ' VAL . 53.9 mmtt -73.01 -47.21 47.14 Favored 'General case' 0 C--N 1.31 -1.134 0 CA-C-N 115.237 -0.892 . . . . 0.0 112.056 -178.134 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.582 ' O ' HG12 ' A' ' 75' ' ' VAL . 53.5 t 25.48 80.56 0.21 Allowed Pre-proline 0 CA--C 1.528 0.099 0 O-C-N 123.765 0.665 . . . . 0.0 111.476 179.874 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_exo -55.76 125.37 18.89 Favored 'Trans proline' 0 C--N 1.307 -1.654 0 C-N-CA 121.663 1.575 . . . . 0.0 111.703 -178.842 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 96.6 t -83.88 -21.09 8.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.788 179.811 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 40.2 p -43.41 -27.57 0.28 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.732 -179.079 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -51.95 -43.28 63.44 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.041 179.777 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 80' ' ' PHE . . . . . 0.678 ' CE2' ' ND2' ' A' ' 84' ' ' ASN . 60.2 t80 -63.05 -42.39 99.71 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.839 179.388 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 39.3 m -58.22 -44.63 88.28 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.477 -0.329 . . . . 0.0 110.871 -179.103 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 14.4 m-85 -60.67 -48.5 81.5 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 120.79 -0.364 . . . . 0.0 110.702 179.751 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 83' ' ' TRP . . . . . 0.407 ' O ' ' CB ' ' A' ' 87' ' ' LYS . 68.5 t90 -56.09 -39.81 72.68 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.647 179.936 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 84' ' ' ASN . . . . . 0.678 ' ND2' ' CE2' ' A' ' 80' ' ' PHE . 49.5 m-20 -61.96 -45.2 94.69 Favored 'General case' 0 C--N 1.326 -0.429 0 C-N-CA 120.658 -0.417 . . . . 0.0 110.966 -179.496 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 50.8 tp -72.47 -56.88 4.7 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 120.466 -0.494 . . . . 0.0 110.449 179.717 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -54.11 -27.25 16.2 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 C-N-CA 120.671 -0.412 . . . . 0.0 110.123 -179.834 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.407 ' CB ' ' O ' ' A' ' 83' ' ' TRP . 65.0 tttt -65.61 -50.89 63.4 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.218 -179.734 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 88' ' ' GLU . . . . . 0.466 ' OE1' ' O ' ' A' ' 88' ' ' GLU . 1.0 OUTLIER -79.66 -19.94 47.88 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.72 -179.371 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.514 ' O ' HD13 ' A' ' 89' ' ' LEU . 0.2 OUTLIER -61.51 -46.42 90.04 Favored 'General case' 0 N--CA 1.444 -0.736 0 C-N-CA 120.128 -0.629 . . . . 0.0 110.043 -179.148 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.484 HD12 ' CG1' ' A' ' 53' ' ' ILE . 3.5 mt -64.05 -42.62 96.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 C-N-CA 120.229 -0.588 . . . . 0.0 109.867 -179.908 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 71.3 m-20 -53.24 -44.81 68.41 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.676 -178.028 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 92' ' ' LYS . . . . . 0.492 ' C ' ' H ' ' A' ' 94' ' ' GLU . 97.5 mttt -71.39 142.76 50.32 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.797 0.332 . . . . 0.0 110.762 179.354 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -71.99 14.95 0.18 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.507 179.841 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 94' ' ' GLU . . . . . 0.492 ' H ' ' C ' ' A' ' 92' ' ' LYS . 40.4 tp10 -61.99 -35.21 77.85 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.296 -179.895 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 34.9 m -70.89 137.58 23.54 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.45 179.924 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 96' ' ' ASN . . . . . 0.525 ' O ' ' N ' ' A' ' 98' ' ' GLN . 0.9 OUTLIER -82.76 166.2 37.33 Favored Pre-proline 0 C--N 1.325 -0.471 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.743 -179.813 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 67.7 Cg_exo -44.94 -11.36 0.04 OUTLIER 'Trans proline' 0 N--CA 1.492 1.384 0 C-N-CA 122.434 2.089 . . . . 0.0 112.111 178.963 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 98' ' ' GLN . . . . . 0.525 ' N ' ' O ' ' A' ' 96' ' ' ASN . 6.1 pt20 . . . . . 0 C--N 1.324 -0.516 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.717 -179.597 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 87.9 m . . . . . 0 N--CA 1.461 0.101 0 CA-C-O 120.778 0.323 . . . . 0.0 110.399 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 107' ' ' GLU . . . . . 0.554 ' CD ' ' H ' ' A' ' 107' ' ' GLU . 30.3 mp0 -68.33 161.58 27.09 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.53 -179.406 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 108' ' ' GLU . . . . . 0.557 ' C ' ' H ' ' A' ' 110' ' ' LEU . 94.7 mt-10 -92.25 140.37 29.68 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.201 -0.454 . . . . 0.0 109.923 179.705 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 33.0 pt -60.74 3.75 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.379 179.848 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.557 ' H ' ' C ' ' A' ' 108' ' ' GLU . 85.3 mt -109.54 32.33 5.1 Favored 'General case' 0 N--CA 1.461 0.082 0 CA-C-O 121.023 0.439 . . . . 0.0 110.37 -179.899 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 111' ' ' LYS . . . . . 0.43 ' CG ' HE22 ' A' ' 115' ' ' GLN . 43.3 pttt -82.2 -115.41 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.484 179.962 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 112' ' ' SER . . . . . 0.499 ' OG ' ' N ' ' A' ' 113' ' ' ASN . 29.1 p -129.59 -132.88 0.21 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.259 179.584 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 113' ' ' ASN . . . . . 0.499 ' N ' ' OG ' ' A' ' 112' ' ' SER . 99.2 m-20 56.41 34.59 24.49 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.597 -179.802 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER 76.26 94.12 0.07 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.141 0.496 . . . . 0.0 110.623 179.962 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 115' ' ' GLN . . . . . 0.43 HE22 ' CG ' ' A' ' 111' ' ' LYS . 82.7 mt-30 -144.12 164.52 30.42 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.819 -179.967 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 8.2 m -60.8 -45.34 94.77 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.916 -0.583 . . . . 0.0 110.463 -179.494 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 117' ' ' ASP . . . . . 0.484 ' OD2' HD22 ' A' ' 110' ' ' LEU . 93.0 m-20 . . . . . 0 C--N 1.33 -0.27 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.542 179.91 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.732 0 N-CA-C 110.991 -0.844 . . . . 0.0 110.991 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 85.7 mt-30 -60.81 -27.06 67.76 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.859 0.361 . . . . 0.0 110.571 -179.937 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -60.6 -23.6 64.83 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.611 179.823 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 37.6 tp -43.53 -32.74 0.97 Allowed 'General case' 0 C--O 1.234 0.271 0 CA-C-O 121.115 0.483 . . . . 0.0 110.362 -179.458 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 78.0 p -57.98 -37.76 74.84 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 120.662 -0.415 . . . . 0.0 110.111 179.952 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 68.5 tp60 -65.43 -32.19 73.69 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.406 179.605 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 75.3 t60 -59.73 -45.35 92.44 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.809 0.338 . . . . 0.0 110.292 -179.941 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -59.79 -46.71 88.36 Favored 'General case' 0 C--O 1.244 0.77 0 CA-C-O 121.177 0.513 . . . . 0.0 110.233 179.713 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.421 ' O ' ' CB ' ' A' ' 14' ' ' GLN . 63.6 mtp85 -64.27 -33.47 75.88 Favored 'General case' 0 C--O 1.209 -1.066 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 179.707 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 29.8 t80 -58.78 -36.74 74.9 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.774 0.321 . . . . 0.0 110.322 -179.547 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 4.2 t -64.15 -50.28 77.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 C-N-CA 120.179 -0.608 . . . . 0.0 111.288 -179.939 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 93.7 mt-10 -80.24 -31.77 38.48 Favored 'General case' 0 C--N 1.325 -0.49 0 C-N-CA 120.485 -0.486 . . . . 0.0 111.767 -179.285 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' GLN . . . . . 0.421 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 65.1 tp60 -72.58 -53.22 12.54 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.025 -178.936 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.595 HD13 ' O ' ' A' ' 15' ' ' LEU . 0.2 OUTLIER -62.33 -45.51 92.88 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.842 -0.429 . . . . 0.0 109.842 -179.673 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.444 ' HB3' HG11 ' A' ' 26' ' ' VAL . 66.0 mttm -56.28 -34.42 66.42 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 120.49 -0.484 . . . . 0.0 109.977 179.489 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 69.7 mm-40 -72.05 -41.42 67.46 Favored 'General case' 0 C--O 1.241 0.608 0 CA-C-O 121.175 0.512 . . . . 0.0 110.521 178.551 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.544 ' O ' HG22 ' A' ' 21' ' ' THR . . . -53.64 -45.88 70.32 Favored 'General case' 0 C--O 1.223 -0.342 0 N-CA-C 109.693 -0.484 . . . . 0.0 109.693 179.902 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.449 ' O ' ' N ' ' A' ' 22' ' ' ARG . 4.5 mt -65.58 -37.11 85.72 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 120.984 0.421 . . . . 0.0 110.421 178.838 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 78.5 tttt -45.4 -37.22 4.85 Favored 'General case' 0 C--N 1.321 -0.646 0 C-N-CA 120.418 -0.513 . . . . 0.0 109.83 -179.798 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' THR . . . . . 0.544 HG22 ' O ' ' A' ' 18' ' ' ALA . 0.9 OUTLIER -63.14 -34.08 76.86 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.11 179.43 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.449 ' N ' ' O ' ' A' ' 19' ' ' LEU . 12.8 mmt180 -70.37 17.59 0.06 Allowed 'General case' 0 C--O 1.233 0.215 0 CA-C-O 120.801 0.334 . . . . 0.0 110.393 -179.721 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 23' ' ' GLY . . . . . 0.529 ' H ' ' C ' ' A' ' 21' ' ' THR . . . 83.13 13.11 77.94 Favored Glycine 0 CA--C 1.523 0.562 0 N-CA-C 110.356 -1.098 . . . . 0.0 110.356 -179.878 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.546 HG12 ' N ' ' A' ' 25' ' ' LYS . 12.7 t -89.2 167.49 1.68 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 N-CA-C 110.333 -0.247 . . . . 0.0 110.333 -179.907 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.546 ' N ' HG12 ' A' ' 24' ' ' VAL . 58.5 mttp -134.87 127.46 30.75 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.223 179.335 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.444 HG11 ' HB3' ' A' ' 16' ' ' LYS . 3.0 m -121.63 126.31 74.58 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.247 0 C-N-CA 121.018 -0.273 . . . . 0.0 110.393 -179.921 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 20.2 ttmt -110.88 159.38 17.75 Favored 'General case' 0 CA--C 1.528 0.114 0 N-CA-C 110.167 -0.308 . . . . 0.0 110.167 179.496 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 76.5 m-85 -49.67 -32.34 13.01 Favored 'General case' 0 C--O 1.237 0.44 0 CA-C-O 121.159 0.504 . . . . 0.0 110.224 179.414 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -55.21 -23.42 22.02 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.151 179.664 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.437 ' O ' ' CB ' ' A' ' 34' ' ' PHE . 87.5 m-20 -61.83 -46.77 88.03 Favored 'General case' 0 C--O 1.216 -0.66 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.758 -179.38 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.509 ' H ' HD12 ' A' ' 31' ' ' LEU . 5.4 mp -65.65 -40.76 92.83 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 121.106 0.479 . . . . 0.0 109.924 179.736 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 35.6 mt -59.2 -45.36 91.29 Favored 'General case' 0 C--N 1.314 -0.962 0 C-N-CA 119.798 -0.761 . . . . 0.0 110.962 -178.473 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.589 ' NZ ' ' CZ ' ' A' ' 37' ' ' PHE . 63.9 tttm -86.05 -50.25 7.18 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 112.064 0.394 . . . . 0.0 112.064 -179.089 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 34' ' ' PHE . . . . . 0.437 ' CB ' ' O ' ' A' ' 30' ' ' ASP . 51.4 t80 -60.21 -50.21 74.57 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.707 -0.678 . . . . 0.0 110.758 -178.591 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.486 ' CB ' ' O ' ' A' ' 31' ' ' LEU . 7.5 t80 -62.29 -46.84 86.96 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.354 -179.659 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 96.7 m-20 -63.03 -36.43 83.55 Favored 'General case' 0 C--N 1.344 0.329 0 CA-C-O 120.908 0.385 . . . . 0.0 111.209 -179.533 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.589 ' CZ ' ' NZ ' ' A' ' 33' ' ' LYS . 1.9 m-85 -57.33 -46.34 83.37 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.825 -179.479 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.561 ' O ' ' N ' ' A' ' 42' ' ' CYS . 23.8 m -81.78 -24.84 9.7 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 C-N-CA 120.299 -0.56 . . . . 0.0 110.395 179.694 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 45.8 tttp -58.03 -31.57 67.12 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 120.78 -0.368 . . . . 0.0 110.4 -179.208 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 65.2 t0 -52.94 -61.14 2.48 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 120.587 -0.445 . . . . 0.0 111.232 -179.548 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.409 ' C ' ' SG ' ' A' ' 42' ' ' CYS . 31.5 p -114.43 -32.03 6.05 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-O 121.141 0.496 . . . . 0.0 111.261 -179.531 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 42' ' ' CYS . . . . . 0.561 ' N ' ' O ' ' A' ' 38' ' ' VAL . 2.4 m 70.57 58.59 0.48 Allowed Pre-proline 0 C--N 1.324 -0.518 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.386 -178.698 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 43' ' ' PRO . . . . . 0.55 ' C ' ' H ' ' A' ' 45' ' ' PHE . 19.9 Cg_exo -68.08 -25.13 38.04 Favored 'Trans proline' 0 N--CA 1.495 1.591 0 C-N-CA 122.443 2.096 . . . . 0.0 112.319 179.885 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -58.1 0.39 0.07 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.059 -179.34 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.55 ' H ' ' C ' ' A' ' 43' ' ' PRO . 0.1 OUTLIER 63.86 82.11 0.22 Allowed Pre-proline 0 C--N 1.328 -0.369 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.25 -179.987 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_endo -71.89 -9.79 25.27 Favored 'Trans proline' 0 N--CA 1.489 1.219 0 C-N-CA 122.041 1.828 . . . . 0.0 112.24 -179.55 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 88.1 mt-30 -81.02 -54.72 5.31 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 120.525 -0.47 . . . . 0.0 110.516 -179.81 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 63.2 tt0 -88.82 -26.72 21.52 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.48 178.984 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 68.56 61.01 5.0 Favored Glycine 0 CA--C 1.52 0.404 0 N-CA-C 110.086 -1.206 . . . . 0.0 110.086 -179.363 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 13.5 t -118.34 154.19 32.76 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.7 0.286 . . . . 0.0 110.995 -179.274 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.4 mt -80.63 137.06 22.07 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-O 121.259 0.552 . . . . 0.0 110.841 179.494 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' ASP . . . . . 0.427 ' OD2' ' O ' ' A' ' 43' ' ' PRO . 79.9 m-20 -108.85 121.48 45.18 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.106 -0.952 . . . . 0.0 111.249 179.504 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.486 ' CG1' HD12 ' A' ' 90' ' ' ILE . 27.6 mm -94.81 -56.02 5.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.111 179.145 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -78.66 -50.09 12.05 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-O 121.032 0.444 . . . . 0.0 111.243 -179.609 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 78.1 mtp180 -58.88 -31.94 69.04 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.016 179.756 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 19.1 t-105 -62.41 -39.18 92.44 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.061 0.458 . . . . 0.0 110.616 178.987 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -62.44 -36.27 81.89 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.135 -179.717 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 95.5 mtt-85 -62.14 -55.32 29.94 Favored 'General case' 0 C--N 1.331 -0.224 0 C-N-CA 120.508 -0.477 . . . . 0.0 111.54 -179.655 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.488 HG13 ' N ' ' A' ' 60' ' ' GLY . 5.0 p -65.6 -43.33 94.06 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.441 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.447 179.803 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 60' ' ' GLY . . . . . 0.488 ' N ' HG13 ' A' ' 59' ' ' VAL . . . -63.67 -41.53 98.99 Favored Glycine 0 C--O 1.22 -0.729 0 N-CA-C 111.33 -0.708 . . . . 0.0 111.33 -179.455 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 76.1 m-20 -61.64 -39.93 93.08 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.82 0.31 . . . . 0.0 110.749 -179.096 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 85.3 m -60.09 -62.98 1.47 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.996 0.427 . . . . 0.0 111.002 -179.694 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 70.7 m-85 -63.35 -42.2 98.9 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.864 -179.917 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 64' ' ' GLN . . . . . 0.487 ' HG2' HD21 ' A' ' 68' ' ' ASN . 56.5 tt0 -57.31 -40.49 78.0 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.814 0.34 . . . . 0.0 110.776 -179.736 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -58.87 -53.75 54.87 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.986 -179.79 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 71.1 m-85 -67.47 -36.49 81.25 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.681 179.851 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 67.7 t80 -60.69 -43.62 97.52 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.61 -179.469 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' ASN . . . . . 0.487 HD21 ' HG2' ' A' ' 64' ' ' GLN . 32.8 m-20 -63.79 -41.8 97.85 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.792 -179.203 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 40.5 p -71.64 -17.59 62.25 Favored 'General case' 0 CA--C 1.514 -0.441 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.227 -179.996 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -69.11 -18.59 63.99 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.955 179.881 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 165.24 -62.73 0.23 Allowed Glycine 0 CA--C 1.53 1.019 0 C-N-CA 120.887 -0.673 . . . . 0.0 111.453 -179.237 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -41.39 100.8 0.03 OUTLIER 'Trans proline' 0 C--N 1.313 -1.311 0 C-N-CA 122.691 2.261 . . . . 0.0 112.363 -179.616 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -73.81 -41.69 61.99 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.523 179.282 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.652 ' CD ' ' H ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -95.11 -13.9 24.69 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.243 -179.878 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.447 ' O ' ' O ' ' A' ' 74' ' ' LYS . 28.9 t 58.27 130.14 0.02 OUTLIER Pre-proline 0 CA--C 1.538 0.504 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.192 -178.985 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 48.6 Cg_exo -52.51 126.47 20.92 Favored 'Trans proline' 0 N--CA 1.496 1.636 0 C-N-CA 121.405 1.403 . . . . 0.0 112.283 179.102 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.46 ' O ' ' N ' ' A' ' 80' ' ' PHE . 56.6 t -83.9 -22.57 8.17 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.333 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.848 179.254 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 28.4 p -42.08 -24.65 0.05 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.371 -179.378 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 79' ' ' ALA . . . . . 0.446 ' N ' ' O ' ' A' ' 77' ' ' VAL . . . -65.76 -38.46 89.14 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.862 179.691 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 80' ' ' PHE . . . . . 0.46 ' N ' ' O ' ' A' ' 77' ' ' VAL . 3.8 m-85 -57.85 -34.8 70.11 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.435 -179.6 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 35.6 t -60.77 -42.88 98.38 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.269 179.947 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 21.8 m-85 -60.38 -50.15 74.74 Favored 'General case' 0 C--O 1.223 -0.32 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.038 179.905 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 83' ' ' TRP . . . . . . . . . . . . . 55.1 t90 -54.43 -39.14 67.08 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.573 -179.555 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 89.6 m-20 -62.31 -47.07 85.89 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 120.649 -0.42 . . . . 0.0 111.02 -179.584 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 41.0 tp -71.79 -54.35 10.45 Favored 'General case' 0 C--O 1.219 -0.545 0 C-N-CA 120.328 -0.549 . . . . 0.0 110.574 179.86 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -56.84 -25.93 23.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.372 179.643 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 63.9 tttt -65.1 -50.62 65.4 Favored 'General case' 0 C--N 1.321 -0.653 0 C-N-CA 120.177 -0.609 . . . . 0.0 110.16 179.892 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 88' ' ' GLU . . . . . 0.437 ' OE1' ' O ' ' A' ' 88' ' ' GLU . 0.9 OUTLIER -80.78 -20.07 43.42 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.008 -179.992 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 14.2 tp -61.03 -44.33 97.57 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.629 -178.95 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.486 HD12 ' CG1' ' A' ' 53' ' ' ILE . 3.3 mt -63.99 -43.58 97.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 C-N-CA 120.12 -0.632 . . . . 0.0 109.711 -179.634 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 91' ' ' ASP . . . . . 0.429 ' O ' ' OD1' ' A' ' 91' ' ' ASP . 64.9 t0 -47.45 -34.98 7.93 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.843 -179.02 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 92' ' ' LYS . . . . . 0.429 ' O ' ' CG2' ' A' ' 95' ' ' VAL . 72.1 tttt -58.84 143.84 46.23 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.924 -179.965 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 64.5 tttm -74.26 -42.56 59.42 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.087 179.846 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 69.1 tt0 -94.24 54.96 1.95 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.02 0.438 . . . . 0.0 110.47 -178.899 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.429 ' CG2' ' O ' ' A' ' 92' ' ' LYS . 5.0 t -61.19 -74.3 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.717 -179.736 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 96' ' ' ASN . . . . . 0.498 ' N ' ' OD1' ' A' ' 96' ' ' ASN . 0.0 OUTLIER -154.04 162.84 25.83 Favored Pre-proline 0 C--N 1.328 -0.352 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.617 179.972 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 14.1 Cg_endo -56.12 -11.01 5.09 Favored 'Trans proline' 0 N--CA 1.496 1.65 0 C-N-CA 122.999 2.466 . . . . 0.0 112.161 179.072 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 98' ' ' GLN . . . . . 0.454 ' OE1' ' OD1' ' A' ' 96' ' ' ASN . 5.5 pt20 . . . . . 0 C--N 1.323 -0.575 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.614 -179.769 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 87.7 m . . . . . 0 N--CA 1.461 0.116 0 CA-C-O 120.739 0.304 . . . . 0.0 110.451 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 93.7 mt-10 -112.54 146.88 37.73 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.432 -179.895 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 108' ' ' GLU . . . . . 0.559 ' C ' ' H ' ' A' ' 110' ' ' LEU . 99.1 mt-10 -64.61 130.6 44.23 Favored 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 120.699 -0.4 . . . . 0.0 110.216 179.572 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 37.9 pt -58.0 -0.31 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.192 179.313 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.559 ' H ' ' C ' ' A' ' 108' ' ' GLU . 97.8 mt -96.23 -2.72 45.57 Favored 'General case' 0 C--O 1.233 0.185 0 C-N-CA 120.723 -0.391 . . . . 0.0 110.518 -179.725 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -111.15 128.89 56.04 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.314 179.916 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 112' ' ' SER . . . . . 0.458 ' OG ' ' N ' ' A' ' 113' ' ' ASN . 86.8 p -136.87 -120.37 0.15 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.883 -0.598 . . . . 0.0 110.33 179.942 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 113' ' ' ASN . . . . . 0.458 ' N ' ' OG ' ' A' ' 112' ' ' SER . 54.1 m-20 -63.13 -40.68 98.28 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.437 -179.889 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 45.0 t -140.53 143.66 35.51 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.466 179.85 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 27.2 mt-30 -70.68 90.52 0.77 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.535 -179.966 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 40.1 p -66.83 -34.77 78.53 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.567 179.995 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 64.9 t0 . . . . . 0 C--N 1.328 -0.327 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.643 -179.877 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 2' ' ' GLY . . . . . 0.425 ' C ' ' N ' ' A' ' 4' ' ' GLU . . . . . . . . 0 CA--C 1.526 0.737 0 N-CA-C 111.009 -0.836 . . . . 0.0 111.009 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 86.9 mt-30 -46.42 -19.78 0.09 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.877 0.37 . . . . 0.0 110.736 -179.965 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 4' ' ' GLU . . . . . 0.425 ' N ' ' C ' ' A' ' 2' ' ' GLY . 82.6 tt0 -54.37 -24.13 18.33 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.471 179.975 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 41.7 tp -42.26 -28.22 0.18 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.386 -179.736 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 59.7 p -59.95 -40.01 87.51 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.665 -179.88 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 90.0 mm-40 -61.72 -36.04 79.81 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.158 179.569 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 84.4 t60 -61.13 -41.25 96.38 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.361 179.657 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 79.1 tt0 -58.38 -47.36 84.1 Favored 'General case' 0 C--O 1.24 0.597 0 CA-C-O 121.327 0.584 . . . . 0.0 110.122 179.878 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.406 ' O ' ' CB ' ' A' ' 14' ' ' GLN . 61.9 mmt-85 -63.54 -34.76 78.51 Favored 'General case' 0 C--O 1.213 -0.854 0 N-CA-C 109.186 -0.672 . . . . 0.0 109.186 179.562 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 35.9 t80 -58.29 -37.43 75.0 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 120.222 -0.591 . . . . 0.0 110.334 -179.642 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 16.9 t -63.33 -48.5 87.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 C-N-CA 120.24 -0.584 . . . . 0.0 111.898 179.885 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -83.39 -26.92 30.0 Favored 'General case' 0 C--N 1.322 -0.617 0 C-N-CA 120.383 -0.527 . . . . 0.0 111.777 -179.125 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' GLN . . . . . 0.406 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 68.2 tp60 -77.82 -51.79 9.93 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.823 -179.181 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.6 HD13 ' O ' ' A' ' 15' ' ' LEU . 0.3 OUTLIER -62.98 -45.98 89.87 Favored 'General case' 0 CA--C 1.535 0.38 0 N-CA-C 109.839 -0.43 . . . . 0.0 109.839 179.886 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.581 ' HB3' HG11 ' A' ' 26' ' ' VAL . 96.8 mttt -58.68 -37.64 76.49 Favored 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 120.464 -0.494 . . . . 0.0 110.265 179.514 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 75.4 mt-30 -70.24 -37.35 74.95 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.619 178.644 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -56.35 -33.07 65.3 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.114 -0.494 . . . . 0.0 109.935 179.842 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.8 mt -85.63 -32.16 22.18 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.043 0.449 . . . . 0.0 110.65 178.969 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 66.0 tttm -48.84 -43.02 38.26 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.497 -178.794 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' THR . . . . . 0.479 ' C ' ' H ' ' A' ' 23' ' ' GLY . 0.1 OUTLIER -70.32 -25.0 63.1 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.611 179.752 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 29.1 mmt180 -74.14 19.04 0.13 Allowed 'General case' 0 N--CA 1.463 0.178 0 CA-C-O 120.812 0.339 . . . . 0.0 110.393 -179.753 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' GLY . . . . . 0.479 ' H ' ' C ' ' A' ' 21' ' ' THR . . . 87.66 17.18 58.81 Favored Glycine 0 N--CA 1.468 0.824 0 N-CA-C 111.138 -0.785 . . . . 0.0 111.138 179.957 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.642 HG12 ' N ' ' A' ' 25' ' ' LYS . 24.7 t -105.61 169.37 2.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 120.57 0.224 . . . . 0.0 110.527 179.953 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.642 ' N ' HG12 ' A' ' 24' ' ' VAL . 67.4 mttm -133.23 136.17 45.44 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.366 179.58 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.581 HG11 ' HB3' ' A' ' 16' ' ' LYS . 19.3 m -132.64 111.45 17.31 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.36 0 C-N-CA 121.148 -0.221 . . . . 0.0 110.666 -179.97 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.4 ' O ' ' N ' ' A' ' 30' ' ' ASP . 23.8 pttt -108.74 166.25 10.94 Favored 'General case' 0 CA--C 1.522 -0.122 0 N-CA-C 110.4 -0.222 . . . . 0.0 110.4 179.601 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 90.1 m-85 -46.92 -36.78 8.01 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-O 121.103 0.478 . . . . 0.0 110.019 179.719 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.44 ' HA ' HD12 ' A' ' 32' ' ' LEU . . . -56.73 -23.76 44.8 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.889 -0.596 . . . . 0.0 109.909 179.159 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.4 ' N ' ' O ' ' A' ' 27' ' ' LYS . 50.4 t0 -61.96 -49.78 74.73 Favored 'General case' 0 C--O 1.223 -0.291 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.974 -179.694 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.511 ' H ' HD12 ' A' ' 31' ' ' LEU . 5.8 mp -63.12 -41.13 99.27 Favored 'General case' 0 C--O 1.218 -0.561 0 CA-C-O 120.867 0.365 . . . . 0.0 110.336 179.965 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.44 HD12 ' HA ' ' A' ' 29' ' ' ALA . 51.2 mt -53.34 -46.07 69.36 Favored 'General case' 0 C--N 1.31 -1.109 0 C-N-CA 119.297 -0.961 . . . . 0.0 111.008 -178.985 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.495 ' O ' ' CD1' ' A' ' 37' ' ' PHE . 87.0 tttt -82.22 -53.16 6.29 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 112.151 0.426 . . . . 0.0 112.151 -179.003 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 34' ' ' PHE . . . . . 0.711 ' O ' HG22 ' A' ' 38' ' ' VAL . 10.2 m-85 -63.09 -50.44 70.53 Favored 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 120.405 -0.518 . . . . 0.0 111.52 -178.866 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.49 ' CB ' ' O ' ' A' ' 31' ' ' LEU . 22.4 t80 -58.21 -47.76 82.46 Favored 'General case' 0 C--N 1.323 -0.56 0 C-N-CA 120.752 -0.379 . . . . 0.0 110.577 -178.584 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 85.2 m-20 -71.33 -21.5 62.04 Favored 'General case' 0 C--N 1.339 0.122 0 C-N-CA 120.11 -0.636 . . . . 0.0 111.052 -179.43 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.635 ' O ' HG23 ' A' ' 41' ' ' THR . 2.7 m-85 -76.36 -63.43 1.33 Allowed 'General case' 0 C--O 1.224 -0.238 0 C-N-CA 120.508 -0.477 . . . . 0.0 111.92 -178.666 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.711 HG22 ' O ' ' A' ' 34' ' ' PHE . 0.3 OUTLIER -63.41 -38.54 82.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-O 120.927 0.394 . . . . 0.0 110.805 -179.24 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 89.0 tttt -63.03 -45.18 93.51 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.36 -179.56 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.428 ' OD1' ' N ' ' A' ' 40' ' ' ASP . 4.4 m-20 -85.06 -33.58 22.44 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 120.951 -0.299 . . . . 0.0 111.46 -179.664 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.635 HG23 ' O ' ' A' ' 37' ' ' PHE . 34.8 p -86.96 -25.83 24.14 Favored 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 120.746 -0.382 . . . . 0.0 111.255 -178.969 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 42' ' ' CYS . . . . . 0.525 ' N ' ' O ' ' A' ' 38' ' ' VAL . 1.7 m 23.15 67.46 0.36 Allowed Pre-proline 0 N--CA 1.466 0.362 0 O-C-N 123.954 0.784 . . . . 0.0 110.539 -178.378 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 16.8 Cg_exo -64.0 -43.38 15.79 Favored 'Trans proline' 0 C--N 1.306 -1.689 0 C-N-CA 121.814 1.676 . . . . 0.0 115.056 -175.914 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' TRP . . . . . 0.555 ' HE1' ' C ' ' A' ' 50' ' ' THR . 5.7 p90 -125.97 17.05 7.93 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.685 0.755 . . . . 0.0 110.128 179.89 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.564 ' N ' ' HD3' ' A' ' 46' ' ' PRO . 4.3 t80 74.96 56.91 0.26 Allowed Pre-proline 0 C--N 1.32 -0.711 0 CA-C-N 114.786 -1.097 . . . . 0.0 111.16 -179.233 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.564 ' HD3' ' N ' ' A' ' 45' ' ' PHE . 11.3 Cg_exo -68.66 -19.83 41.29 Favored 'Trans proline' 0 N--CA 1.495 1.614 0 C-N-CA 123.018 2.479 . . . . 0.0 112.491 179.83 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 58.2 tt0 -54.24 -40.49 67.78 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.903 -179.002 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 31.6 tp10 -68.45 -32.25 72.13 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.825 -0.435 . . . . 0.0 109.825 179.637 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' GLY . . . . . 0.436 ' O ' ' OE1' ' A' ' 98' ' ' GLN . . . 116.62 -17.93 13.45 Favored Glycine 0 CA--C 1.521 0.431 0 N-CA-C 110.448 -1.061 . . . . 0.0 110.448 -179.27 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 50' ' ' THR . . . . . 0.555 ' C ' ' HE1' ' A' ' 44' ' ' TRP . 6.2 t -56.38 159.49 3.6 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 109.284 -0.635 . . . . 0.0 109.284 179.411 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.478 ' HA ' ' NE1' ' A' ' 44' ' ' TRP . 0.7 OUTLIER -128.28 132.29 68.39 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.488 0 CA-C-O 120.743 0.306 . . . . 0.0 110.49 -179.977 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 48.3 t0 -123.18 117.69 25.94 Favored 'General case' 0 C--N 1.312 -1.039 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.9 177.88 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 25.3 mm -72.95 -43.4 59.3 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.882 -179.561 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -62.74 -55.62 24.99 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 121.241 0.543 . . . . 0.0 111.168 -178.374 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 91.2 mtt180 -64.48 -34.92 79.35 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.305 179.201 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' TRP . . . . . 0.43 ' HE1' ' HB2' ' A' ' 83' ' ' TRP . 33.6 t-105 -55.85 -37.29 68.54 Favored 'General case' 0 C--N 1.332 -0.18 0 N-CA-C 109.698 -0.482 . . . . 0.0 109.698 179.394 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.62 ' NH2' ' CH2' ' A' ' 83' ' ' TRP . 63.7 ttm-85 -67.12 -36.97 83.05 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.003 179.126 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 44.3 ttm180 -59.65 -46.22 89.68 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 120.766 -0.373 . . . . 0.0 111.427 -179.509 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 3.1 p -69.08 -36.56 74.08 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 CA-C-O 120.774 0.321 . . . . 0.0 110.436 179.266 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -67.15 -50.53 45.04 Favored Glycine 0 CA--C 1.526 0.754 0 N-CA-C 111.296 -0.722 . . . . 0.0 111.296 179.827 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -63.83 -40.65 97.11 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.624 0.25 . . . . 0.0 111.207 -179.744 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 3.1 m -58.68 -51.56 69.43 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.993 0.425 . . . . 0.0 110.694 -179.464 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' PHE . . . . . 0.494 ' CE2' ' CE2' ' A' ' 37' ' ' PHE . 14.1 m-85 -68.3 -33.79 74.97 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.362 179.386 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 72.2 tp60 -60.1 -45.25 93.58 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.639 -179.755 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 16.3 t0 -60.63 -51.85 67.64 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.025 0.441 . . . . 0.0 110.603 179.971 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 49.3 m-85 -63.71 -33.19 75.08 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.103 179.65 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 76.4 t80 -61.74 -40.43 95.06 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.105 179.703 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 98.5 m-20 -62.64 -38.11 88.97 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.065 -179.705 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 43.5 p -47.23 -32.58 4.64 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 120.458 -0.497 . . . . 0.0 110.472 -179.084 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 60.2 m-85 -67.35 -38.35 84.7 Favored 'General case' 0 C--N 1.32 -0.69 0 C-N-CA 120.211 -0.596 . . . . 0.0 111.209 179.774 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 71' ' ' GLY . . . . . 0.51 ' H ' ' HD3' ' A' ' 72' ' ' PRO . . . 100.68 58.24 0.85 Allowed Glycine 0 CA--C 1.528 0.866 0 N-CA-C 110.715 -0.954 . . . . 0.0 110.715 -179.37 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 72' ' ' PRO . . . . . 0.51 ' HD3' ' H ' ' A' ' 71' ' ' GLY . 66.4 Cg_endo -76.36 116.64 4.38 Favored 'Trans proline' 0 C--N 1.31 -1.454 0 C-N-CA 122.781 2.321 . . . . 0.0 111.59 -179.941 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 79.4 tt0 -85.18 -21.23 29.26 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.248 -179.8 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.743 ' CD ' ' H ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -98.44 -29.14 13.29 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.867 -0.606 . . . . 0.0 112.392 -179.765 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.511 ' O ' HG12 ' A' ' 75' ' ' VAL . 24.4 t 39.3 92.68 0.05 OUTLIER Pre-proline 0 C--N 1.331 -0.231 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.736 -178.827 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -58.07 125.52 18.81 Favored 'Trans proline' 0 C--N 1.316 -1.169 0 C-N-CA 121.113 1.209 . . . . 0.0 111.049 179.792 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.443 ' O ' ' N ' ' A' ' 80' ' ' PHE . 96.0 t -84.23 -16.24 10.82 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.618 179.452 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 36.4 p -40.68 -27.07 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.637 -178.688 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 79' ' ' ALA . . . . . 0.426 ' N ' ' O ' ' A' ' 77' ' ' VAL . . . -59.92 -42.47 94.0 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.031 0.443 . . . . 0.0 110.313 179.648 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 80' ' ' PHE . . . . . 0.579 ' CZ ' ' ND2' ' A' ' 84' ' ' ASN . 55.4 t80 -61.34 -41.54 97.21 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.54 179.682 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 17.9 m -58.05 -43.53 86.91 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.905 -179.215 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 6.4 m-85 -58.65 -53.63 56.16 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.916 0.389 . . . . 0.0 111.298 -179.504 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 83' ' ' TRP . . . . . 0.62 ' CH2' ' NH2' ' A' ' 57' ' ' ARG . 15.2 t90 -59.58 -38.43 81.15 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.103 179.966 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 84' ' ' ASN . . . . . 0.579 ' ND2' ' CZ ' ' A' ' 80' ' ' PHE . 3.7 m-80 -61.55 -44.46 97.0 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 120.67 -0.412 . . . . 0.0 110.796 -179.611 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.406 HD23 HD11 ' A' ' 15' ' ' LEU . 53.9 tp -71.47 -53.72 13.0 Favored 'General case' 0 C--O 1.218 -0.575 0 C-N-CA 120.343 -0.543 . . . . 0.0 110.119 179.511 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -58.9 -24.85 27.67 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 C-N-CA 120.8 -0.36 . . . . 0.0 110.883 179.763 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 70.0 tttt -67.97 -49.68 60.26 Favored 'General case' 0 C--N 1.313 -1.0 0 C-N-CA 120.351 -0.54 . . . . 0.0 110.144 179.647 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.2 pp20? -79.97 -20.57 45.23 Favored 'General case' 0 C--N 1.32 -0.682 0 C-N-CA 120.321 -0.552 . . . . 0.0 110.366 -179.883 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 14.0 tp -62.19 -44.87 95.63 Favored 'General case' 0 N--CA 1.445 -0.705 0 C-N-CA 120.338 -0.545 . . . . 0.0 109.879 179.918 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -64.16 -43.42 97.38 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.228 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.936 179.57 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 99.4 m-20 -43.74 -37.51 2.72 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.025 -178.545 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 92' ' ' LYS . . . . . 0.609 ' HB2' HG22 ' A' ' 95' ' ' VAL . 97.5 mttt -47.36 144.09 3.09 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 120.72 -0.392 . . . . 0.0 110.499 179.629 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 89.0 tttt -71.91 -49.16 40.21 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.874 0.369 . . . . 0.0 111.207 -179.662 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -108.31 54.21 0.67 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.583 -179.286 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.609 HG22 ' HB2' ' A' ' 92' ' ' LYS . 11.5 t -45.21 -73.88 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.242 -179.159 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 96' ' ' ASN . . . . . 0.548 ' ND2' HG12 ' A' ' 95' ' ' VAL . 0.0 OUTLIER -153.42 160.5 30.87 Favored Pre-proline 0 C--N 1.325 -0.496 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.598 -179.965 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -59.31 -13.35 19.79 Favored 'Trans proline' 0 C--N 1.306 -1.659 0 C-N-CA 122.672 2.248 . . . . 0.0 111.87 179.063 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 98' ' ' GLN . . . . . 0.436 ' OE1' ' O ' ' A' ' 49' ' ' GLY . 9.5 pt20 . . . . . 0 C--N 1.324 -0.526 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.89 -179.962 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 65.0 p . . . . . 0 N--CA 1.458 -0.073 0 CA-C-O 120.72 0.295 . . . . 0.0 110.584 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 85.4 mt-10 -137.13 179.4 6.41 Favored 'General case' 0 CA--C 1.52 -0.206 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.29 179.974 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 108' ' ' GLU . . . . . 0.48 ' C ' ' N ' ' A' ' 110' ' ' LEU . 95.4 mt-10 -105.62 128.55 53.7 Favored 'General case' 0 CA--C 1.513 -0.463 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.003 179.198 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 44.8 pt -50.16 -12.18 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-N 115.938 -0.574 . . . . 0.0 109.962 179.805 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.48 ' N ' ' C ' ' A' ' 108' ' ' GLU . 31.2 mt -65.51 -40.45 93.04 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.609 179.606 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 111' ' ' LYS . . . . . 0.417 ' O ' ' O ' ' A' ' 114' ' ' SER . 86.8 tttt -68.09 -19.35 64.84 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.991 179.828 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 6.3 t -57.25 -44.2 83.64 Favored 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 120.615 -0.434 . . . . 0.0 110.611 -179.263 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 60.3 m-20 -64.06 -41.51 97.34 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.88 179.939 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 114' ' ' SER . . . . . 0.417 ' O ' ' O ' ' A' ' 111' ' ' LYS . 29.6 p -157.6 167.46 30.07 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.491 -179.695 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 86.8 mt-30 -40.96 -28.99 0.09 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.846 0.355 . . . . 0.0 110.887 -179.773 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 2.8 t -166.9 176.49 6.98 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.528 -179.759 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 63.4 t0 . . . . . 0 C--N 1.328 -0.329 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.305 -179.912 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 2' ' ' GLY . . . . . 0.406 ' C ' ' N ' ' A' ' 4' ' ' GLU . . . . . . . . 0 CA--C 1.526 0.765 0 N-CA-C 110.992 -0.843 . . . . 0.0 110.992 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 85.0 mt-30 -44.15 -23.29 0.09 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.977 0.417 . . . . 0.0 110.507 -179.853 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 4' ' ' GLU . . . . . 0.465 ' O ' ' N ' ' A' ' 7' ' ' GLN . 95.0 mt-10 -53.05 -20.95 4.0 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.77 179.799 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 27.3 tp -40.85 -35.67 0.54 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.413 -178.716 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 78.1 p -54.61 -40.68 69.13 Favored 'General case' 0 C--N 1.325 -0.481 0 C-N-CA 120.432 -0.507 . . . . 0.0 110.011 179.532 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' GLN . . . . . 0.465 ' N ' ' O ' ' A' ' 4' ' ' GLU . 76.7 mt-30 -64.66 -32.31 73.92 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.612 179.735 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 63.3 t-80 -57.37 -45.32 84.56 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 121.12 0.486 . . . . 0.0 109.851 -179.925 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -61.31 -41.69 97.41 Favored 'General case' 0 C--O 1.24 0.588 0 CA-C-O 121.265 0.555 . . . . 0.0 109.625 179.498 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.463 ' O ' ' N ' ' A' ' 14' ' ' GLN . 93.8 mtt-85 -65.13 -38.8 91.78 Favored 'General case' 0 C--O 1.212 -0.904 0 C-N-CA 119.983 -0.687 . . . . 0.0 109.253 179.632 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -52.59 -40.06 62.25 Favored 'General case' 0 C--N 1.32 -0.692 0 C-N-CA 120.194 -0.603 . . . . 0.0 110.451 -179.848 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 5.6 t -62.32 -53.83 42.3 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 C-N-CA 120.154 -0.618 . . . . 0.0 111.366 -179.808 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 91.4 mt-10 -79.22 -48.13 14.73 Favored 'General case' 0 N--CA 1.466 0.356 0 C-N-CA 120.104 -0.639 . . . . 0.0 111.907 -179.258 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' GLN . . . . . 0.463 ' N ' ' O ' ' A' ' 10' ' ' ARG . 70.5 tp60 -49.34 -55.74 11.86 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.056 -179.461 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.57 HD13 ' O ' ' A' ' 15' ' ' LEU . 0.2 OUTLIER -62.02 -47.66 83.75 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.85 -0.426 . . . . 0.0 109.85 -179.629 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 92.4 mttt -55.46 -32.06 62.47 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 120.728 -0.389 . . . . 0.0 110.206 179.217 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 83.8 mt-30 -77.98 -36.58 48.78 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.512 178.967 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -56.7 -32.08 65.11 Favored 'General case' 0 C--O 1.226 -0.165 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.019 -179.907 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.463 ' O ' ' N ' ' A' ' 22' ' ' ARG . 3.5 mt -85.49 -37.42 19.72 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.248 0.547 . . . . 0.0 109.939 178.826 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 64.6 tttm -42.88 -45.62 5.01 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.447 -178.944 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' THR . . . . . 0.553 ' C ' ' H ' ' A' ' 23' ' ' GLY . 0.5 OUTLIER -68.39 -30.67 69.64 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.708 179.895 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.463 ' N ' ' O ' ' A' ' 19' ' ' LEU . 86.8 mmt-85 -69.81 24.06 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.634 -179.778 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 23' ' ' GLY . . . . . 0.553 ' H ' ' C ' ' A' ' 21' ' ' THR . . . 82.4 17.09 69.68 Favored Glycine 0 N--CA 1.468 0.83 0 N-CA-C 110.994 -0.842 . . . . 0.0 110.994 179.606 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.647 HG12 ' N ' ' A' ' 25' ' ' LYS . 26.2 t -105.5 169.03 2.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-O 120.742 0.306 . . . . 0.0 110.599 -179.93 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.647 ' N ' HG12 ' A' ' 24' ' ' VAL . 98.7 mttt -137.98 133.56 33.8 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.162 179.167 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 3.7 m -124.19 129.6 74.02 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.349 0 CA-C-O 120.558 0.218 . . . . 0.0 110.666 -179.977 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.444 ' HG2' ' H ' ' A' ' 28' ' ' TYR . 19.0 ttmt -111.35 162.12 15.36 Favored 'General case' 0 CA--C 1.529 0.136 0 N-CA-C 110.253 -0.277 . . . . 0.0 110.253 179.628 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.444 ' H ' ' HG2' ' A' ' 27' ' ' LYS . 97.7 m-85 -51.22 -30.44 17.36 Favored 'General case' 0 C--O 1.238 0.482 0 CA-C-O 121.257 0.551 . . . . 0.0 110.017 179.228 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.4 ' HA ' HD12 ' A' ' 32' ' ' LEU . . . -57.24 -23.25 46.79 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.21 179.434 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.415 ' O ' ' CB ' ' A' ' 34' ' ' PHE . 87.8 m-20 -61.0 -47.43 86.47 Favored 'General case' 0 C--O 1.22 -0.496 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.47 -179.44 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.516 ' H ' HD12 ' A' ' 31' ' ' LEU . 5.6 mp -65.68 -40.35 92.28 Favored 'General case' 0 C--O 1.216 -0.681 0 C-N-CA 120.769 -0.372 . . . . 0.0 110.277 179.373 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.4 HD12 ' HA ' ' A' ' 29' ' ' ALA . 41.5 mt -58.21 -45.39 87.74 Favored 'General case' 0 C--N 1.313 -0.99 0 C-N-CA 119.429 -0.908 . . . . 0.0 111.164 -178.381 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.589 ' NZ ' ' CZ ' ' A' ' 37' ' ' PHE . 64.8 tttm -86.0 -48.49 8.62 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 121.072 0.463 . . . . 0.0 111.802 -179.222 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 34' ' ' PHE . . . . . 0.415 ' CB ' ' O ' ' A' ' 30' ' ' ASP . 60.2 t80 -61.1 -49.01 79.03 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.844 -179.0 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.486 ' CB ' ' O ' ' A' ' 31' ' ' LEU . 13.8 t80 -63.17 -46.62 86.27 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.576 -179.639 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 99.1 m-20 -64.48 -34.39 78.09 Favored 'General case' 0 C--N 1.341 0.227 0 CA-C-O 120.862 0.363 . . . . 0.0 110.965 -179.668 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.589 ' CZ ' ' NZ ' ' A' ' 33' ' ' LYS . 1.6 m-85 -59.35 -48.02 83.23 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.114 -179.597 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.575 ' O ' ' N ' ' A' ' 42' ' ' CYS . 14.8 m -74.81 -36.35 39.39 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.68 179.878 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -55.54 -27.7 50.5 Favored 'General case' 0 C--N 1.322 -0.606 0 C-N-CA 120.733 -0.387 . . . . 0.0 110.15 -179.792 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 85.0 m-20 -54.1 -62.27 1.76 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.797 -179.719 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.44 ' C ' ' SG ' ' A' ' 42' ' ' CYS . 7.8 p -114.33 -27.37 7.62 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 120.864 0.364 . . . . 0.0 111.392 -179.801 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 42' ' ' CYS . . . . . 0.575 ' N ' ' O ' ' A' ' 38' ' ' VAL . 2.3 m 71.46 55.57 0.4 Allowed Pre-proline 0 C--N 1.326 -0.436 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.468 -179.151 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 43' ' ' PRO . . . . . 0.512 ' C ' ' H ' ' A' ' 45' ' ' PHE . 73.0 Cg_endo -77.18 -37.32 1.08 Allowed 'Trans proline' 0 N--CA 1.494 1.512 0 C-N-CA 122.753 2.302 . . . . 0.0 113.054 -179.536 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 44' ' ' TRP . . . . . 0.652 ' HE1' ' H ' ' A' ' 52' ' ' ASP . 0.0 OUTLIER -62.83 4.68 0.16 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.787 -179.974 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.539 ' N ' ' HD3' ' A' ' 46' ' ' PRO . 0.2 OUTLIER 55.17 53.54 9.19 Favored Pre-proline 0 CA--C 1.539 0.533 0 CA-C-O 121.49 0.662 . . . . 0.0 110.233 -178.85 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.539 ' HD3' ' N ' ' A' ' 45' ' ' PHE . 48.0 Cg_exo -52.46 -28.93 37.73 Favored 'Trans proline' 0 N--CA 1.493 1.453 0 C-N-CA 122.09 1.86 . . . . 0.0 111.84 179.327 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -70.45 -42.87 70.91 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.132 -179.44 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 14.1 tt0 -84.71 -15.22 45.97 Favored 'General case' 0 N--CA 1.465 0.305 0 C-N-CA 120.687 -0.405 . . . . 0.0 109.978 -179.69 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 63.26 56.86 17.74 Favored Glycine 0 C--O 1.229 -0.181 0 N-CA-C 110.142 -1.183 . . . . 0.0 110.142 -179.947 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' THR . . . . . 0.537 HG22 ' HB3' ' A' ' 45' ' ' PHE . 6.5 t -121.11 165.88 14.72 Favored 'General case' 0 C--N 1.327 -0.397 0 O-C-N 123.586 0.227 . . . . 0.0 110.785 -179.295 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.817 HG13 HE22 ' A' ' 98' ' ' GLN . 1.1 mt -101.24 137.95 27.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 N-CA-C 109.688 -0.486 . . . . 0.0 109.688 179.522 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 52' ' ' ASP . . . . . 0.652 ' H ' ' HE1' ' A' ' 44' ' ' TRP . 20.0 m-20 -115.05 120.43 39.83 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.279 179.836 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.476 ' CG1' HD12 ' A' ' 90' ' ' ILE . 23.2 mm -94.69 -56.39 5.25 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.904 179.147 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 99.8 mttt -78.44 -48.33 15.66 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.226 -179.733 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 83.0 mtp180 -60.19 -32.92 71.54 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.091 -179.844 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' TRP . . . . . 0.525 ' CE3' ' CZ3' ' A' ' 44' ' ' TRP . 17.2 t-105 -62.16 -39.24 91.98 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-O 120.998 0.428 . . . . 0.0 110.536 179.437 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 63.5 ttm-85 -62.43 -38.11 88.47 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.325 179.849 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 61.6 ttt85 -59.69 -56.65 19.14 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 120.63 -0.428 . . . . 0.0 110.909 -179.36 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.478 HG13 ' N ' ' A' ' 60' ' ' GLY . 6.6 p -66.7 -42.79 90.09 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.552 0 CA-C-O 120.803 0.335 . . . . 0.0 111.049 -179.865 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 60' ' ' GLY . . . . . 0.478 ' N ' HG13 ' A' ' 59' ' ' VAL . . . -63.34 -46.74 92.11 Favored Glycine 0 C--O 1.222 -0.636 0 N-CA-C 111.681 -0.568 . . . . 0.0 111.681 -179.259 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 66.7 t0 -61.0 -36.89 80.66 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.574 0.226 . . . . 0.0 110.948 -179.444 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 71.3 m -61.03 -64.83 0.82 Allowed 'General case' 0 C--N 1.325 -0.468 0 C-N-CA 120.712 -0.395 . . . . 0.0 111.304 -179.674 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 73.3 m-85 -64.77 -43.58 92.79 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.334 -0.393 . . . . 0.0 111.441 -179.666 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 64' ' ' GLN . . . . . 0.427 ' CB ' ' O ' ' A' ' 60' ' ' GLY . 53.0 tt0 -59.45 -40.7 87.7 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.768 -179.394 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.482 ' O ' HG23 ' A' ' 69' ' ' THR . 18.9 t0 -58.09 -55.4 35.47 Favored 'General case' 0 C--N 1.323 -0.548 0 C-N-CA 120.65 -0.42 . . . . 0.0 110.853 -179.885 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 61.9 m-85 -66.27 -38.89 88.85 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 120.617 -0.433 . . . . 0.0 110.868 179.89 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 67' ' ' TYR . . . . . 0.442 ' O ' ' N ' ' A' ' 71' ' ' GLY . 59.9 t80 -58.99 -42.34 89.8 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.533 -179.496 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 68' ' ' ASN . . . . . 0.411 HD21 ' HG2' ' A' ' 64' ' ' GLN . 23.5 m-20 -62.99 -42.74 99.93 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.225 -179.015 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.482 HG23 ' O ' ' A' ' 65' ' ' ASP . 10.1 p -77.33 -18.92 57.06 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 120.609 -0.436 . . . . 0.0 109.958 -179.575 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 40.5 m-85 -113.41 16.47 18.89 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.797 179.715 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 71' ' ' GLY . . . . . 0.442 ' N ' ' O ' ' A' ' 67' ' ' TYR . . . -154.16 -109.76 0.36 Allowed Glycine 0 CA--C 1.535 1.329 0 C-N-CA 120.594 -0.813 . . . . 0.0 111.133 -179.875 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -74.34 144.82 33.34 Favored 'Trans proline' 0 N--CA 1.492 1.386 0 C-N-CA 121.906 1.738 . . . . 0.0 113.296 -179.432 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 84.7 tt0 -85.43 -43.92 13.2 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.718 -0.673 . . . . 0.0 110.659 179.773 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.655 ' CD ' ' H ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -87.21 -18.13 31.03 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.984 -179.83 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.411 ' H ' ' HD3' ' A' ' 74' ' ' LYS . 99.6 t 57.22 114.46 0.02 OUTLIER Pre-proline 0 N--CA 1.448 -0.571 0 CA-C-N 115.846 -0.616 . . . . 0.0 111.5 -179.465 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_exo -53.23 128.8 30.59 Favored 'Trans proline' 0 N--CA 1.491 1.337 0 C-N-CA 121.312 1.342 . . . . 0.0 111.58 179.847 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.428 ' O ' HG12 ' A' ' 77' ' ' VAL . 42.5 t -82.53 -7.81 10.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.59 179.483 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 75.4 p -48.21 -23.57 0.91 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.957 0.408 . . . . 0.0 110.172 -179.916 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.72 -36.57 84.73 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.797 179.461 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 -58.33 -34.59 70.78 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.119 179.934 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 49.5 m -59.32 -40.59 86.76 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.352 179.573 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 11.8 m-85 -60.97 -49.58 76.85 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 120.793 -0.363 . . . . 0.0 111.022 179.826 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 83' ' ' TRP . . . . . 0.491 ' N ' ' CD1' ' A' ' 83' ' ' TRP . 21.9 m0 -58.6 -35.34 72.28 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.508 -179.756 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 77.5 m-20 -63.49 -46.52 85.74 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 120.618 -0.433 . . . . 0.0 110.758 179.727 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 35.1 tp -71.24 -53.32 14.77 Favored 'General case' 0 C--O 1.219 -0.501 0 C-N-CA 120.486 -0.486 . . . . 0.0 110.274 179.344 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -56.85 -27.51 26.43 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-O 120.863 0.363 . . . . 0.0 110.466 -179.988 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 34.8 tttm -65.8 -49.68 67.41 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.72 -179.599 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 88' ' ' GLU . . . . . 0.536 ' OE1' ' NZ ' ' A' ' 92' ' ' LYS . 1.1 pp20? -80.08 -20.1 45.91 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.794 -179.64 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.524 ' O ' HD13 ' A' ' 89' ' ' LEU . 0.2 OUTLIER -62.48 -45.06 94.77 Favored 'General case' 0 N--CA 1.444 -0.753 0 C-N-CA 120.263 -0.575 . . . . 0.0 110.427 -179.104 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.476 HD12 ' CG1' ' A' ' 53' ' ' ILE . 3.4 mt -64.79 -43.19 96.46 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.153 0 C-N-CA 120.504 -0.478 . . . . 0.0 109.955 -179.831 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 88.7 m-20 -44.31 -42.05 6.45 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.604 -178.487 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 92' ' ' LYS . . . . . 0.742 ' O ' HG23 ' A' ' 95' ' ' VAL . 51.2 mttp -57.14 124.96 20.58 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.025 0.441 . . . . 0.0 110.773 179.923 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -71.43 -38.28 71.37 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.436 179.187 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 93.0 mt-10 -81.72 50.25 1.48 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.915 -179.395 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.742 HG23 ' O ' ' A' ' 92' ' ' LYS . 13.1 t -80.61 162.35 3.67 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.057 179.719 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 96' ' ' ASN . . . . . 0.602 ' O ' ' N ' ' A' ' 98' ' ' GLN . 0.0 OUTLIER -40.87 166.35 0.06 OUTLIER Pre-proline 0 C--N 1.328 -0.362 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.324 179.95 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 77.3 Cg_exo -40.19 -14.05 0.03 OUTLIER 'Trans proline' 0 C--N 1.313 -1.335 0 C-N-CA 122.864 2.376 . . . . 0.0 112.695 179.327 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 98' ' ' GLN . . . . . 0.817 HE22 HG13 ' A' ' 51' ' ' ILE . 0.6 OUTLIER . . . . . 0 C--N 1.321 -0.632 0 C-N-CA 120.742 -0.383 . . . . 0.0 110.056 179.281 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 30.7 p . . . . . 0 N--CA 1.461 0.121 0 CA-C-O 120.753 0.311 . . . . 0.0 110.325 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -99.43 147.0 25.72 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.538 -179.846 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 108' ' ' GLU . . . . . 0.427 ' C ' ' N ' ' A' ' 110' ' ' LEU . 79.6 mm-40 -79.57 129.69 34.7 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.15 -0.477 . . . . 0.0 109.978 179.499 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 109' ' ' ILE . . . . . 0.442 ' O ' ' OG ' ' A' ' 112' ' ' SER . 39.1 pt -54.29 -12.1 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 115.922 -0.581 . . . . 0.0 109.846 -179.887 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.427 ' N ' ' C ' ' A' ' 108' ' ' GLU . 79.1 mt -73.47 -39.08 65.19 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.429 179.278 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -65.64 -33.73 76.56 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.424 -179.884 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 112' ' ' SER . . . . . 0.442 ' OG ' ' O ' ' A' ' 109' ' ' ILE . 94.0 p -59.74 -44.5 93.76 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.968 -179.304 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 40.6 t30 -64.77 -41.74 95.64 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.192 179.944 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 17.1 p -167.81 157.24 9.92 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.514 179.498 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 34.0 mt-30 -99.75 10.34 41.49 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.835 0.35 . . . . 0.0 110.495 179.764 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 43.7 p -65.02 -36.75 85.39 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.471 -179.901 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 91.0 m-20 . . . . . 0 C--N 1.329 -0.323 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.528 179.962 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.743 0 N-CA-C 111.2 -0.76 . . . . 0.0 111.2 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 97.2 mm-40 -60.01 -21.58 61.49 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.911 0.386 . . . . 0.0 110.315 -179.87 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.569 ' OE2' ' H61' ' A' ' 201' ' ' MYR . 82.8 tt0 -56.23 -22.62 30.68 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.468 179.705 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 34.2 tp -41.63 -28.54 0.14 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.373 -179.681 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 78.2 p -57.73 -36.97 72.76 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 120.662 -0.415 . . . . 0.0 110.112 -179.762 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 88.0 mt-30 -64.28 -33.04 74.92 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.573 179.431 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 58.5 t-80 -61.85 -45.62 92.99 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.596 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 98.1 mt-10 -59.84 -44.84 93.88 Favored 'General case' 0 C--O 1.243 0.718 0 CA-C-O 121.243 0.544 . . . . 0.0 110.111 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 77.9 mmt-85 -62.27 -33.47 74.69 Favored 'General case' 0 C--O 1.214 -0.813 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 179.235 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.722 ' CD2' H122 ' A' ' 201' ' ' MYR . 40.7 t80 -59.96 -37.29 79.14 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 120.548 -0.461 . . . . 0.0 110.353 -179.762 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 3.4 t -61.62 -48.28 89.45 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 C-N-CA 119.75 -0.78 . . . . 0.0 110.888 179.885 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 98.4 mt-10 -82.02 -46.85 13.38 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 120.038 -0.665 . . . . 0.0 111.66 -179.554 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 71.2 tp60 -58.3 -51.38 70.04 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.89 -0.595 . . . . 0.0 111.201 -179.131 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.647 HD13 ' O ' ' A' ' 15' ' ' LEU . 0.4 OUTLIER -63.48 -46.12 87.65 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-O 120.991 0.424 . . . . 0.0 109.933 179.875 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.544 ' HB3' HG11 ' A' ' 26' ' ' VAL . 91.8 mttt -58.32 -35.54 72.02 Favored 'General case' 0 C--N 1.329 -0.284 0 O-C-N 121.962 -0.461 . . . . 0.0 110.478 179.359 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 93.2 mt-30 -71.91 -36.25 69.94 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.369 178.967 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.16 -38.68 80.31 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.087 179.87 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.5 mt -79.88 -28.01 39.96 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.965 0.412 . . . . 0.0 110.581 179.293 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 65.1 tttm -55.29 -39.81 70.31 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.243 -179.337 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.434 HG23 HH11 ' A' ' 22' ' ' ARG . 1.5 t -74.13 -18.18 60.83 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.877 -179.821 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.434 HH11 HG23 ' A' ' 21' ' ' THR . 62.8 mmt-85 -77.22 -0.19 24.28 Favored 'General case' 0 C--N 1.331 -0.2 0 C-N-CA 120.672 -0.411 . . . . 0.0 110.202 179.544 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 106.67 13.57 21.84 Favored Glycine 0 N--CA 1.466 0.7 0 N-CA-C 110.884 -0.886 . . . . 0.0 110.884 -179.554 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.589 HG12 ' N ' ' A' ' 25' ' ' LYS . 17.9 t -100.86 168.74 1.83 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 N-CA-C 110.441 -0.207 . . . . 0.0 110.441 -179.838 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.589 ' N ' HG12 ' A' ' 24' ' ' VAL . 68.6 mttm -125.54 137.9 53.95 Favored 'General case' 0 C--O 1.233 0.209 0 N-CA-C 110.175 -0.306 . . . . 0.0 110.175 179.591 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.544 HG11 ' HB3' ' A' ' 16' ' ' LYS . 3.2 m -135.63 107.12 6.9 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.374 0 CA-C-O 120.761 0.315 . . . . 0.0 110.801 -179.651 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 27.8 pttt -108.55 165.83 11.23 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-O 120.75 0.309 . . . . 0.0 110.527 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.605 ' CE2' HD11 ' A' ' 32' ' ' LEU . 81.6 t80 -47.97 -38.52 17.02 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-O 121.04 0.447 . . . . 0.0 109.884 179.442 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.444 ' HA ' HD12 ' A' ' 32' ' ' LEU . . . -56.98 -23.08 43.26 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.021 -0.536 . . . . 0.0 109.984 179.041 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 58.2 t0 -62.26 -44.36 96.72 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.559 -179.594 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.518 ' O ' ' CB ' ' A' ' 35' ' ' PHE . 5.6 mp -67.47 -41.29 84.87 Favored 'General case' 0 C--O 1.213 -0.828 0 CA-C-O 121.164 0.507 . . . . 0.0 109.694 179.184 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.605 HD11 ' CE2' ' A' ' 28' ' ' TYR . 49.4 mt -56.97 -44.57 82.77 Favored 'General case' 0 C--N 1.313 -0.987 0 C-N-CA 119.715 -0.794 . . . . 0.0 111.26 -178.605 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -84.31 -50.86 7.45 Favored 'General case' 0 C--N 1.32 -0.702 0 C-N-CA 120.666 -0.413 . . . . 0.0 111.617 -179.013 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' PHE . . . . . 0.794 ' O ' HG22 ' A' ' 38' ' ' VAL . 59.7 t80 -63.48 -48.27 78.35 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.47 -178.916 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.518 ' CB ' ' O ' ' A' ' 31' ' ' LEU . 17.4 t80 -61.97 -44.47 96.68 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 110.009 -0.367 . . . . 0.0 110.009 -179.442 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 92.4 m-20 -70.39 -37.96 74.6 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 120.717 -0.393 . . . . 0.0 111.683 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.472 ' CE2' ' CE2' ' A' ' 63' ' ' PHE . 2.7 m-85 -62.34 -50.46 71.52 Favored 'General case' 0 N--CA 1.464 0.253 0 N-CA-C 112.116 0.413 . . . . 0.0 112.116 -178.629 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.794 HG22 ' O ' ' A' ' 34' ' ' PHE . 13.9 m -68.17 -42.58 84.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 C-N-CA 120.541 -0.463 . . . . 0.0 110.493 -179.599 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 43.3 mmtt -64.24 -28.5 69.77 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.069 179.872 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 67.3 t0 -54.2 -49.24 69.84 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 120.725 -0.39 . . . . 0.0 110.542 -179.309 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.465 ' O ' ' SG ' ' A' ' 42' ' ' CYS . 12.1 p -113.38 -2.77 13.89 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.026 179.766 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' CYS . . . . . 0.533 ' N ' ' O ' ' A' ' 38' ' ' VAL . 29.8 p 37.72 57.6 4.48 Favored Pre-proline 0 N--CA 1.465 0.3 0 CA-C-N 116.484 -0.325 . . . . 0.0 110.553 -179.223 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 69.7 Cg_endo -76.54 -33.23 3.26 Favored 'Trans proline' 0 C--N 1.31 -1.461 0 C-N-CA 122.538 2.159 . . . . 0.0 112.806 -179.062 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' TRP . . . . . 0.639 ' HE1' ' H ' ' A' ' 52' ' ' ASP . 0.0 OUTLIER -75.94 2.36 12.78 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.711 -179.775 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.489 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 16.7 m-85 50.14 51.41 10.64 Favored Pre-proline 0 C--N 1.327 -0.397 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.02 -179.786 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.489 ' CD ' ' N ' ' A' ' 45' ' ' PHE . 10.1 Cg_endo -51.14 -7.24 0.14 Allowed 'Trans proline' 0 C--N 1.308 -1.587 0 C-N-CA 122.805 2.337 . . . . 0.0 111.973 -179.783 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.47 ' H ' ' C ' ' A' ' 45' ' ' PHE . 99.5 mm-40 -62.21 -52.8 62.31 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.627 -179.576 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.498 ' O ' ' H51' ' A' ' 201' ' ' MYR . 55.1 tt0 -88.3 -12.86 42.31 Favored 'General case' 0 N--CA 1.466 0.326 0 C-N-CA 120.569 -0.452 . . . . 0.0 110.387 179.713 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' GLY . . . . . 0.711 ' O ' ' H71' ' A' ' 201' ' ' MYR . . . 71.73 69.05 1.46 Allowed Glycine 0 CA--C 1.524 0.651 0 N-CA-C 110.486 -1.045 . . . . 0.0 110.486 -179.504 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 3.0 t -136.39 161.31 36.16 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.712 0.291 . . . . 0.0 110.945 -179.249 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.1 mt -99.92 139.75 20.75 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.248 0 CA-C-O 120.98 0.419 . . . . 0.0 110.29 179.428 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' ASP . . . . . 0.639 ' H ' ' HE1' ' A' ' 44' ' ' TRP . 4.9 t70 -125.44 120.83 32.08 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.588 -0.733 . . . . 0.0 109.648 179.405 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 20.1 mm -88.04 -44.74 15.87 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.834 -179.26 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 65.4 tttm -66.92 -51.45 55.15 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-O 121.077 0.465 . . . . 0.0 111.618 -179.718 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 79.3 mmt-85 -62.09 -32.52 73.08 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.807 -0.442 . . . . 0.0 109.807 -179.665 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' TRP . . . . . 0.594 ' CE3' ' CH2' ' A' ' 44' ' ' TRP . 29.9 t-105 -57.59 -39.72 77.42 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 120.564 -0.454 . . . . 0.0 110.097 -179.897 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -65.22 -37.81 88.44 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.981 -0.554 . . . . 0.0 109.944 179.544 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 68.6 ttt180 -61.24 -53.35 58.02 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 120.67 -0.412 . . . . 0.0 111.144 -179.723 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.432 HG13 ' N ' ' A' ' 60' ' ' GLY . 3.5 p -64.46 -43.87 96.97 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.507 0 CA-C-O 120.721 0.296 . . . . 0.0 110.274 179.695 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' GLY . . . . . 0.432 ' N ' HG13 ' A' ' 59' ' ' VAL . . . -62.65 -40.4 99.12 Favored Glycine 0 CA--C 1.524 0.645 0 N-CA-C 111.047 -0.821 . . . . 0.0 111.047 179.741 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' ASP . . . . . 0.43 ' O ' ' OD1' ' A' ' 61' ' ' ASP . 67.9 t0 -64.17 -37.8 88.76 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.742 0.306 . . . . 0.0 110.929 -179.688 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 67.5 m -60.55 -53.08 61.77 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.911 -179.367 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' PHE . . . . . 0.472 ' CE2' ' CE2' ' A' ' 37' ' ' PHE . 44.3 m-85 -68.97 -37.03 78.55 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.725 179.457 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 69.5 tp60 -59.71 -43.34 94.16 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.867 0.365 . . . . 0.0 110.358 -179.805 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 18.4 t0 -60.56 -50.77 72.21 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.568 179.707 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' TYR . . . . . 0.465 ' O ' ' OG1' ' A' ' 69' ' ' THR . 70.9 t80 -66.36 -26.16 67.14 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.113 179.749 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 59.2 t80 -73.36 -42.08 62.65 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.612 179.882 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' ASN . . . . . 0.473 ' O ' ' N ' ' A' ' 71' ' ' GLY . 94.0 m-20 -63.35 -37.1 85.97 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.025 -179.14 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.465 ' OG1' ' O ' ' A' ' 66' ' ' TYR . 40.5 p -48.35 -17.08 0.12 Allowed 'General case' 0 N--CA 1.464 0.256 0 C-N-CA 120.786 -0.366 . . . . 0.0 110.664 -179.593 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' PHE . . . . . 0.418 ' N ' ' C ' ' A' ' 68' ' ' ASN . 90.3 m-85 -95.59 15.47 19.77 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 120.806 -0.358 . . . . 0.0 111.047 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 71' ' ' GLY . . . . . 0.473 ' N ' ' O ' ' A' ' 68' ' ' ASN . . . 38.0 59.18 1.46 Allowed Glycine 0 N--CA 1.471 1.018 0 N-CA-C 110.976 -0.85 . . . . 0.0 110.976 -179.451 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 72' ' ' PRO . . . . . 0.5 ' O ' HG23 ' A' ' 75' ' ' VAL . 69.4 Cg_endo -80.62 125.42 5.57 Favored 'Trans proline' 0 C--N 1.309 -1.5 0 C-N-CA 122.431 2.087 . . . . 0.0 112.223 -179.962 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 77.5 mm-40 -85.73 -39.2 17.43 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.885 179.771 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.724 ' CD ' ' H ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -62.58 -41.29 98.84 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.424 -0.807 . . . . 0.0 111.646 -179.752 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.516 ' O ' HG12 ' A' ' 75' ' ' VAL . 29.0 t 31.77 93.05 0.05 OUTLIER Pre-proline 0 N--CA 1.463 0.212 0 O-C-N 123.296 0.373 . . . . 0.0 111.194 179.633 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 34.6 Cg_exo -55.63 125.62 19.73 Favored 'Trans proline' 0 C--N 1.311 -1.441 0 C-N-CA 121.442 1.428 . . . . 0.0 111.645 -179.073 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.448 ' O ' ' N ' ' A' ' 80' ' ' PHE . 60.5 t -82.8 -19.61 10.09 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.452 179.576 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 78' ' ' THR . . . . . 0.416 ' H ' HG23 ' A' ' 78' ' ' THR . 10.3 p -41.56 -28.26 0.12 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.328 -179.187 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 79' ' ' ALA . . . . . 0.407 ' N ' ' C ' ' A' ' 77' ' ' VAL . . . -59.78 -41.48 91.22 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.371 179.724 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 80' ' ' PHE . . . . . 0.448 ' N ' ' O ' ' A' ' 77' ' ' VAL . 3.2 m-85 -63.21 -40.27 97.01 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.672 179.701 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 43.5 m -59.1 -42.12 89.75 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.866 -179.77 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 5.6 m-85 -60.05 -51.23 70.55 Favored 'General case' 0 C--N 1.331 -0.22 0 C-N-CA 120.813 -0.355 . . . . 0.0 110.74 -179.736 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' TRP . . . . . . . . . . . . . 32.9 t90 -58.48 -38.52 77.78 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.536 179.565 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 92.8 m-20 -61.51 -44.18 97.52 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 120.652 -0.419 . . . . 0.0 110.529 -179.475 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.405 HD11 HD23 ' A' ' 89' ' ' LEU . 23.7 tp -72.98 -56.06 5.68 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 120.328 -0.549 . . . . 0.0 110.242 179.403 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -54.88 -25.56 15.85 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 CA-C-O 120.9 0.381 . . . . 0.0 110.364 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 64.4 tttt -67.19 -50.64 60.21 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.576 179.83 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' GLU . . . . . 0.442 ' OE1' ' O ' ' A' ' 88' ' ' GLU . 1.0 OUTLIER -80.42 -19.89 45.15 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.917 -179.473 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.532 ' O ' HD13 ' A' ' 89' ' ' LEU . 0.2 OUTLIER -62.31 -44.82 95.63 Favored 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 120.549 -0.461 . . . . 0.0 110.327 -179.346 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 3.4 mt -64.28 -43.27 97.18 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 C-N-CA 120.007 -0.677 . . . . 0.0 109.991 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -47.94 -40.24 21.57 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.405 -0.362 . . . . 0.0 110.445 -179.09 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 43.1 mttm -60.02 136.29 57.97 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.991 0.424 . . . . 0.0 110.841 179.821 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -90.27 -8.96 49.63 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.192 -179.811 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 42.2 tp10 -66.45 -31.62 72.49 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.894 -0.593 . . . . 0.0 110.442 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.408 HG23 ' H ' ' A' ' 95' ' ' VAL . 21.2 t -41.7 135.48 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.298 -0.41 . . . . 0.0 109.902 -179.66 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 96' ' ' ASN . . . . . 0.491 ' O ' ' N ' ' A' ' 98' ' ' GLN . 0.9 OUTLIER -40.48 157.22 0.17 Allowed Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.07 -178.833 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 40.9 Cg_exo -45.62 -13.0 0.07 OUTLIER 'Trans proline' 0 N--CA 1.492 1.414 0 C-N-CA 122.432 2.088 . . . . 0.0 112.209 179.23 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 98' ' ' GLN . . . . . 0.491 ' N ' ' O ' ' A' ' 96' ' ' ASN . 1.9 pt20 -46.72 -23.74 0.46 Allowed 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.742 -179.436 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 72.5 t -63.61 -50.3 78.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.761 -179.399 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 95.8 mtp -78.78 -39.02 37.04 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.775 179.725 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 101' ' ' ALA . . . . . 0.403 ' O ' ' OE2' ' A' ' 48' ' ' GLU . . . -65.18 -33.46 76.07 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.781 -179.68 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 102' ' ' ALA . . . . . 0.439 ' HB2' ' O ' ' A' ' 98' ' ' GLN . . . -59.35 -15.73 18.21 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.555 -179.93 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 90.8 t -63.79 -19.91 25.38 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.186 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.359 179.591 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -57.74 -37.7 74.07 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.43 -179.807 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 27.3 mt-30 -64.36 -40.31 95.59 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.474 179.882 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 98.7 m -62.79 -45.42 92.72 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.577 179.865 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 67.3 mm-40 -66.27 -163.38 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.139 -179.908 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 108' ' ' GLU . . . . . 0.483 ' C ' ' N ' ' A' ' 110' ' ' LEU . 97.4 mt-10 -106.73 129.12 54.66 Favored 'General case' 0 CA--C 1.516 -0.346 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.009 179.073 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 38.9 pt -50.42 -11.84 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-N 116.075 -0.511 . . . . 0.0 109.928 179.645 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.483 ' N ' ' C ' ' A' ' 108' ' ' GLU . 26.3 mt -64.41 -40.59 96.07 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.577 179.649 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -94.6 87.18 5.01 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.956 -179.895 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 50.2 m -63.24 -41.63 99.11 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.679 179.441 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 96.3 m-20 -137.18 -166.26 1.89 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.644 -179.565 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 77.8 p -64.02 -17.27 63.17 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.441 -179.832 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 84.4 mt-30 -56.13 -165.98 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.375 -179.915 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 77.0 p -83.34 -171.73 3.74 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.53 179.872 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 117' ' ' ASP . . . . . 0.424 ' N ' ' OD1' ' A' ' 117' ' ' ASP . 33.9 p-10 -63.34 -28.32 69.92 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.763 -179.894 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 95.6 mt -101.5 129.82 47.65 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.613 -179.847 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 17.0 pt-20 -88.33 139.3 30.63 Favored 'General case' 0 C--N 1.334 -0.075 0 CA-C-O 120.625 0.25 . . . . 0.0 110.502 179.95 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 98.0 m-70 -113.2 143.68 43.99 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.653 -179.901 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 99.5 m-70 -135.02 145.57 48.18 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.544 179.897 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 90.9 m-70 -62.17 -36.82 83.04 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.457 -179.938 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 62.5 m80 -64.4 -43.9 92.98 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.682 -179.872 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 124' ' ' HIS . . . . . . . . . . . . . 24.9 m170 -66.94 -40.75 87.65 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.567 179.915 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 82.0 t60 . . . . . 0 C--O 1.22 -0.481 0 CA-C-O 117.985 -1.007 . . . . 0.0 110.608 -179.931 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 201' ' ' MYR . . . . . 0.722 H122 ' CD2' ' A' ' 11' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.67 0 N-CA-C 110.972 -0.851 . . . . 0.0 110.972 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 99.4 mt-30 -64.97 -38.74 91.95 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.856 0.36 . . . . 0.0 110.601 179.857 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.716 ' OE1' ' H52' ' A' ' 201' ' ' MYR . 83.7 tt0 -52.88 -22.88 6.03 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.523 179.995 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.491 ' HB2' ' H21' ' A' ' 201' ' ' MYR . 40.0 tp -42.12 -31.42 0.37 Allowed 'General case' 0 C--O 1.237 0.426 0 CA-C-O 121.016 0.436 . . . . 0.0 110.349 -179.625 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 70.4 m -56.34 -36.74 69.1 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.112 -0.495 . . . . 0.0 109.954 179.743 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' GLN . . . . . 0.456 ' HA ' ' HE ' ' A' ' 10' ' ' ARG . 57.6 tt0 -63.38 -34.82 78.56 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.586 179.537 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 73.6 t60 -60.29 -46.08 91.1 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.813 0.34 . . . . 0.0 110.277 -179.672 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 77.1 tt0 -61.17 -48.77 80.01 Favored 'General case' 0 C--O 1.244 0.804 0 CA-C-O 121.391 0.615 . . . . 0.0 110.288 179.552 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.456 ' HE ' ' HA ' ' A' ' 7' ' ' GLN . 85.9 mtm180 -62.47 -32.6 73.52 Favored 'General case' 0 C--O 1.213 -0.844 0 N-CA-C 108.624 -0.88 . . . . 0.0 108.624 179.462 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.433 ' CE1' HD23 ' A' ' 15' ' ' LEU . 26.4 t80 -58.68 -37.17 75.46 Favored 'General case' 0 C--N 1.324 -0.51 0 C-N-CA 120.41 -0.516 . . . . 0.0 110.186 -179.839 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 2.3 t -61.26 -50.69 79.41 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 C-N-CA 119.601 -0.84 . . . . 0.0 110.658 179.904 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 78.1 tt0 -81.66 -46.92 13.66 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 119.989 -0.684 . . . . 0.0 112.108 -179.215 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 66.4 tp60 -57.61 -52.47 65.28 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.428 -179.018 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.603 HD13 ' O ' ' A' ' 15' ' ' LEU . 0.3 OUTLIER -63.31 -45.64 90.42 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 109.619 -0.512 . . . . 0.0 109.619 -179.693 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.535 ' HB3' HG11 ' A' ' 26' ' ' VAL . 87.7 mttt -57.25 -35.2 69.43 Favored 'General case' 0 C--N 1.332 -0.182 0 C-N-CA 120.511 -0.475 . . . . 0.0 110.365 179.36 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 81.6 mm-40 -71.07 -41.89 70.11 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.071 0.462 . . . . 0.0 110.616 178.988 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.567 ' O ' HG22 ' A' ' 21' ' ' THR . . . -54.21 -45.64 72.26 Favored 'General case' 0 C--O 1.223 -0.294 0 CA-C-N 116.02 -0.536 . . . . 0.0 109.641 179.931 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.444 ' O ' ' N ' ' A' ' 22' ' ' ARG . 4.7 mt -68.03 -35.23 77.92 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.888 0.375 . . . . 0.0 110.851 178.849 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 56.1 tttm -47.37 -37.57 11.45 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 -179.424 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.567 HG22 ' O ' ' A' ' 18' ' ' ALA . 0.7 OUTLIER -64.56 -31.55 72.82 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.947 -0.569 . . . . 0.0 111.149 179.019 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.444 ' N ' ' O ' ' A' ' 19' ' ' LEU . 30.9 mmt-85 -73.16 21.3 0.08 Allowed 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 120.921 0.391 . . . . 0.0 110.761 -179.615 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' GLY . . . . . 0.484 ' H ' ' C ' ' A' ' 21' ' ' THR . . . 81.58 13.24 80.51 Favored Glycine 0 N--CA 1.466 0.652 0 N-CA-C 110.487 -1.045 . . . . 0.0 110.487 179.972 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.464 HG12 ' N ' ' A' ' 25' ' ' LYS . 4.3 t -92.12 167.33 1.66 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 N-CA-C 110.082 -0.34 . . . . 0.0 110.082 179.959 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.464 ' N ' HG12 ' A' ' 24' ' ' VAL . 99.1 mttt -129.52 134.49 47.8 Favored 'General case' 0 N--CA 1.455 -0.219 0 N-CA-C 110.149 -0.315 . . . . 0.0 110.149 179.64 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.535 HG11 ' HB3' ' A' ' 16' ' ' LYS . 2.6 m -132.03 105.7 10.04 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.371 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.141 179.927 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.455 ' O ' ' OD1' ' A' ' 30' ' ' ASP . 11.6 ttmt -107.99 162.08 14.35 Favored 'General case' 0 C--O 1.224 -0.276 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 179.822 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.439 ' H ' ' HG2' ' A' ' 27' ' ' LYS . 93.6 m-85 -38.83 -33.33 0.11 Allowed 'General case' 0 C--O 1.235 0.334 0 CA-C-O 121.118 0.485 . . . . 0.0 110.823 179.837 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.532 ' HA ' HD12 ' A' ' 32' ' ' LEU . . . -52.62 -23.13 5.93 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.196 179.836 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.488 ' CG ' ' N ' ' A' ' 31' ' ' LEU . 21.6 p-10 -59.03 -54.19 49.87 Favored 'General case' 0 C--O 1.217 -0.646 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.763 -179.33 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.488 ' N ' ' CG ' ' A' ' 30' ' ' ASP . 0.5 OUTLIER -63.49 -40.07 96.12 Favored 'General case' 0 C--O 1.217 -0.619 0 C-N-CA 120.439 -0.504 . . . . 0.0 109.814 -179.724 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.532 HD12 ' HA ' ' A' ' 29' ' ' ALA . 45.7 mt -56.74 -50.21 72.93 Favored 'General case' 0 C--N 1.314 -0.959 0 C-N-CA 119.267 -0.973 . . . . 0.0 111.021 -178.76 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.415 ' O ' ' N ' ' A' ' 37' ' ' PHE . 88.1 tttt -85.54 -52.77 5.61 Favored 'General case' 0 C--N 1.32 -0.68 0 C-N-CA 120.317 -0.553 . . . . 0.0 112.031 -179.295 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' PHE . . . . . 0.462 ' CB ' ' O ' ' A' ' 30' ' ' ASP . 45.1 t80 -55.2 -47.8 74.76 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.027 -178.121 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.47 ' CB ' ' O ' ' A' ' 31' ' ' LEU . 14.7 t80 -61.2 -46.62 89.69 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 120.083 -0.647 . . . . 0.0 109.513 -179.794 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 98.1 m-20 -71.22 -23.65 62.05 Favored 'General case' 0 C--N 1.345 0.401 0 C-N-CA 120.511 -0.476 . . . . 0.0 111.404 179.949 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.415 ' N ' ' O ' ' A' ' 33' ' ' LYS . 7.5 t80 -61.28 -48.06 83.14 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.849 0.357 . . . . 0.0 110.403 -178.934 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.555 ' O ' ' N ' ' A' ' 42' ' ' CYS . 6.6 m -77.85 -30.68 16.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.387 179.343 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -55.96 -30.1 61.21 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.44 -0.504 . . . . 0.0 110.545 -179.41 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 65.0 t0 -55.37 -63.97 0.99 Allowed 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 120.699 -0.4 . . . . 0.0 111.805 -179.208 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.428 ' C ' ' SG ' ' A' ' 42' ' ' CYS . 17.0 p -116.27 -19.77 10.06 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-O 120.98 0.419 . . . . 0.0 111.481 -179.559 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' CYS . . . . . 0.555 ' N ' ' O ' ' A' ' 38' ' ' VAL . 1.7 m 65.84 58.48 1.14 Allowed Pre-proline 0 CA--C 1.537 0.443 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.625 -178.461 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' PRO . . . . . 0.51 ' HD3' ' N ' ' A' ' 42' ' ' CYS . 11.8 Cg_exo -70.23 -37.35 8.17 Favored 'Trans proline' 0 N--CA 1.498 1.783 0 C-N-CA 122.891 2.394 . . . . 0.0 112.889 -179.409 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' TRP . . . . . 0.762 ' HE1' ' H ' ' A' ' 52' ' ' ASP . 0.0 OUTLIER -75.91 15.29 0.55 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.455 -179.387 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.439 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 62.1 m-85 41.57 53.65 7.47 Favored Pre-proline 0 C--N 1.332 -0.188 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.027 -179.879 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.439 ' CD ' ' N ' ' A' ' 45' ' ' PHE . 9.8 Cg_endo -52.39 -9.62 0.61 Allowed 'Trans proline' 0 C--N 1.308 -1.569 0 C-N-CA 122.803 2.335 . . . . 0.0 112.077 -179.883 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 98.3 mm-40 -64.99 -52.81 54.11 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.255 179.729 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.415 ' O ' ' H62' ' A' ' 201' ' ' MYR . 46.7 tp10 -87.02 -51.26 6.12 Favored 'General case' 0 N--CA 1.466 0.357 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 178.983 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 49' ' ' GLY . . . . . 0.581 ' O ' ' H91' ' A' ' 201' ' ' MYR . . . 108.25 77.89 1.05 Allowed Glycine 0 CA--C 1.526 0.719 0 N-CA-C 109.619 -1.392 . . . . 0.0 109.619 -178.714 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' THR . . . . . 0.443 ' O ' H132 ' A' ' 201' ' ' MYR . 13.0 t -134.49 170.87 15.12 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 110.179 -0.304 . . . . 0.0 110.179 -179.106 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.1 mt -101.95 137.63 29.08 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.283 0 CA-C-O 121.027 0.441 . . . . 0.0 109.952 178.977 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' ASP . . . . . 0.762 ' H ' ' HE1' ' A' ' 44' ' ' TRP . 11.7 m-20 -117.15 121.21 40.64 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.646 -0.706 . . . . 0.0 111.377 179.807 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.497 ' CG1' HD12 ' A' ' 90' ' ' ILE . 22.9 mm -94.86 -56.14 5.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.756 179.045 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 67.7 mttm -75.86 -48.37 21.73 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-O 121.105 0.479 . . . . 0.0 111.364 -179.856 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 74.6 mtp85 -60.27 -32.46 71.2 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.253 179.898 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' TRP . . . . . 0.454 ' CE3' ' CZ3' ' A' ' 44' ' ' TRP . 22.8 t-105 -59.8 -38.8 82.94 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.133 178.727 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 85.7 mtp180 -65.22 -36.18 83.35 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 120.51 -0.476 . . . . 0.0 110.406 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 94.5 mtt180 -59.82 -50.15 74.94 Favored 'General case' 0 N--CA 1.466 0.359 0 C-N-CA 120.25 -0.58 . . . . 0.0 111.579 -179.175 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 3.2 p -64.4 -43.74 97.05 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.508 0 CA-C-O 120.809 0.337 . . . . 0.0 110.141 179.717 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -64.0 -35.51 92.09 Favored Glycine 0 CA--C 1.524 0.65 0 N-CA-C 111.072 -0.811 . . . . 0.0 111.072 179.611 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 97.3 m-20 -63.6 -36.53 84.1 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.659 0.266 . . . . 0.0 110.802 -179.694 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 63.4 m -65.58 -56.21 13.5 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 120.845 -0.342 . . . . 0.0 110.945 -179.713 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 59.4 m-85 -65.51 -37.22 86.14 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.721 179.819 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 55.8 tt0 -63.1 -40.14 96.76 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.675 -179.719 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.592 ' O ' HG23 ' A' ' 69' ' ' THR . 37.7 t0 -59.75 -51.03 71.53 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.449 -179.959 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' TYR . . . . . 0.469 ' O ' ' OG1' ' A' ' 69' ' ' THR . 53.8 m-85 -69.08 -33.13 73.06 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.681 179.585 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 56.2 t80 -66.69 -44.09 82.7 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.983 0.42 . . . . 0.0 110.415 -179.641 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 94.1 m-20 -64.2 -39.09 93.26 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.425 -179.237 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.592 HG23 ' O ' ' A' ' 65' ' ' ASP . 44.8 p -48.24 -28.53 3.11 Favored 'General case' 0 CA--C 1.516 -0.342 0 C-N-CA 120.766 -0.374 . . . . 0.0 110.676 -179.125 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 67.5 m-85 -69.77 -35.82 75.24 Favored 'General case' 0 C--N 1.32 -0.686 0 C-N-CA 120.283 -0.567 . . . . 0.0 111.31 179.263 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' GLY . . . . . 0.51 ' N ' ' CD ' ' A' ' 72' ' ' PRO . . . 90.65 46.4 4.0 Favored Glycine 0 CA--C 1.533 1.185 0 N-CA-C 110.64 -0.984 . . . . 0.0 110.64 -178.457 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 72' ' ' PRO . . . . . 0.531 ' O ' HG23 ' A' ' 75' ' ' VAL . 66.8 Cg_endo -75.0 128.26 11.34 Favored 'Trans proline' 0 N--CA 1.49 1.285 0 C-N-CA 122.744 2.296 . . . . 0.0 111.861 -179.671 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 80.4 mm-40 -86.77 -38.63 16.71 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.342 0.591 . . . . 0.0 111.089 -179.92 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.716 ' CD ' ' H ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -59.12 -39.52 82.55 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 115.261 -0.882 . . . . 0.0 111.559 -179.436 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.531 HG23 ' O ' ' A' ' 72' ' ' PRO . 41.6 t 20.87 90.0 0.05 OUTLIER Pre-proline 0 N--CA 1.466 0.349 0 O-C-N 124.074 0.859 . . . . 0.0 111.287 -179.972 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_exo -55.53 125.44 19.13 Favored 'Trans proline' 0 C--N 1.313 -1.307 0 C-N-CA 121.131 1.221 . . . . 0.0 111.613 -178.725 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.475 ' O ' ' N ' ' A' ' 79' ' ' ALA . 89.4 t -83.8 -18.98 9.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 115.301 -0.863 . . . . 0.0 110.638 179.663 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 71.5 p -41.94 -22.55 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.707 -178.901 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' ALA . . . . . 0.475 ' N ' ' O ' ' A' ' 77' ' ' VAL . . . -61.94 -39.0 90.6 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.251 179.711 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 38.6 t80 -61.41 -40.39 94.22 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.464 179.956 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 82.8 p -58.36 -40.33 81.94 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.709 0.29 . . . . 0.0 110.727 -179.489 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 7.5 m-85 -60.46 -50.63 72.79 Favored 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 120.745 -0.382 . . . . 0.0 110.716 179.915 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' TRP . . . . . . . . . . . . . 55.6 t90 -58.34 -38.34 76.96 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.604 179.938 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 87.6 m-20 -61.29 -44.86 96.51 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 120.594 -0.442 . . . . 0.0 110.838 -179.364 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 29.1 tp -73.67 -57.15 4.19 Favored 'General case' 0 N--CA 1.449 -0.478 0 C-N-CA 120.262 -0.575 . . . . 0.0 110.194 179.552 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -52.59 -26.8 10.61 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 C-N-CA 120.531 -0.468 . . . . 0.0 110.454 179.667 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 63.7 tttt -66.81 -50.32 63.0 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.976 -0.557 . . . . 0.0 110.78 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' GLU . . . . . 0.413 ' OE1' ' O ' ' A' ' 88' ' ' GLU . 1.2 pp20? -80.02 -20.24 45.83 Favored 'General case' 0 C--N 1.319 -0.738 0 C-N-CA 120.302 -0.559 . . . . 0.0 110.899 -179.396 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.533 ' O ' HD13 ' A' ' 89' ' ' LEU . 0.2 OUTLIER -62.16 -46.94 86.73 Favored 'General case' 0 N--CA 1.447 -0.613 0 C-N-CA 120.72 -0.392 . . . . 0.0 110.324 -178.865 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.497 HD12 ' CG1' ' A' ' 53' ' ' ILE . 3.3 mt -63.79 -43.43 97.93 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.141 0 C-N-CA 120.121 -0.632 . . . . 0.0 109.695 -179.821 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 96.2 m-20 -48.92 -44.86 40.73 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.56 -178.817 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 95.0 mttt -64.35 147.9 51.56 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.933 0.397 . . . . 0.0 110.759 179.599 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 69.8 mmtt -81.63 8.0 10.89 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.261 -179.83 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 80.5 tt0 -61.11 -33.81 73.97 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.128 179.801 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.46 ' H ' HG22 ' A' ' 95' ' ' VAL . 2.9 m -67.89 137.39 24.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.284 -0.417 . . . . 0.0 110.184 179.872 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 96' ' ' ASN . . . . . 0.487 ' ND2' ' N ' ' A' ' 96' ' ' ASN . 0.0 OUTLIER -81.07 176.23 4.04 Favored Pre-proline 0 C--N 1.328 -0.354 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.93 -179.369 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 97' ' ' PRO . . . . . 0.401 ' C ' ' N ' ' A' ' 99' ' ' VAL . 34.7 Cg_exo -57.95 -13.32 14.76 Favored 'Trans proline' 0 N--CA 1.495 1.606 0 C-N-CA 122.551 2.168 . . . . 0.0 112.268 179.428 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 98' ' ' GLN . . . . . 0.482 ' OE1' ' H71' ' A' ' 201' ' ' MYR . 6.0 pt20 -46.67 -21.09 0.16 Allowed 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.785 -179.577 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 99' ' ' VAL . . . . . 0.401 ' N ' ' C ' ' A' ' 97' ' ' PRO . 94.4 t -63.28 -48.09 89.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 C-N-CA 120.725 -0.39 . . . . 0.0 110.801 179.927 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 100' ' ' MET . . . . . 0.456 ' O ' HG23 ' A' ' 103' ' ' VAL . 62.6 ttp -77.65 -36.98 50.88 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.445 179.844 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -61.98 -23.64 66.52 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.772 -179.741 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -60.59 -16.46 38.35 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.623 -179.831 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.456 HG23 ' O ' ' A' ' 100' ' ' MET . 95.5 t -62.46 -22.61 30.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.385 -0.371 . . . . 0.0 110.413 179.919 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -62.01 -38.88 90.33 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.712 179.94 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 27.1 mt-30 47.92 -116.5 0.77 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.565 -179.976 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 89.7 m -115.4 126.22 54.11 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.248 179.878 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 86.3 mt-10 -77.98 172.64 13.19 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.244 -179.557 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 108' ' ' GLU . . . . . 0.481 ' O ' ' N ' ' A' ' 110' ' ' LEU . 94.8 mt-10 -106.2 124.42 49.56 Favored 'General case' 0 CA--C 1.513 -0.451 0 N-CA-C 109.85 -0.426 . . . . 0.0 109.85 179.129 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 45.7 pt -48.66 -13.16 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.971 179.76 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.481 ' N ' ' O ' ' A' ' 108' ' ' GLU . 33.0 mt -65.25 -42.22 93.5 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.596 179.778 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 111' ' ' LYS . . . . . 0.472 ' HZ1' ' CE1' ' A' ' 121' ' ' HIS . 88.6 tttt -69.01 -38.64 79.34 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.929 -179.988 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 60.2 m -58.86 -43.63 90.88 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.835 -179.369 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 24.4 t-20 -66.76 -43.4 84.17 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.473 179.848 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 99.7 p -165.73 156.37 13.34 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.42 179.686 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 87.3 mt-30 -100.96 11.81 38.89 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.767 0.318 . . . . 0.0 110.567 179.81 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 41.0 p -65.58 -35.87 82.11 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.803 -179.797 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 55.2 m-20 -62.2 -47.28 85.16 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.467 -0.333 . . . . 0.0 110.281 -179.714 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.502 HD11 ' O ' ' A' ' 120' ' ' HIS . 48.2 tp -139.33 94.64 2.82 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.4 179.41 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 56.3 mp0 -69.79 -40.49 75.96 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.303 179.904 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 120' ' ' HIS . . . . . 0.502 ' O ' HD11 ' A' ' 118' ' ' LEU . 90.2 m-70 -119.65 144.54 47.1 Favored 'General case' 0 C--O 1.231 0.125 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.954 179.977 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 121' ' ' HIS . . . . . 0.472 ' CE1' ' HZ1' ' A' ' 111' ' ' LYS . 92.2 m-70 -82.11 137.76 34.93 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.737 -179.92 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 17.8 t-80 -83.94 130.88 34.89 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.594 179.678 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 98.2 m-70 -125.07 137.58 54.2 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.455 179.941 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 124' ' ' HIS . . . . . . . . . . . . . 70.2 m80 -58.18 -44.23 87.91 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.564 -179.919 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 97.5 m-70 . . . . . 0 C--O 1.22 -0.493 0 CA-C-O 117.967 -1.016 . . . . 0.0 110.442 179.889 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 201' ' ' MYR . . . . . 0.716 ' H52' ' OE1' ' A' ' 4' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.653 0 N-CA-C 110.912 -0.875 . . . . 0.0 110.912 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 84.5 mt-30 -64.03 -38.73 92.14 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.791 0.329 . . . . 0.0 110.559 -179.998 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.5 ' HB2' ' H31' ' A' ' 201' ' ' MYR . 92.8 mt-10 -55.79 -21.29 18.55 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.567 -179.852 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.445 ' HB2' ' H21' ' A' ' 201' ' ' MYR . 46.5 tp -40.63 -37.22 0.7 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.546 179.951 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 82.5 p -55.72 -38.0 69.18 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.578 179.366 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' GLN . . . . . 0.492 ' N ' ' O ' ' A' ' 4' ' ' GLU . 85.6 mt-30 -65.96 -30.58 71.18 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.523 179.798 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 59.3 t-80 -61.1 -43.69 98.49 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.557 179.695 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -62.11 -43.27 99.21 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.614 179.251 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.502 ' O ' ' CB ' ' A' ' 14' ' ' GLN . 89.1 mtt-85 -65.93 -33.89 76.87 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.54 178.889 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.565 ' CZ ' H143 ' A' ' 201' ' ' MYR . 0.1 OUTLIER -57.69 -43.2 84.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.609 -179.488 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 2.2 t -60.43 -52.31 62.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.546 -178.649 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 80.9 tt0 -78.16 -46.54 20.31 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.545 -178.683 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' GLN . . . . . 0.502 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 65.1 tp60 -59.29 -46.73 87.75 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.594 -178.423 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.793 ' C ' HD13 ' A' ' 15' ' ' LEU . 3.4 tm? -62.37 -51.25 68.33 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.562 -179.159 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -61.19 -37.15 81.95 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.558 -179.522 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 76.0 mt-30 -66.51 -40.3 89.13 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.557 177.832 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.512 ' O ' HG23 ' A' ' 21' ' ' THR . . . -63.04 -19.28 64.23 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.591 178.676 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.484 ' CD1' ' CE2' ' A' ' 82' ' ' TYR . 9.1 mt -86.59 -35.66 19.32 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.597 178.229 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 96.6 mttt -55.03 -42.26 72.4 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.543 -179.702 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.512 HG23 ' O ' ' A' ' 18' ' ' ALA . 0.5 OUTLIER -63.09 -29.2 70.62 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.597 -179.73 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 75.0 mmt-85 -71.91 -7.33 47.86 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.582 179.462 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 105.82 23.96 7.21 Favored Glycine 0 CA--C 1.524 0.641 0 N-CA-C 110.92 -0.872 . . . . 0.0 110.92 179.854 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.643 HG12 ' N ' ' A' ' 25' ' ' LYS . 34.7 t -103.4 168.61 2.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 120.809 0.337 . . . . 0.0 110.579 179.839 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.643 ' N ' HG12 ' A' ' 24' ' ' VAL . 49.1 tttp -130.46 110.56 11.55 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.541 178.807 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.423 ' CG1' ' OD2' ' A' ' 30' ' ' ASP . 2.1 t -128.3 90.56 1.52 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.603 -179.391 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 19.2 pttt -78.56 166.55 22.43 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.555 179.416 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 87.7 m-85 -47.84 -35.69 10.68 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.588 179.812 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -48.98 -22.16 0.81 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.577 179.057 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.465 ' O ' ' CB ' ' A' ' 34' ' ' PHE . 20.3 t0 -66.62 -41.5 88.25 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.511 -179.56 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.541 ' O ' ' CB ' ' A' ' 35' ' ' PHE . 4.0 mp -61.45 -40.82 95.89 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.556 179.217 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 32.5 mt -62.28 -48.01 81.78 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.557 -179.014 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 82.0 tttt -84.82 -53.97 4.99 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.608 -177.469 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' PHE . . . . . 0.465 ' CB ' ' O ' ' A' ' 30' ' ' ASP . 35.4 t80 -56.94 -52.03 66.83 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.597 -177.434 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.541 ' CB ' ' O ' ' A' ' 31' ' ' LEU . 5.5 t80 -61.55 -45.79 92.69 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.534 -177.85 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 91.1 m-20 -65.72 -32.81 74.56 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.585 -179.08 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -65.85 -49.81 66.81 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.533 -178.831 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.605 ' O ' ' N ' ' A' ' 42' ' ' CYS . 26.9 m -72.08 -36.28 56.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.532 -179.037 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -61.97 -29.2 70.09 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.541 -179.354 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 97.5 m-20 -57.99 -47.49 82.85 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.55 -179.148 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.474 ' O ' ' C ' ' A' ' 42' ' ' CYS . 82.7 p -113.9 0.1 14.32 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.59 -178.91 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' CYS . . . . . 0.605 ' N ' ' O ' ' A' ' 38' ' ' VAL . 26.0 p 33.78 61.02 1.86 Allowed Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.595 -179.494 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' PRO . . . . . 0.404 ' HD3' ' N ' ' A' ' 42' ' ' CYS . 58.0 Cg_endo -78.43 -36.61 0.89 Allowed 'Trans proline' 0 C--N 1.305 -1.721 0 C-N-CA 122.816 2.344 . . . . 0.0 112.133 -179.256 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' TRP . . . . . 0.791 ' HE1' ' H ' ' A' ' 52' ' ' ASP . 0.0 OUTLIER -71.73 -2.01 15.94 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.565 -179.755 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.576 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 69.0 m-85 58.1 47.5 2.22 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.58 -179.677 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.576 ' CD ' ' N ' ' A' ' 45' ' ' PHE . 46.9 Cg_exo -38.48 -19.0 0.04 OUTLIER 'Trans proline' 0 C--N 1.305 -1.725 0 C-N-CA 122.837 2.358 . . . . 0.0 112.112 178.248 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.564 ' N ' ' O ' ' A' ' 45' ' ' PHE . 86.5 mt-30 -65.85 -53.64 37.21 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.601 -178.468 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.575 ' O ' ' H51' ' A' ' 201' ' ' MYR . 1.2 tt0 -86.09 -15.77 40.15 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.544 -179.861 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 64.76 84.24 0.08 OUTLIER Glycine 0 CA--C 1.525 0.661 0 N-CA-C 110.97 -0.852 . . . . 0.0 110.97 -179.746 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' THR . . . . . 0.708 ' O ' H132 ' A' ' 201' ' ' MYR . 14.8 t -145.33 171.29 14.8 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.816 0.341 . . . . 0.0 110.537 -179.284 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.2 mt -104.85 134.3 46.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.57 179.277 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' ASP . . . . . 0.791 ' H ' ' HE1' ' A' ' 44' ' ' TRP . 1.7 m-20 -111.93 121.94 46.39 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.536 -179.764 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.439 ' CG1' HD12 ' A' ' 90' ' ' ILE . 33.4 mm -94.6 -56.17 5.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.591 179.578 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -74.99 -51.56 13.34 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.566 -179.391 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.432 ' HA ' ' HE ' ' A' ' 58' ' ' ARG . 84.5 mtt85 -59.26 -29.75 67.78 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.553 -179.042 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' TRP . . . . . 0.585 ' CE3' ' CH2' ' A' ' 44' ' ' TRP . 24.9 t-105 -63.44 -36.96 85.46 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.529 178.923 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 79.3 mtp85 -64.96 -35.37 80.96 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.565 179.217 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' ARG . . . . . 0.432 ' HE ' ' HA ' ' A' ' 55' ' ' ARG . 69.8 mtm180 -60.11 -52.59 64.67 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.621 -179.466 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 2.8 p -65.44 -33.35 63.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.612 -179.86 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -71.22 -38.97 62.94 Favored Glycine 0 CA--C 1.525 0.689 0 N-CA-C 110.944 -0.862 . . . . 0.0 110.944 179.932 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 56.0 t0 -63.36 -48.75 76.65 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.792 0.329 . . . . 0.0 110.554 -179.627 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 99.8 m -64.06 -46.59 83.68 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.553 -179.863 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 6.3 m-85 -63.79 -31.65 72.9 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.6 179.767 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 70.8 tp60 -61.57 -40.22 93.95 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.514 179.647 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 20.6 t0 -63.19 -52.03 63.97 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.561 179.583 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' TYR . . . . . 0.461 ' O ' ' OG1' ' A' ' 69' ' ' THR . 68.8 m-85 -66.81 -32.06 73.1 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.579 179.743 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 63.9 t80 -60.41 -43.37 96.76 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.525 179.388 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 99.0 m-20 -65.65 -38.68 90.03 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.526 -179.863 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.461 ' OG1' ' O ' ' A' ' 66' ' ' TYR . 62.0 p -64.91 -22.59 67.02 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.568 -179.571 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -72.21 -42.58 65.61 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.561 179.938 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 71' ' ' GLY . . . . . 0.531 ' H ' ' HD3' ' A' ' 72' ' ' PRO . . . 110.24 72.34 0.69 Allowed Glycine 0 CA--C 1.525 0.715 0 N-CA-C 110.925 -0.87 . . . . 0.0 110.925 179.139 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 72' ' ' PRO . . . . . 0.531 ' HD3' ' H ' ' A' ' 71' ' ' GLY . 16.4 Cg_exo -67.4 147.28 77.33 Favored 'Trans proline' 0 C--N 1.305 -1.728 0 C-N-CA 122.746 2.297 . . . . 0.0 112.124 178.108 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 99.1 mt-10 -76.92 -51.13 11.74 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.546 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.527 ' HD3' ' H ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -140.44 5.59 2.05 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.547 -179.609 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 55.5 t 56.46 91.69 0.07 OUTLIER Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.57 -179.808 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_exo -55.26 122.64 12.08 Favored 'Trans proline' 0 C--N 1.305 -1.732 0 C-N-CA 122.845 2.363 . . . . 0.0 112.146 -179.011 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.44 ' O ' HG12 ' A' ' 77' ' ' VAL . 98.0 t -86.25 -13.49 10.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.539 -179.536 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 81.0 p -44.01 -23.74 0.11 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.601 -179.587 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' ALA . . . . . 0.401 ' N ' ' O ' ' A' ' 77' ' ' VAL . . . -55.41 -40.61 71.65 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.61 179.794 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 41.1 t80 -63.02 -38.35 90.83 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.604 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 19.6 m -59.05 -41.86 88.93 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.6 -179.511 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' TYR . . . . . 0.484 ' CE2' ' CD1' ' A' ' 19' ' ' LEU . 13.0 m-85 -59.66 -51.65 68.89 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.533 -179.952 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 83' ' ' TRP . . . . . 0.431 ' O ' ' CB ' ' A' ' 87' ' ' LYS . 80.9 t90 -56.66 -40.25 75.16 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.522 -179.69 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 71.8 m-20 -59.92 -46.37 89.58 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.542 -179.883 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.407 ' O ' ' HG3' ' A' ' 88' ' ' GLU . 26.1 tp -71.8 -63.34 1.15 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.57 179.674 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -47.57 -26.77 1.06 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.584 179.11 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.431 ' CB ' ' O ' ' A' ' 83' ' ' TRP . 59.6 tttt -68.03 -49.97 58.22 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.564 -179.536 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 88' ' ' GLU . . . . . 0.488 ' OE1' ' O ' ' A' ' 88' ' ' GLU . 1.0 OUTLIER -79.74 -19.59 48.39 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.565 -179.924 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.586 ' O ' HD13 ' A' ' 89' ' ' LEU . 0.2 OUTLIER -60.92 -49.15 78.61 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.573 -179.509 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.439 HD12 ' CG1' ' A' ' 53' ' ' ILE . 3.1 mt -63.66 -42.6 96.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.53 179.726 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 65.0 t0 -57.16 -45.87 83.24 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.555 -178.931 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 78.8 mttt -57.12 136.79 56.39 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.568 -179.546 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 58.6 mttp -69.81 -4.34 19.64 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.582 179.857 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -73.4 47.65 0.23 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.573 -179.871 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 21.4 m -121.82 163.98 19.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.581 179.81 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 96' ' ' ASN . . . . . 0.459 ' CB ' ' CD ' ' A' ' 97' ' ' PRO . 0.0 OUTLIER -97.31 176.75 1.92 Allowed Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.58 -179.896 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 97' ' ' PRO . . . . . 0.459 ' CD ' ' CB ' ' A' ' 96' ' ' ASN . 37.9 Cg_exo -59.55 -22.49 66.9 Favored 'Trans proline' 0 C--N 1.305 -1.744 0 C-N-CA 122.839 2.359 . . . . 0.0 112.109 179.688 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 98' ' ' GLN . . . . . 0.549 ' NE2' ' H91' ' A' ' 201' ' ' MYR . 5.7 pt20 -45.64 -26.54 0.63 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.579 -179.766 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 69.4 t -62.63 -48.62 87.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.569 179.917 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 98.7 mtp -76.77 -40.29 48.78 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.546 179.588 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -65.26 -25.42 67.65 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.574 -179.088 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -64.62 -14.36 57.63 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.565 -179.689 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 49.9 t -62.67 -21.64 28.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.528 179.752 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -54.65 -26.72 34.93 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.57 -179.953 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 81.9 mt-30 -109.35 49.79 0.81 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.579 179.781 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 98.0 m -63.78 -44.79 92.31 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.573 179.895 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 107' ' ' GLU . . . . . 0.436 ' OE2' ' O ' ' A' ' 113' ' ' ASN . 90.2 mt-10 -74.95 -178.27 3.69 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.547 -179.813 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 108' ' ' GLU . . . . . 0.553 ' C ' ' H ' ' A' ' 110' ' ' LEU . 80.7 mm-40 -102.87 128.56 49.6 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.571 179.256 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 40.7 pt -56.37 -0.78 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.613 -179.803 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.553 ' H ' ' C ' ' A' ' 108' ' ' GLU . 94.9 mt -89.33 -2.33 58.4 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.592 179.969 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 84.6 tttt -141.8 154.44 45.21 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.555 -179.747 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 5.5 p -60.69 173.3 0.76 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.546 -179.791 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 113' ' ' ASN . . . . . 0.436 ' O ' ' OE2' ' A' ' 107' ' ' GLU . 70.6 m-20 -62.45 -38.5 90.01 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.566 -179.628 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 114' ' ' SER . . . . . 0.483 ' O ' ' O ' ' A' ' 115' ' ' GLN . 11.6 m -68.77 138.82 55.14 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.599 -179.705 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 115' ' ' GLN . . . . . 0.483 ' O ' ' O ' ' A' ' 114' ' ' SER . 33.7 mt-30 56.95 148.57 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.556 -179.624 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 116' ' ' THR . . . . . 0.508 ' O ' ' N ' ' A' ' 118' ' ' LEU . 21.5 p -84.17 170.59 13.63 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.581 179.472 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 117' ' ' ASP . . . . . 0.481 ' C ' ' O ' ' A' ' 116' ' ' THR . 58.6 t0 -33.75 -33.94 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.588 179.894 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.508 ' N ' ' O ' ' A' ' 116' ' ' THR . 67.1 mt -102.53 128.46 49.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.555 179.476 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 82.6 tt0 -67.75 -35.83 79.45 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.594 -179.933 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 80.7 m80 -112.67 145.39 40.53 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.566 -179.846 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 69.9 m80 -111.81 142.33 44.31 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.561 179.924 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 94.9 m-70 -63.95 -39.1 93.37 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.551 179.9 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 80.5 m80 -62.52 -45.75 91.56 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.571 179.769 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 124' ' ' HIS . . . . . . . . . . . . . 73.0 m80 -126.15 126.18 43.7 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.571 179.849 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 72.5 m80 . . . . . 0 C--O 1.221 -0.432 0 CA-C-O 117.995 -1.002 . . . . 0.0 110.612 179.994 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 201' ' ' MYR . . . . . 0.708 H132 ' O ' ' A' ' 50' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.632 0 N-CA-C 111.104 -0.798 . . . . 0.0 111.104 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 88.6 mt-30 -58.94 -31.39 68.65 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.874 0.368 . . . . 0.0 110.407 -179.723 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 69.7 mm-40 -65.32 -24.53 67.3 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.681 179.545 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.499 ' N ' ' H21' ' A' ' 201' ' ' MYR . 37.4 tp -43.06 -33.08 0.77 Allowed 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.245 0.545 . . . . 0.0 110.307 -179.553 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 68.1 m -53.67 -41.27 66.69 Favored 'General case' 0 C--N 1.324 -0.526 0 C-N-CA 120.486 -0.486 . . . . 0.0 110.123 179.912 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' GLN . . . . . 0.467 ' OE1' ' CG ' ' A' ' 97' ' ' PRO . 86.6 mt-30 -61.93 -34.16 75.58 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.827 179.703 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' HIS . . . . . 0.438 ' ND1' ' H91' ' A' ' 201' ' ' MYR . 73.9 t60 -57.1 -41.81 79.6 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.974 0.416 . . . . 0.0 109.952 -179.982 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 96.2 mt-10 -62.5 -43.38 98.95 Favored 'General case' 0 C--O 1.238 0.482 0 C-N-CA 120.357 -0.537 . . . . 0.0 110.026 179.566 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.446 ' O ' ' CB ' ' A' ' 14' ' ' GLN . 62.6 mtp180 -65.16 -33.18 75.39 Favored 'General case' 0 C--O 1.208 -1.096 0 CA-C-N 116.038 -0.528 . . . . 0.0 109.58 179.668 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.638 ' CE1' H143 ' A' ' 201' ' ' MYR . 0.0 OUTLIER -58.4 -44.6 89.04 Favored 'General case' 0 C--N 1.322 -0.588 0 C-N-CA 120.77 -0.372 . . . . 0.0 110.62 -179.54 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 13.4 t -61.62 -48.83 86.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 C-N-CA 120.433 -0.507 . . . . 0.0 111.892 -179.863 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.414 ' OE2' HD11 ' A' ' 31' ' ' LEU . 70.0 mm-40 -76.02 -41.79 49.89 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.291 0.567 . . . . 0.0 111.428 -179.649 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' GLN . . . . . 0.446 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 66.6 tp60 -62.07 -50.4 72.11 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.498 -179.189 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.57 HD13 ' O ' ' A' ' 15' ' ' LEU . 0.3 OUTLIER -63.97 -49.17 73.58 Favored 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 120.303 -0.559 . . . . 0.0 109.99 179.828 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 94.9 mttt -58.93 -34.44 71.74 Favored 'General case' 0 C--N 1.324 -0.525 0 C-N-CA 120.707 -0.397 . . . . 0.0 110.729 -179.683 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 91.1 mt-30 -78.58 -36.2 44.79 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.864 179.633 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -56.39 -34.63 66.89 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.932 -0.576 . . . . 0.0 109.929 -179.749 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.472 ' O ' ' N ' ' A' ' 22' ' ' ARG . 3.7 mt -85.16 -35.06 21.96 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.156 0.503 . . . . 0.0 110.461 179.231 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 65.1 tttm -45.95 -41.68 11.94 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.478 -178.642 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.404 ' H ' HG22 ' A' ' 21' ' ' THR . 0.2 OUTLIER -75.71 -16.06 60.21 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.747 -179.942 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.472 ' N ' ' O ' ' A' ' 19' ' ' LEU . 86.2 mmt-85 -83.56 13.21 4.74 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 120.828 0.347 . . . . 0.0 110.28 -179.881 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 97.32 4.94 58.24 Favored Glycine 0 CA--C 1.522 0.512 0 N-CA-C 110.915 -0.874 . . . . 0.0 110.915 179.671 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.599 HG12 ' N ' ' A' ' 25' ' ' LYS . 15.7 t -93.5 169.33 1.38 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 C-N-CA 121.094 -0.242 . . . . 0.0 110.469 -179.798 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.599 ' N ' HG12 ' A' ' 24' ' ' VAL . 99.4 mttt -134.41 134.46 41.66 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.24 179.654 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 8.9 m -131.03 129.86 63.53 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.288 0 CA-C-N 116.601 -0.272 . . . . 0.0 110.268 179.812 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.4 ' HD2' ' HB3' ' A' ' 29' ' ' ALA . 16.0 pttp -110.13 163.59 13.45 Favored 'General case' 0 C--O 1.226 -0.134 0 CA-C-O 120.652 0.263 . . . . 0.0 110.585 179.771 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 98.0 m-85 -56.51 -34.75 67.3 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.021 0.439 . . . . 0.0 110.267 179.858 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.512 ' HA ' HD12 ' A' ' 32' ' ' LEU . . . -51.93 -23.32 4.8 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.236 179.708 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.487 ' O ' ' CB ' ' A' ' 34' ' ' PHE . 97.3 m-20 -62.2 -49.99 73.59 Favored 'General case' 0 C--O 1.219 -0.531 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.311 -179.547 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.433 ' O ' ' CB ' ' A' ' 35' ' ' PHE . 3.7 mp -63.32 -38.3 90.63 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 121.224 0.535 . . . . 0.0 109.837 179.565 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.512 HD12 ' HA ' ' A' ' 29' ' ' ALA . 42.9 mt -61.1 -51.32 69.63 Favored 'General case' 0 C--N 1.308 -1.199 0 C-N-CA 119.106 -1.038 . . . . 0.0 111.435 -179.068 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.408 ' O ' ' OD1' ' A' ' 36' ' ' ASP . 87.1 tttt -88.07 -54.18 4.35 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 112.864 0.691 . . . . 0.0 112.864 -178.287 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' PHE . . . . . 0.487 ' CB ' ' O ' ' A' ' 30' ' ' ASP . 9.7 t80 -53.48 -47.75 69.52 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.427 -178.093 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.433 ' CB ' ' O ' ' A' ' 31' ' ' LEU . 1.1 t80 -62.89 -48.88 77.07 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 120.348 -0.541 . . . . 0.0 110.341 179.978 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' ASP . . . . . 0.408 ' OD1' ' O ' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -62.94 -34.3 77.19 Favored 'General case' 0 C--O 1.234 0.282 0 C-N-CA 119.554 -0.858 . . . . 0.0 111.816 -179.052 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.439 ' O ' ' OG1' ' A' ' 41' ' ' THR . 3.2 t80 -62.15 -47.12 85.94 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.226 -178.734 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.505 ' O ' ' N ' ' A' ' 42' ' ' CYS . 29.8 m -71.17 -26.27 26.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.528 -179.47 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 24.4 mttt -61.22 -45.55 94.11 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 120.465 -0.494 . . . . 0.0 110.89 -179.584 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 89.3 m-20 -75.88 -50.55 14.74 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 120.549 -0.46 . . . . 0.0 111.41 -179.835 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.439 ' OG1' ' O ' ' A' ' 37' ' ' PHE . 1.6 p -70.27 -34.74 73.16 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.443 -179.501 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' CYS . . . . . 0.505 ' N ' ' O ' ' A' ' 38' ' ' VAL . 48.6 m 47.09 53.14 13.36 Favored Pre-proline 0 C--N 1.331 -0.219 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.416 -178.45 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' PRO . . . . . 0.464 ' HD3' ' N ' ' A' ' 42' ' ' CYS . 68.6 Cg_endo -79.22 -33.21 1.48 Allowed 'Trans proline' 0 N--CA 1.488 1.165 0 C-N-CA 122.507 2.138 . . . . 0.0 112.463 -179.608 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' TRP . . . . . 0.882 ' CE2' H141 ' A' ' 201' ' ' MYR . 0.0 OUTLIER -87.86 20.12 3.21 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.971 -179.27 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.428 ' C ' ' H ' ' A' ' 47' ' ' GLN . 59.4 m-85 48.21 59.61 16.58 Favored Pre-proline 0 C--N 1.33 -0.277 0 C-N-CA 120.455 -0.498 . . . . 0.0 109.972 179.917 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo -51.82 -7.76 0.25 Allowed 'Trans proline' 0 C--N 1.312 -1.371 0 C-N-CA 122.893 2.395 . . . . 0.0 112.333 179.867 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.428 ' H ' ' C ' ' A' ' 45' ' ' PHE . 87.8 mt-30 -71.32 -54.37 11.04 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.635 -179.849 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.724 ' O ' ' H51' ' A' ' 201' ' ' MYR . 12.5 pt-20 -88.76 -28.59 20.39 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.576 179.254 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' GLY . . . . . 0.594 ' CA ' ' H92' ' A' ' 201' ' ' MYR . . . 79.12 66.8 1.66 Allowed Glycine 0 CA--C 1.525 0.696 0 N-CA-C 110.661 -0.976 . . . . 0.0 110.661 -179.615 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' THR . . . . . 0.509 ' O ' H132 ' A' ' 201' ' ' MYR . 15.3 t -127.93 169.13 14.32 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.827 0.346 . . . . 0.0 111.012 -179.361 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.2 mt -98.88 132.08 44.85 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.253 0 CA-C-N 116.094 -0.503 . . . . 0.0 109.901 179.418 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' ASP . . . . . 0.676 ' H ' ' HE1' ' A' ' 44' ' ' TRP . 5.6 t0 -116.54 119.08 34.46 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.008 179.012 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 17.8 mm -82.98 -25.41 8.13 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.035 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -85.81 -57.18 3.15 Favored 'General case' 0 C--O 1.239 0.523 0 CA-C-O 121.471 0.653 . . . . 0.0 111.442 -179.116 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 95.7 mtt-85 -60.72 -33.27 72.64 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.396 -179.342 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' TRP . . . . . 0.629 ' CE3' ' CH2' ' A' ' 44' ' ' TRP . 34.2 t-105 -57.85 -37.7 74.35 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.114 0.483 . . . . 0.0 110.265 179.96 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 85.0 mtp180 -64.58 -37.94 89.3 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.183 179.79 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 41.2 ttm180 -60.95 -51.62 68.51 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 120.447 -0.501 . . . . 0.0 111.049 -179.551 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 6.9 p -68.85 -38.43 78.69 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.425 0 CA-C-O 120.896 0.379 . . . . 0.0 110.218 179.404 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -64.5 -39.05 96.53 Favored Glycine 0 CA--C 1.525 0.68 0 N-CA-C 111.135 -0.786 . . . . 0.0 111.135 179.689 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' ASP . . . . . 0.422 ' O ' ' OD1' ' A' ' 61' ' ' ASP . 64.0 t0 -62.64 -38.29 89.69 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.876 0.369 . . . . 0.0 110.326 -179.962 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 75.8 m -61.95 -38.42 88.44 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.447 -179.893 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 5.5 m-85 -62.71 -37.75 87.73 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.358 179.89 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 57.6 tt0 -63.11 -42.1 99.5 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.963 -179.898 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 62.2 t0 -60.22 -52.0 67.17 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.055 0.455 . . . . 0.0 110.456 -179.925 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 55.0 m-85 -62.2 -39.52 93.02 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.414 179.811 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 9.8 t80 -62.1 -40.53 96.18 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.291 179.818 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 88.3 m-20 -57.33 -32.72 67.0 Favored 'General case' 0 CA--C 1.518 -0.269 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.046 -179.27 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 25.0 p -65.64 -20.47 66.31 Favored 'General case' 0 C--N 1.317 -0.816 0 C-N-CA 119.748 -0.781 . . . . 0.0 110.034 179.281 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 69.7 m-85 -107.34 -51.45 2.91 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 116.024 -0.534 . . . . 0.0 112.399 -179.738 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -142.46 78.11 0.28 Allowed Glycine 0 CA--C 1.539 1.54 0 N-CA-C 111.074 -0.811 . . . . 0.0 111.074 -179.292 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' PRO . . . . . 0.412 ' O ' HG23 ' A' ' 75' ' ' VAL . 56.8 Cg_endo -75.98 -16.14 18.26 Favored 'Trans proline' 0 C--N 1.298 -2.093 0 C-N-CA 122.831 2.354 . . . . 0.0 111.735 -179.672 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 77.4 mm-40 -89.47 -38.39 14.09 Favored 'General case' 0 CA--C 1.505 -0.774 0 CA-C-O 121.567 0.699 . . . . 0.0 110.585 179.798 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 51.5 mmtt -65.48 -46.09 81.1 Favored 'General case' 0 C--N 1.308 -1.213 0 CA-C-N 114.82 -1.082 . . . . 0.0 111.123 -178.199 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.555 ' O ' HG12 ' A' ' 75' ' ' VAL . 54.6 t 38.51 84.06 0.19 Allowed Pre-proline 0 N--CA 1.451 -0.406 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.115 179.492 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_exo -55.41 126.86 23.92 Favored 'Trans proline' 0 C--N 1.311 -1.436 0 C-N-CA 121.925 1.75 . . . . 0.0 111.373 -179.629 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 58.0 t -82.08 -17.17 11.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.513 -179.936 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 22.6 p -48.19 -26.46 1.93 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.176 -179.35 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.27 -41.24 98.3 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.179 0.514 . . . . 0.0 110.583 179.661 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 8.4 m-85 -62.69 -37.31 85.96 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.346 179.829 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 59.9 m -58.58 -40.62 83.68 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.309 179.745 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 5.1 m-85 -59.67 -50.83 72.34 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.722 -179.675 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' TRP . . . . . 0.539 ' N ' ' CD1' ' A' ' 83' ' ' TRP . 6.1 m0 -59.8 -38.26 81.41 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.595 -179.881 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 92.9 m-20 -62.09 -45.28 94.18 Favored 'General case' 0 C--N 1.325 -0.457 0 C-N-CA 120.581 -0.447 . . . . 0.0 110.79 -179.339 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 56.7 tp -71.91 -53.99 11.42 Favored 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 120.341 -0.544 . . . . 0.0 110.5 179.87 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -58.54 -25.16 27.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 C-N-CA 120.766 -0.374 . . . . 0.0 110.483 179.884 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.401 ' CB ' ' O ' ' A' ' 83' ' ' TRP . 67.1 tttt -65.39 -50.24 66.25 Favored 'General case' 0 C--N 1.321 -0.672 0 C-N-CA 120.348 -0.541 . . . . 0.0 110.306 -179.79 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 88' ' ' GLU . . . . . 0.415 ' OE1' ' O ' ' A' ' 88' ' ' GLU . 1.0 OUTLIER -80.54 -20.84 42.59 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.782 -179.912 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.412 HD12 ' HA ' ' A' ' 89' ' ' LEU . 12.4 tp -62.15 -45.16 94.64 Favored 'General case' 0 N--CA 1.448 -0.57 0 C-N-CA 120.316 -0.554 . . . . 0.0 110.438 -178.686 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.482 ' O ' ' N ' ' A' ' 92' ' ' LYS . 2.9 mt -65.02 -43.63 96.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 C-N-CA 120.334 -0.547 . . . . 0.0 109.955 179.943 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 98.0 m-20 -47.03 -14.06 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.791 -178.199 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' LYS . . . . . 0.482 ' N ' ' O ' ' A' ' 90' ' ' ILE . 86.4 tttt -68.58 133.9 49.2 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.371 179.92 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -64.46 -41.41 96.53 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.942 -179.939 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 99.1 mt-10 -105.79 55.17 0.68 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.053 -179.664 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.515 ' O ' ' ND2' ' A' ' 96' ' ' ASN . 6.9 t -45.27 -75.48 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.497 -179.476 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 96' ' ' ASN . . . . . 0.515 ' ND2' ' O ' ' A' ' 95' ' ' VAL . 0.9 OUTLIER -153.74 160.54 30.82 Favored Pre-proline 0 C--N 1.326 -0.431 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.738 179.979 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 97' ' ' PRO . . . . . 0.467 ' CG ' ' OE1' ' A' ' 7' ' ' GLN . 16.3 Cg_endo -56.83 -11.89 8.07 Favored 'Trans proline' 0 N--CA 1.495 1.602 0 C-N-CA 122.959 2.439 . . . . 0.0 112.059 178.751 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 98' ' ' GLN . . . . . 0.435 HE21 ' HB3' ' A' ' 98' ' ' GLN . 0.2 OUTLIER -45.88 -18.63 0.05 OUTLIER 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.999 -179.758 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 99' ' ' VAL . . . . . 0.445 ' N ' ' C ' ' A' ' 97' ' ' PRO . 64.3 t -61.6 -47.69 92.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 C-N-CA 120.617 -0.433 . . . . 0.0 110.655 -179.904 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 97.6 mmm -80.31 -42.66 22.61 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.809 179.948 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -60.86 -26.1 67.14 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.401 -179.652 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -64.55 -15.46 61.0 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.423 179.934 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 74.9 t -62.03 -41.21 90.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.37 179.81 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -53.96 -51.38 64.03 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.851 -179.662 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 85.9 mt-30 -133.6 134.76 43.67 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.324 179.877 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 106' ' ' THR . . . . . 0.415 ' O ' ' O ' ' A' ' 107' ' ' GLU . 4.9 t -146.45 157.48 43.76 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.634 -179.86 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 107' ' ' GLU . . . . . 0.415 ' O ' ' O ' ' A' ' 106' ' ' THR . 75.4 mm-40 44.39 -169.37 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.343 179.856 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 108' ' ' GLU . . . . . 0.513 ' O ' ' N ' ' A' ' 110' ' ' LEU . 93.0 mt-10 -109.07 122.16 46.67 Favored 'General case' 0 CA--C 1.515 -0.393 0 N-CA-C 109.697 -0.483 . . . . 0.0 109.697 179.387 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 44.0 pt -47.69 -12.43 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.14 179.573 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.513 ' N ' ' O ' ' A' ' 108' ' ' GLU . 31.5 mt -66.25 -41.95 89.25 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.812 179.615 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -66.12 -36.0 81.98 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.479 -179.899 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 45.9 m -57.7 -45.44 85.68 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.684 -179.289 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 29.6 t30 -65.56 -43.33 90.2 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.637 179.676 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 20.8 m -166.06 150.94 8.28 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.559 179.663 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 87.4 mt-30 -91.09 18.8 6.35 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.487 179.715 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 15.3 p -60.16 -47.42 85.99 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.495 -179.809 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 94.8 m-20 -63.86 -42.83 97.46 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.539 179.684 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 36.4 tp -132.95 117.03 17.17 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.27 179.836 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -107.82 142.73 37.42 Favored 'General case' 0 C--N 1.333 -0.114 0 CA-C-O 120.771 0.32 . . . . 0.0 110.329 179.589 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 85.5 t60 -100.13 129.15 46.13 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.431 -179.92 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 73.0 m80 -108.32 151.4 26.04 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.368 -179.944 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 52.3 m-70 -113.6 138.48 50.11 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.325 -179.826 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 78.2 m80 -117.29 146.51 43.28 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.304 -179.91 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 124' ' ' HIS . . . . . . . . . . . . . 79.9 t60 -111.93 117.42 32.69 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.498 -179.946 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 77.6 m80 . . . . . 0 C--O 1.22 -0.456 0 CA-C-O 117.985 -1.007 . . . . 0.0 110.49 -179.861 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 201' ' ' MYR . . . . . 0.882 H141 ' CE2' ' A' ' 44' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.875 0 N-CA-C 111.142 -0.783 . . . . 0.0 111.142 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 87.1 mt-30 -59.3 -27.05 65.51 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.952 0.406 . . . . 0.0 110.389 -179.925 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.534 ' OE1' ' H52' ' A' ' 201' ' ' MYR . 82.2 tt0 -53.9 -21.48 7.9 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.613 179.862 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 34.5 tp -40.19 -29.59 0.08 Allowed 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 120.959 0.409 . . . . 0.0 110.418 -179.321 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 78.3 p -55.38 -38.6 69.07 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 120.586 -0.446 . . . . 0.0 110.078 179.947 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 99.7 mm-40 -62.28 -37.23 84.71 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.585 179.64 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 75.1 t60 -57.24 -42.29 81.21 Favored 'General case' 0 C--N 1.332 -0.169 0 N-CA-C 109.91 -0.404 . . . . 0.0 109.91 -179.854 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 81.2 mm-40 -60.11 -45.63 92.32 Favored 'General case' 0 C--O 1.243 0.726 0 CA-C-O 121.208 0.528 . . . . 0.0 109.873 179.318 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.415 ' O ' ' CB ' ' A' ' 14' ' ' GLN . 70.3 mtp180 -64.87 -33.34 75.78 Favored 'General case' 0 C--O 1.212 -0.912 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 179.327 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.574 ' CE1' HD23 ' A' ' 15' ' ' LEU . 49.0 t80 -59.37 -38.17 79.78 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 120.217 -0.593 . . . . 0.0 110.3 -179.295 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 3.4 t -62.07 -50.01 81.8 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 C-N-CA 119.774 -0.77 . . . . 0.0 111.37 179.974 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 97.3 mt-10 -79.38 -35.86 40.12 Favored 'General case' 0 C--N 1.322 -0.587 0 C-N-CA 120.232 -0.587 . . . . 0.0 112.061 -179.082 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' GLN . . . . . 0.415 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 66.2 tp60 -68.71 -51.68 39.04 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.527 -179.005 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.574 HD23 ' CE1' ' A' ' 11' ' ' TYR . 0.2 OUTLIER -63.35 -46.43 86.62 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.343 -179.518 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -57.76 -31.95 67.0 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 178.838 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 49.2 tt0 -75.24 -39.45 59.92 Favored 'General case' 0 C--O 1.239 0.552 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.198 178.879 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.417 ' O ' HG23 ' A' ' 21' ' ' THR . . . -58.07 -25.06 60.79 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-N 115.933 -0.576 . . . . 0.0 109.725 179.536 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.448 ' O ' ' N ' ' A' ' 22' ' ' ARG . 3.7 mt -85.36 -40.73 16.17 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.199 178.581 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 92.9 mttt -43.24 -45.69 5.86 Favored 'General case' 0 N--CA 1.464 0.273 0 C-N-CA 120.353 -0.539 . . . . 0.0 111.035 -179.2 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.49 ' C ' ' H ' ' A' ' 23' ' ' GLY . 0.2 OUTLIER -63.62 -31.38 72.53 Favored 'General case' 0 C--N 1.324 -0.535 0 C-N-CA 120.467 -0.493 . . . . 0.0 110.758 -179.812 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.448 ' N ' ' O ' ' A' ' 19' ' ' LEU . 80.1 mmt-85 -69.05 10.24 0.32 Allowed 'General case' 0 C--O 1.232 0.18 0 C-N-CA 120.795 -0.362 . . . . 0.0 110.457 -179.745 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' GLY . . . . . 0.49 ' H ' ' C ' ' A' ' 21' ' ' THR . . . 91.52 22.49 31.4 Favored Glycine 0 N--CA 1.467 0.736 0 N-CA-C 111.162 -0.775 . . . . 0.0 111.162 179.738 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.642 HG12 ' N ' ' A' ' 25' ' ' LYS . 39.8 t -105.27 168.27 2.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-O 120.63 0.253 . . . . 0.0 110.575 -179.882 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.642 ' N ' HG12 ' A' ' 24' ' ' VAL . 98.9 mttt -134.96 105.15 6.25 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.171 179.356 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.491 ' CG1' ' OD2' ' A' ' 30' ' ' ASP . 1.7 t -117.92 93.66 2.67 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.443 0 C-N-CA 120.895 -0.322 . . . . 0.0 110.765 -179.656 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 25.5 pttt -81.43 165.22 21.47 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.711 179.619 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 98.0 m-85 -48.21 -31.83 6.33 Favored 'General case' 0 C--O 1.241 0.614 0 CA-C-O 121.254 0.55 . . . . 0.0 110.647 179.895 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -54.43 -23.22 15.05 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.012 179.552 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.491 ' OD2' ' CG1' ' A' ' 26' ' ' VAL . 21.4 t0 -65.11 -42.0 94.4 Favored 'General case' 0 C--O 1.218 -0.567 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.894 -179.54 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.482 ' O ' ' CB ' ' A' ' 35' ' ' PHE . 4.7 mp -65.16 -40.58 94.55 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-O 121.029 0.443 . . . . 0.0 109.856 -179.866 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 40.7 mt -58.91 -46.35 88.11 Favored 'General case' 0 C--N 1.312 -1.064 0 C-N-CA 119.34 -0.944 . . . . 0.0 111.086 -178.216 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.411 ' O ' ' CD1' ' A' ' 37' ' ' PHE . 83.3 tttt -85.67 -49.99 7.54 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.896 -178.889 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' PHE . . . . . 0.44 ' CB ' ' O ' ' A' ' 30' ' ' ASP . 49.7 t80 -61.51 -50.75 71.44 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.206 -178.742 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.482 ' CB ' ' O ' ' A' ' 31' ' ' LEU . 5.4 t80 -61.6 -46.79 88.33 Favored 'General case' 0 C--N 1.33 -0.264 0 O-C-N 123.325 0.391 . . . . 0.0 110.241 -179.152 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 93.1 m-20 -63.44 -38.31 90.64 Favored 'General case' 0 C--N 1.34 0.167 0 C-N-CA 120.597 -0.441 . . . . 0.0 111.224 -179.431 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.411 ' CD1' ' O ' ' A' ' 33' ' ' LYS . 2.8 m-85 -61.09 -46.49 90.41 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.487 -178.929 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.524 ' O ' ' N ' ' A' ' 42' ' ' CYS . 27.6 m -76.87 -37.29 27.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 C-N-CA 120.307 -0.557 . . . . 0.0 110.425 -179.779 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 61.5 tttm -56.49 -29.25 61.57 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.763 -179.627 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 66.4 t0 -49.73 -62.43 1.56 Allowed 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.748 -0.381 . . . . 0.0 111.138 -179.446 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 17.2 p -115.21 1.1 13.74 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 116.529 -0.305 . . . . 0.0 111.562 -179.84 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' CYS . . . . . 0.524 ' N ' ' O ' ' A' ' 38' ' ' VAL . 2.2 m 40.49 59.25 7.72 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.434 -178.479 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' PRO . . . . . 0.483 ' HD3' ' N ' ' A' ' 42' ' ' CYS . 9.1 Cg_exo -67.75 -29.65 35.31 Favored 'Trans proline' 0 N--CA 1.496 1.668 0 C-N-CA 122.442 2.094 . . . . 0.0 112.568 -179.415 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' TRP . . . . . 0.535 ' HE1' ' H ' ' A' ' 52' ' ' ASP . 0.0 OUTLIER -64.75 0.47 1.14 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.827 -179.272 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.487 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 45.9 t80 45.25 52.25 10.29 Favored Pre-proline 0 C--N 1.327 -0.395 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.078 -179.789 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.487 ' CD ' ' N ' ' A' ' 45' ' ' PHE . 19.8 Cg_endo -59.23 -7.17 4.64 Favored 'Trans proline' 0 C--N 1.307 -1.627 0 C-N-CA 122.965 2.443 . . . . 0.0 112.176 179.804 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 99.3 mm-40 -51.22 -54.38 26.2 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 120.534 -0.466 . . . . 0.0 110.167 -179.491 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.504 ' O ' ' H51' ' A' ' 201' ' ' MYR . 40.6 tt0 -89.65 -13.36 37.21 Favored 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 120.737 -0.385 . . . . 0.0 110.697 179.028 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' GLY . . . . . 0.685 ' O ' ' H71' ' A' ' 201' ' ' MYR . . . 77.32 71.58 1.19 Allowed Glycine 0 CA--C 1.522 0.53 0 N-CA-C 110.474 -1.051 . . . . 0.0 110.474 -179.318 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 1.7 t -137.22 162.99 31.97 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 121.052 -0.259 . . . . 0.0 110.719 -179.383 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.443 ' CD1' HD23 ' A' ' 89' ' ' LEU . 1.5 mt -91.6 141.97 13.71 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.101 179.445 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' ASP . . . . . 0.535 ' H ' ' HE1' ' A' ' 44' ' ' TRP . 9.3 m-20 -113.77 119.21 36.56 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.987 -0.552 . . . . 0.0 111.503 179.835 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.503 ' CG1' HD12 ' A' ' 90' ' ' ILE . 27.8 mm -95.21 -57.01 4.69 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 C-N-CA 120.768 -0.373 . . . . 0.0 110.963 178.694 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 99.7 mttt -75.81 -46.73 28.98 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-O 121.137 0.494 . . . . 0.0 111.52 -179.784 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 79.7 mtp180 -60.56 -32.4 71.47 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 116.031 -0.531 . . . . 0.0 109.897 -179.668 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 26.9 t-105 -59.67 -36.86 77.3 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 116.039 -0.528 . . . . 0.0 109.759 178.691 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 63.3 ttm-85 -66.75 -38.22 86.19 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.498 179.505 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 82.7 mtp180 -57.22 -48.09 79.69 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 120.577 -0.449 . . . . 0.0 111.318 -179.122 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 4.3 p -66.14 -34.25 68.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 C-N-CA 120.602 -0.439 . . . . 0.0 110.059 179.461 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -66.22 -38.85 94.17 Favored Glycine 0 CA--C 1.526 0.772 0 N-CA-C 111.197 -0.761 . . . . 0.0 111.197 179.545 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 99.9 m-20 -62.46 -46.02 90.41 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.758 0.313 . . . . 0.0 111.07 -179.524 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 88.6 m -65.74 -42.48 90.95 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.173 0.511 . . . . 0.0 110.305 179.941 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 6.8 m-85 -67.47 -30.05 69.66 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.289 179.572 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 59.7 tt0 -62.33 -43.75 98.09 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.228 -179.888 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 31.3 t0 -61.28 -50.74 71.81 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.11 0.481 . . . . 0.0 110.422 179.232 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 34.0 m-85 -62.88 -34.91 78.37 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.075 -0.512 . . . . 0.0 109.947 179.318 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.548 ' CE2' ' O ' ' A' ' 71' ' ' GLY . 76.2 t80 -62.43 -36.85 83.68 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.005 -0.543 . . . . 0.0 109.96 179.679 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 23.5 m-20 -62.63 -37.77 87.63 Favored 'General case' 0 CA--C 1.519 -0.217 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.334 179.801 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 66.5 p -61.27 -19.45 61.73 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 119.812 -0.755 . . . . 0.0 109.16 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 60.0 m-85 -99.27 -49.99 4.28 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 112.752 0.649 . . . . 0.0 112.752 179.731 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' GLY . . . . . 0.548 ' O ' ' CE2' ' A' ' 67' ' ' TYR . . . 173.02 92.73 0.08 OUTLIER Glycine 0 CA--C 1.537 1.429 0 N-CA-C 111.024 -0.83 . . . . 0.0 111.024 -178.874 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 72' ' ' PRO . . . . . 0.514 ' O ' HG23 ' A' ' 75' ' ' VAL . 52.9 Cg_endo -84.23 16.06 2.02 Favored 'Trans proline' 0 N--CA 1.487 1.103 0 C-N-CA 124.12 3.214 . . . . 0.0 111.182 179.458 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 92.4 mt-10 -88.24 -49.65 6.85 Favored 'General case' 0 CA--C 1.51 -0.583 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.248 -178.896 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.423 ' O ' ' O ' ' A' ' 75' ' ' VAL . 0.5 OUTLIER -62.14 -44.31 96.9 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.015 -0.993 . . . . 0.0 110.614 179.671 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.514 HG23 ' O ' ' A' ' 72' ' ' PRO . 78.8 t 36.31 94.16 0.04 OUTLIER Pre-proline 0 N--CA 1.467 0.408 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.395 -179.52 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_exo -57.63 126.21 21.14 Favored 'Trans proline' 0 N--CA 1.493 1.473 0 C-N-CA 121.377 1.385 . . . . 0.0 112.283 -179.672 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 60.6 t -83.83 -25.9 7.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.905 179.144 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' THR . . . . . 0.43 ' H ' HG23 ' A' ' 78' ' ' THR . 22.0 p -44.73 -24.25 0.19 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.499 -179.112 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -59.86 -40.67 89.41 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.348 179.635 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 35.9 t80 -64.61 -39.47 93.78 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.717 179.872 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 11.6 t -58.66 -46.67 86.66 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.028 -179.409 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 14.6 m-85 -62.7 -49.07 76.55 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.731 -0.388 . . . . 0.0 110.942 179.622 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' TRP . . . . . . . . . . . . . 53.1 t90 -53.82 -39.17 65.29 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.579 -179.576 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 92.8 m-20 -61.64 -47.02 87.27 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 120.473 -0.491 . . . . 0.0 111.167 -179.431 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 36.5 tp -72.63 -54.58 8.68 Favored 'General case' 0 C--O 1.221 -0.444 0 C-N-CA 120.186 -0.606 . . . . 0.0 110.496 179.717 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -55.56 -26.09 18.99 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-O 120.765 0.317 . . . . 0.0 110.507 179.575 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 70.8 tttt -65.66 -51.46 59.33 Favored 'General case' 0 C--N 1.322 -0.613 0 C-N-CA 119.966 -0.693 . . . . 0.0 110.224 179.952 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' GLU . . . . . 0.401 ' O ' ' OE1' ' A' ' 88' ' ' GLU . 1.1 pp20? -80.07 -19.77 46.74 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.009 -179.498 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.443 HD23 ' CD1' ' A' ' 51' ' ' ILE . 14.6 tp -61.68 -44.37 97.08 Favored 'General case' 0 N--CA 1.446 -0.639 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.901 -179.142 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.503 HD12 ' CG1' ' A' ' 53' ' ' ILE . 3.4 mt -64.02 -43.78 97.65 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.109 0 C-N-CA 120.174 -0.611 . . . . 0.0 109.833 -179.406 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 95.8 m-20 -64.14 -14.84 57.76 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.65 -179.345 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 21.1 tttt -79.48 153.54 29.53 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.519 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -92.74 -9.44 40.65 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.777 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -63.2 -18.26 63.3 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.427 179.961 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 10.9 t -69.3 134.17 30.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.144 -179.732 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 96' ' ' ASN . . . . . 0.564 ' O ' ' N ' ' A' ' 98' ' ' GLN . 0.7 OUTLIER -55.42 161.23 3.04 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.889 -179.579 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_exo -42.61 -12.93 0.04 OUTLIER 'Trans proline' 0 N--CA 1.491 1.346 0 C-N-CA 123.006 2.471 . . . . 0.0 112.23 178.995 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 98' ' ' GLN . . . . . 0.564 ' N ' ' O ' ' A' ' 96' ' ' ASN . 2.2 pt20 -46.87 -25.29 0.74 Allowed 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.425 -179.672 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 93.5 t -63.05 -50.23 80.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.019 -179.524 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 97.5 mmm -77.19 -38.1 52.22 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.694 179.708 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 101' ' ' ALA . . . . . 0.453 ' O ' ' OE2' ' A' ' 48' ' ' GLU . . . -65.58 -34.61 78.65 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.662 -179.934 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -56.86 -16.19 6.23 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.732 -179.901 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 76.3 t -64.08 -24.5 35.89 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 CA-C-N 116.51 -0.313 . . . . 0.0 110.579 179.509 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 104' ' ' ALA . . . . . 0.525 ' O ' ' N ' ' A' ' 106' ' ' THR . . . -62.38 -39.13 92.2 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.455 -0.339 . . . . 0.0 110.582 -179.958 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 87.4 mt-30 52.08 -85.35 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.616 179.865 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 106' ' ' THR . . . . . 0.525 ' N ' ' O ' ' A' ' 104' ' ' ALA . 58.6 p -83.07 167.55 17.75 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.619 179.984 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 85.1 mt-10 -132.71 167.95 19.2 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.044 -179.741 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 108' ' ' GLU . . . . . 0.497 ' OE1' ' N ' ' A' ' 108' ' ' GLU . 57.1 mp0 -101.39 121.38 41.81 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.77 -0.456 . . . . 0.0 109.77 179.096 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 45.0 pt -46.34 -17.06 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.202 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.463 ' N ' ' C ' ' A' ' 108' ' ' GLU . 34.1 mt -63.82 -42.12 97.72 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.297 179.685 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 111' ' ' LYS . . . . . 0.433 ' O ' ' O ' ' A' ' 114' ' ' SER . 88.6 tttt -63.84 -44.28 93.67 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.527 179.437 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 112' ' ' SER . . . . . 0.423 ' O ' ' O ' ' A' ' 111' ' ' LYS . 1.2 p 38.66 -161.44 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.877 179.921 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 113' ' ' ASN . . . . . 0.42 ' N ' ' OG ' ' A' ' 112' ' ' SER . 94.2 m-20 -63.62 -43.12 97.78 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.745 -179.52 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 114' ' ' SER . . . . . 0.433 ' O ' ' O ' ' A' ' 111' ' ' LYS . 6.4 m -93.9 129.05 40.49 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.277 179.96 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 84.9 mt-30 -86.92 34.58 0.67 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.838 0.351 . . . . 0.0 110.309 -179.776 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 64.1 p -65.75 -31.14 71.96 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.409 -179.858 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 97.0 m-20 -84.08 -53.99 5.15 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.527 179.777 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 54.2 tp -63.56 -42.47 98.35 Favored 'General case' 0 N--CA 1.461 0.122 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.801 -179.818 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 63.0 mm-40 56.75 60.16 3.19 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.511 -0.313 . . . . 0.0 110.649 -179.617 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 60.9 t-80 -80.13 139.0 37.02 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.57 179.962 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 75.3 m80 -116.22 143.26 45.75 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.772 179.859 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 97.3 m-70 -110.3 139.27 45.65 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.507 -179.996 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 74.8 m80 -112.06 141.25 45.96 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.391 179.799 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 124' ' ' HIS . . . . . . . . . . . . . 91.1 m-70 -117.22 146.14 43.45 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.458 -179.92 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 73.9 m-70 . . . . . 0 C--O 1.22 -0.478 0 CA-C-O 117.992 -1.004 . . . . 0.0 110.504 -179.875 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 201' ' ' MYR . . . . . 0.685 ' H71' ' O ' ' A' ' 49' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.675 0 N-CA-C 110.873 -0.891 . . . . 0.0 110.873 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 86.7 mt-30 -63.72 -34.1 77.13 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.807 0.337 . . . . 0.0 110.709 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.416 ' OE1' ' H32' ' A' ' 201' ' ' MYR . 98.9 mt-10 -46.96 -24.34 0.59 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.677 179.926 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 34.6 tp -48.99 -34.19 12.57 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-O 121.103 0.478 . . . . 0.0 110.232 -179.55 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 46.5 m -54.66 -37.78 66.13 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.115 179.871 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 97.5 mm-40 -62.79 -32.06 73.16 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.375 179.804 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 59.8 t-80 -60.63 -43.89 96.99 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.933 0.397 . . . . 0.0 110.376 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 81.2 tt0 -60.59 -51.28 70.1 Favored 'General case' 0 C--O 1.244 0.808 0 CA-C-O 121.335 0.588 . . . . 0.0 110.105 179.729 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.413 ' O ' ' CB ' ' A' ' 14' ' ' GLN . 76.3 mtt-85 -62.56 -31.52 72.33 Favored 'General case' 0 C--O 1.211 -0.938 0 CA-C-N 115.897 -0.592 . . . . 0.0 109.458 179.513 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.461 ' OH ' ' CD2' ' A' ' 89' ' ' LEU . 36.5 t80 -60.23 -37.59 80.81 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 120.936 -0.306 . . . . 0.0 110.326 -179.52 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 2.4 t -62.75 -49.69 82.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 C-N-CA 120.056 -0.657 . . . . 0.0 110.914 -179.803 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 95.6 mt-10 -79.25 -35.9 40.77 Favored 'General case' 0 C--N 1.326 -0.436 0 C-N-CA 120.398 -0.521 . . . . 0.0 111.682 -179.302 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' GLN . . . . . 0.413 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 70.9 tp60 -69.15 -52.39 28.58 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.199 -178.941 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.613 HD13 ' O ' ' A' ' 15' ' ' LEU . 0.3 OUTLIER -61.73 -45.64 93.05 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 -179.406 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.486 ' HB3' HG11 ' A' ' 26' ' ' VAL . 63.9 mttm -55.51 -35.94 66.15 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 120.482 -0.487 . . . . 0.0 110.156 179.486 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 77.3 mt-30 -71.87 -42.0 67.36 Favored 'General case' 0 C--O 1.241 0.641 0 CA-C-O 121.264 0.554 . . . . 0.0 110.552 178.64 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.59 ' O ' HG22 ' A' ' 21' ' ' THR . . . -54.23 -45.18 72.25 Favored 'General case' 0 C--O 1.223 -0.31 0 CA-C-N 115.788 -0.642 . . . . 0.0 109.599 179.93 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.503 ' O ' ' N ' ' A' ' 22' ' ' ARG . 4.4 mt -65.62 -37.9 87.88 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.856 0.36 . . . . 0.0 110.511 178.666 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 77.0 tttt -44.07 -36.74 2.69 Favored 'General case' 0 C--N 1.321 -0.637 0 C-N-CA 120.537 -0.465 . . . . 0.0 109.848 -179.44 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.59 HG22 ' O ' ' A' ' 18' ' ' ALA . 1.2 t -63.27 -32.06 73.37 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.215 179.318 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.503 ' N ' ' O ' ' A' ' 19' ' ' LEU . 26.3 mmt-85 -73.46 19.53 0.1 Allowed 'General case' 0 N--CA 1.462 0.162 0 CA-C-O 120.959 0.409 . . . . 0.0 110.546 -179.715 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' GLY . . . . . 0.488 ' H ' ' C ' ' A' ' 21' ' ' THR . . . 81.45 15.34 76.49 Favored Glycine 0 CA--C 1.524 0.609 0 N-CA-C 110.625 -0.99 . . . . 0.0 110.625 179.974 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.451 HG12 ' H ' ' A' ' 25' ' ' LYS . 3.4 t -92.61 167.53 1.62 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 N-CA-C 110.097 -0.334 . . . . 0.0 110.097 -179.795 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.451 ' H ' HG12 ' A' ' 24' ' ' VAL . 55.5 mtmt -128.56 133.21 48.31 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 110.143 -0.317 . . . . 0.0 110.143 179.71 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.486 HG11 ' HB3' ' A' ' 16' ' ' LYS . 2.1 m -133.37 110.54 14.98 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.333 0 CA-C-N 116.62 -0.264 . . . . 0.0 110.512 179.854 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 25.7 pttt -108.92 165.15 11.79 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-O 120.615 0.245 . . . . 0.0 110.459 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 76.3 m-85 -48.52 -39.57 23.78 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.043 0.449 . . . . 0.0 110.318 179.941 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.421 ' HA ' HD12 ' A' ' 32' ' ' LEU . . . -55.69 -23.17 27.07 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.073 179.516 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.428 ' O ' ' CB ' ' A' ' 34' ' ' PHE . 44.7 t0 -62.14 -44.41 96.69 Favored 'General case' 0 C--O 1.221 -0.395 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.641 -179.719 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.483 ' O ' ' CB ' ' A' ' 35' ' ' PHE . 5.2 mp -68.08 -40.06 82.75 Favored 'General case' 0 C--O 1.218 -0.558 0 CA-C-O 121.099 0.476 . . . . 0.0 110.11 179.24 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.421 HD12 ' HA ' ' A' ' 29' ' ' ALA . 46.0 mt -58.84 -44.61 90.98 Favored 'General case' 0 C--N 1.317 -0.84 0 C-N-CA 119.856 -0.738 . . . . 0.0 110.862 -178.634 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.619 ' NZ ' ' CE2' ' A' ' 67' ' ' TYR . 88.3 tttt -85.61 -49.09 8.29 Favored 'General case' 0 C--N 1.321 -0.631 0 C-N-CA 120.741 -0.384 . . . . 0.0 111.704 -179.325 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' PHE . . . . . 0.428 ' CB ' ' O ' ' A' ' 30' ' ' ASP . 54.1 t80 -61.34 -50.52 72.6 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.927 -178.682 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.483 ' CB ' ' O ' ' A' ' 31' ' ' LEU . 6.1 t80 -61.83 -46.95 87.26 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.339 -179.685 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 90.8 m-20 -64.37 -36.18 83.31 Favored 'General case' 0 C--N 1.341 0.202 0 CA-C-O 120.747 0.308 . . . . 0.0 111.478 -179.617 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 1.8 m-85 -58.33 -45.47 88.02 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.854 -179.176 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.542 ' O ' ' N ' ' A' ' 42' ' ' CYS . 19.7 m -79.48 -39.05 20.26 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.871 179.97 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 85.9 tttt -55.21 -28.45 53.2 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.775 -179.229 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 96.5 m-20 -50.41 -63.28 1.17 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.389 -0.368 . . . . 0.0 111.134 -179.43 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.445 ' O ' ' SG ' ' A' ' 42' ' ' CYS . 22.9 p -114.51 4.48 15.23 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.983 -179.87 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' CYS . . . . . 0.542 ' N ' ' O ' ' A' ' 38' ' ' VAL . 19.5 p 41.29 54.68 7.9 Favored Pre-proline 0 C--N 1.331 -0.214 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.679 -179.109 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' PRO . . . . . 0.461 ' C ' ' H ' ' A' ' 45' ' ' PHE . 57.8 Cg_endo -72.93 -25.16 16.78 Favored 'Trans proline' 0 N--CA 1.491 1.352 0 C-N-CA 122.469 2.113 . . . . 0.0 112.142 -179.996 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' TRP . . . . . 0.63 ' NE1' H132 ' A' ' 201' ' ' MYR . 1.2 t-105 -61.53 -1.41 0.56 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.526 -179.52 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.461 ' H ' ' C ' ' A' ' 43' ' ' PRO . 4.8 t80 50.02 54.36 15.61 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-O 121.021 0.438 . . . . 0.0 110.087 -179.856 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.461 ' CD ' ' N ' ' A' ' 45' ' ' PHE . 29.5 Cg_endo -65.21 -10.55 26.24 Favored 'Trans proline' 0 C--N 1.308 -1.584 0 C-N-CA 122.863 2.375 . . . . 0.0 112.117 179.948 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 86.9 mt-30 -58.44 -52.39 65.84 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.248 -179.613 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.615 ' O ' ' H42' ' A' ' 201' ' ' MYR . 50.2 tt0 -88.81 -13.76 38.61 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.172 179.472 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' GLY . . . . . 0.54 ' C ' ' H91' ' A' ' 201' ' ' MYR . . . 72.53 65.58 2.29 Favored Glycine 0 CA--C 1.522 0.528 0 N-CA-C 110.494 -1.042 . . . . 0.0 110.494 -179.3 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' THR . . . . . 0.543 ' OG1' ' NE2' ' A' ' 98' ' ' GLN . 2.4 t -136.76 155.88 49.25 Favored 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 120.998 -0.281 . . . . 0.0 110.775 -179.536 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.5 mt -85.24 140.74 15.53 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-O 121.074 0.464 . . . . 0.0 110.537 179.308 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -110.78 121.47 45.43 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.474 -0.785 . . . . 0.0 110.995 179.378 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.473 ' CG1' HD12 ' A' ' 90' ' ' ILE . 32.6 mm -94.81 -56.53 5.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.203 179.324 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 68.6 mmtt -74.07 -49.04 25.82 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.359 -179.522 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 78.1 mtp85 -61.07 -35.17 76.23 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.212 -179.742 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 22.8 t-105 -61.94 -38.54 88.83 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.791 179.407 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 61.7 ttt85 -62.86 -39.05 93.23 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.276 -179.901 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -59.23 -50.75 72.82 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 120.89 -0.324 . . . . 0.0 111.103 -179.345 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 6.4 p -73.54 -36.85 48.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-O 120.84 0.352 . . . . 0.0 110.825 179.748 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' GLY . . . . . 0.428 ' O ' ' CB ' ' A' ' 64' ' ' GLN . . . -64.06 -54.85 27.66 Favored Glycine 0 C--O 1.223 -0.59 0 N-CA-C 111.438 -0.665 . . . . 0.0 111.438 -179.104 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 62.5 m-20 -63.35 -35.86 81.8 Favored 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 120.828 -0.349 . . . . 0.0 110.581 -179.536 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 3.8 m -64.01 -62.57 1.55 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.841 0.353 . . . . 0.0 111.355 -179.509 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 21.1 m-85 -63.5 -41.97 98.52 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.972 -179.701 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' GLN . . . . . 0.59 ' HG2' HD22 ' A' ' 68' ' ' ASN . 56.7 tt0 -62.92 -42.21 99.72 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.877 -179.582 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 24.5 t0 -54.7 -56.75 15.85 Favored 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 120.476 -0.49 . . . . 0.0 110.944 -179.61 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 65.2 m-85 -64.46 -41.47 96.49 Favored 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 120.678 -0.409 . . . . 0.0 110.787 179.846 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.619 ' CE2' ' NZ ' ' A' ' 33' ' ' LYS . 65.6 t80 -57.61 -41.0 80.4 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.618 -179.403 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 68' ' ' ASN . . . . . 0.59 HD22 ' HG2' ' A' ' 64' ' ' GLN . 26.4 m-20 -62.15 -43.82 97.99 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.122 -179.075 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 81.1 p -77.69 -18.64 56.42 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.238 -179.812 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 34.9 m-85 -109.73 16.09 22.32 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.381 179.933 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -160.41 -108.32 0.23 Allowed Glycine 0 CA--C 1.532 1.147 0 C-N-CA 120.539 -0.838 . . . . 0.0 111.213 -179.947 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 65.3 Cg_endo -73.71 141.49 30.84 Favored 'Trans proline' 0 N--CA 1.497 1.715 0 C-N-CA 121.98 1.787 . . . . 0.0 113.211 -179.487 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 81.5 tt0 -86.44 -43.38 12.84 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.548 179.343 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.664 ' CD ' ' H ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -82.75 -26.67 31.67 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 115.892 -0.595 . . . . 0.0 111.326 -179.46 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.535 ' H ' ' HD3' ' A' ' 74' ' ' LYS . 87.5 t 57.38 115.57 0.02 OUTLIER Pre-proline 0 N--CA 1.45 -0.436 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.683 -179.554 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_exo -53.73 127.84 27.1 Favored 'Trans proline' 0 N--CA 1.495 1.576 0 C-N-CA 121.473 1.449 . . . . 0.0 111.697 179.74 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.523 ' O ' HG12 ' A' ' 77' ' ' VAL . 61.1 t -82.65 -7.42 10.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.98 179.827 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 68.2 p -48.95 -22.02 0.77 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.549 -179.455 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.06 -27.06 68.63 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.532 179.722 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 34.6 t80 -60.95 -40.44 93.34 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.147 -179.815 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 20.9 m -57.98 -42.08 84.35 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.527 -179.687 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 13.5 m-85 -57.35 -53.8 54.03 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.772 -0.371 . . . . 0.0 110.621 -179.968 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' TRP . . . . . 0.484 ' C ' ' CD1' ' A' ' 83' ' ' TRP . 9.0 t-105 -56.39 -40.55 74.81 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.499 -179.983 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 83.8 m-20 -61.27 -45.41 94.61 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 120.484 -0.486 . . . . 0.0 111.111 -179.01 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 42.4 tp -72.83 -57.62 3.94 Favored 'General case' 0 C--O 1.218 -0.567 0 C-N-CA 120.337 -0.545 . . . . 0.0 110.574 179.84 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -53.75 -26.41 13.68 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 C-N-CA 120.733 -0.387 . . . . 0.0 110.379 179.452 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.415 ' CB ' ' O ' ' A' ' 83' ' ' TRP . 64.2 tttt -65.44 -50.93 63.56 Favored 'General case' 0 C--N 1.322 -0.608 0 C-N-CA 120.404 -0.519 . . . . 0.0 110.393 179.938 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 88' ' ' GLU . . . . . 0.434 ' O ' ' OD1' ' A' ' 91' ' ' ASP . 1.1 pp20? -80.75 -19.71 44.33 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.774 179.954 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.461 ' CD2' ' OH ' ' A' ' 11' ' ' TYR . 12.6 tp -62.17 -43.76 98.12 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.322 -178.746 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.473 HD12 ' CG1' ' A' ' 53' ' ' ILE . 3.1 mt -63.69 -45.47 97.33 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 C-N-CA 120.271 -0.572 . . . . 0.0 110.847 -178.783 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 91' ' ' ASP . . . . . 0.434 ' OD1' ' O ' ' A' ' 88' ' ' GLU . 4.4 p30 -81.64 -4.92 57.45 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.433 -0.348 . . . . 0.0 111.075 -178.757 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 92' ' ' LYS . . . . . 0.471 ' O ' ' CB ' ' A' ' 93' ' ' LYS . 86.4 tttt -57.24 -15.71 6.59 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.633 -179.904 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 93' ' ' LYS . . . . . 0.471 ' CB ' ' O ' ' A' ' 92' ' ' LYS . 59.4 tttt 79.63 -68.11 0.13 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.731 179.805 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 70.3 tt0 -73.94 54.7 0.52 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.057 0.456 . . . . 0.0 110.005 -179.741 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.441 ' O ' ' O ' ' A' ' 96' ' ' ASN . 1.9 t -87.46 164.76 2.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.4 -179.636 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 96' ' ' ASN . . . . . 0.601 ' O ' ' N ' ' A' ' 98' ' ' GLN . 0.0 OUTLIER -42.19 167.04 0.07 OUTLIER Pre-proline 0 C--N 1.327 -0.395 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.353 179.731 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 77.0 Cg_exo -40.38 -14.01 0.03 OUTLIER 'Trans proline' 0 C--N 1.312 -1.386 0 C-N-CA 122.844 2.363 . . . . 0.0 112.485 179.174 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 98' ' ' GLN . . . . . 0.601 ' N ' ' O ' ' A' ' 96' ' ' ASN . 12.1 tt0 -46.14 -33.19 3.38 Favored 'General case' 0 C--N 1.322 -0.629 0 C-N-CA 120.799 -0.361 . . . . 0.0 110.174 179.17 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 96.7 t -62.16 -49.72 82.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 C-N-CA 120.453 -0.499 . . . . 0.0 110.927 -178.877 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 98.6 mtp -80.41 -43.57 20.78 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.279 -0.418 . . . . 0.0 111.049 179.845 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -61.85 -27.25 68.65 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.406 -179.572 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 102' ' ' ALA . . . . . 0.565 ' HB2' ' O ' ' A' ' 98' ' ' GLN . . . -63.5 -15.54 58.15 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.379 -179.991 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 71.5 t -63.73 -18.43 22.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.781 -179.925 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 104' ' ' ALA . . . . . 0.527 ' HB3' ' OE2' ' A' ' 48' ' ' GLU . . . -54.42 -41.59 69.51 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.66 -179.632 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 99.4 mm-40 -40.43 114.97 0.5 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.559 179.84 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 45.3 p -67.37 -32.76 73.89 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.698 179.945 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 46.4 mm-40 -74.93 155.02 37.88 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.605 -179.836 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 108' ' ' GLU . . . . . 0.553 ' C ' ' H ' ' A' ' 110' ' ' LEU . 99.3 mt-10 -89.85 135.11 33.83 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.177 179.536 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 47.3 pt -59.14 0.77 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 115.965 -0.562 . . . . 0.0 110.201 179.564 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.553 ' H ' ' C ' ' A' ' 108' ' ' GLU . 96.6 mt -100.73 -9.43 21.8 Favored 'General case' 0 C--N 1.334 -0.097 0 C-N-CA 120.592 -0.443 . . . . 0.0 110.507 -179.857 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 111' ' ' LYS . . . . . 0.454 ' O ' ' O ' ' A' ' 114' ' ' SER . 86.3 tttt -71.3 -13.38 61.87 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.676 179.927 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 11.7 t -58.93 -45.38 90.53 Favored 'General case' 0 C--N 1.326 -0.45 0 C-N-CA 120.724 -0.391 . . . . 0.0 110.613 -179.895 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 88.3 m-20 -64.54 -41.89 96.07 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.867 -179.785 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 114' ' ' SER . . . . . 0.454 ' O ' ' O ' ' A' ' 111' ' ' LYS . 35.5 t -158.5 177.99 10.63 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.468 -179.815 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 95.5 mt-30 -53.5 -41.52 66.37 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.945 0.402 . . . . 0.0 110.467 -179.812 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 62.8 p -146.75 162.88 37.63 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.571 179.749 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -62.05 -45.08 95.1 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 120.92 -0.312 . . . . 0.0 110.517 179.452 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.431 ' O ' ' O ' ' A' ' 119' ' ' GLU . 58.9 tp -64.07 -43.37 95.66 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.35 -0.387 . . . . 0.0 110.247 179.739 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 119' ' ' GLU . . . . . 0.431 ' O ' ' O ' ' A' ' 118' ' ' LEU . 78.8 tt0 58.94 148.76 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.19 -179.63 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 58.1 m80 -125.24 140.41 52.87 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.54 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 95.4 m-70 -107.71 130.6 54.92 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.424 -179.938 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 96.5 m-70 -116.41 145.88 42.93 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.971 -0.558 . . . . 0.0 110.548 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 88.8 m-70 -109.02 131.73 54.79 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.539 179.924 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 124' ' ' HIS . . . . . . . . . . . . . 89.0 m-70 -126.85 138.28 53.3 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.523 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 93.5 m-70 . . . . . 0 C--O 1.22 -0.449 0 CA-C-O 117.936 -1.031 . . . . 0.0 110.606 179.942 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 201' ' ' MYR . . . . . 0.63 H132 ' NE1' ' A' ' 44' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.695 0 N-CA-C 111.134 -0.787 . . . . 0.0 111.134 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 99.3 mm-40 -56.92 -28.43 62.01 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.819 0.342 . . . . 0.0 110.34 -179.799 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.602 ' HB2' ' H21' ' A' ' 201' ' ' MYR . 91.0 mt-10 -57.67 -21.54 40.74 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.563 179.853 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 49.9 tp -40.46 -30.3 0.11 Allowed 'General case' 0 C--O 1.234 0.279 0 CA-C-O 121.004 0.431 . . . . 0.0 110.358 -179.31 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 16.3 t -59.88 -42.43 93.74 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 120.693 -0.403 . . . . 0.0 109.924 179.42 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' GLN . . . . . 0.499 ' N ' ' O ' ' A' ' 4' ' ' GLU . 87.0 mt-30 -61.39 -35.42 77.43 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.666 179.689 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 63.3 t60 -57.33 -44.1 83.95 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.059 -179.822 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 81.0 mm-40 -61.33 -45.22 95.35 Favored 'General case' 0 C--O 1.241 0.651 0 CA-C-O 121.061 0.457 . . . . 0.0 110.007 179.648 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.427 ' O ' ' CB ' ' A' ' 14' ' ' GLN . 64.5 mtp85 -64.41 -33.25 75.43 Favored 'General case' 0 C--O 1.212 -0.871 0 N-CA-C 109.22 -0.659 . . . . 0.0 109.22 179.636 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.478 ' CE1' HD23 ' A' ' 15' ' ' LEU . 53.4 t80 -60.09 -37.77 80.93 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 120.554 -0.458 . . . . 0.0 110.365 -179.52 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 4.5 t -61.62 -49.44 84.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 C-N-CA 120.056 -0.658 . . . . 0.0 111.048 179.935 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 80.9 mm-40 -80.72 -43.05 20.89 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 120.33 -0.548 . . . . 0.0 111.659 -179.33 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' GLN . . . . . 0.427 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 69.1 tp60 -61.36 -52.75 63.34 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.881 -0.6 . . . . 0.0 111.325 -178.977 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.595 HD13 ' O ' ' A' ' 15' ' ' LEU . 0.2 OUTLIER -63.21 -45.27 92.45 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 120.649 -0.42 . . . . 0.0 110.086 -179.613 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.532 ' HB3' HG11 ' A' ' 26' ' ' VAL . 92.0 mttt -58.16 -33.57 69.36 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 120.674 -0.411 . . . . 0.0 110.527 179.236 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 76.8 mt-30 -71.95 -41.68 67.48 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.178 0.513 . . . . 0.0 110.446 178.664 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.543 ' O ' HG22 ' A' ' 21' ' ' THR . . . -55.12 -42.98 73.68 Favored 'General case' 0 C--O 1.222 -0.368 0 CA-C-N 116.074 -0.512 . . . . 0.0 109.69 179.843 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.453 ' O ' ' N ' ' A' ' 22' ' ' ARG . 5.0 mt -66.62 -37.96 85.94 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.995 0.426 . . . . 0.0 110.703 178.579 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 61.6 tttm -45.61 -37.36 5.52 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 -179.62 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.543 HG22 ' O ' ' A' ' 18' ' ' ALA . 1.0 OUTLIER -61.14 -33.18 73.0 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.01 179.392 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.453 ' N ' ' O ' ' A' ' 19' ' ' LEU . 10.3 mmm180 -72.93 15.63 0.19 Allowed 'General case' 0 N--CA 1.464 0.266 0 CA-C-O 120.868 0.366 . . . . 0.0 110.41 -179.633 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' GLY . . . . . 0.471 ' H ' ' C ' ' A' ' 21' ' ' THR . . . 84.41 13.67 72.94 Favored Glycine 0 CA--C 1.525 0.696 0 N-CA-C 110.561 -1.016 . . . . 0.0 110.561 -179.872 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.549 HG12 ' N ' ' A' ' 25' ' ' LYS . 11.7 t -88.01 167.65 1.69 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 N-CA-C 110.314 -0.254 . . . . 0.0 110.314 179.993 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.549 ' N ' HG12 ' A' ' 24' ' ' VAL . 88.8 tttt -130.0 129.85 44.25 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.214 179.616 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.532 HG11 ' HB3' ' A' ' 16' ' ' LYS . 3.6 m -128.15 108.56 17.99 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.307 0 CA-C-N 116.503 -0.317 . . . . 0.0 110.543 -179.884 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.564 ' HD3' ' H ' ' A' ' 29' ' ' ALA . 12.5 tmtt? -109.49 165.22 11.82 Favored 'General case' 0 CA--C 1.527 0.074 0 N-CA-C 109.959 -0.385 . . . . 0.0 109.959 -179.824 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 89.8 m-85 -47.06 -35.94 7.5 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.923 0.392 . . . . 0.0 110.246 -179.973 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.564 ' H ' ' HD3' ' A' ' 27' ' ' LYS . . . -57.95 -24.03 56.25 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 121.185 0.517 . . . . 0.0 110.042 179.452 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 65.9 t0 -60.66 -48.36 82.14 Favored 'General case' 0 C--O 1.222 -0.367 0 CA-C-N 115.606 -0.724 . . . . 0.0 110.594 -179.697 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.539 ' H ' HD12 ' A' ' 31' ' ' LEU . 5.4 mp -63.72 -42.09 97.98 Favored 'General case' 0 C--O 1.217 -0.631 0 CA-C-O 121.048 0.452 . . . . 0.0 110.155 179.448 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.418 ' H ' ' HG ' ' A' ' 32' ' ' LEU . 30.4 mt -59.29 -44.95 92.45 Favored 'General case' 0 C--N 1.31 -1.119 0 C-N-CA 119.332 -0.947 . . . . 0.0 110.423 -178.892 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.465 ' O ' ' CD1' ' A' ' 37' ' ' PHE . 99.7 mttt -73.96 -41.68 61.62 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.075 -0.511 . . . . 0.0 112.366 -179.189 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' PHE . . . . . 0.863 ' O ' HG22 ' A' ' 38' ' ' VAL . 5.1 m-85 -83.07 -61.59 1.82 Allowed 'General case' 0 CA--C 1.511 -0.534 0 C-N-CA 120.738 -0.385 . . . . 0.0 111.214 -178.664 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.504 ' CB ' ' O ' ' A' ' 31' ' ' LEU . 17.1 t80 -41.98 -45.91 3.97 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.198 -179.322 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 80.1 m-20 -72.74 -41.49 65.08 Favored 'General case' 0 CA--C 1.529 0.164 0 C-N-CA 120.291 -0.564 . . . . 0.0 111.809 -179.44 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.465 ' CD1' ' O ' ' A' ' 33' ' ' LYS . 3.5 m-30 -63.34 -51.13 67.26 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 111.975 0.361 . . . . 0.0 111.975 -178.037 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.863 HG22 ' O ' ' A' ' 34' ' ' PHE . 6.5 m -67.68 -42.65 86.64 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.716 -179.563 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -65.47 -30.57 71.37 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.137 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 57.2 t0 -54.21 -49.23 69.88 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 120.84 -0.344 . . . . 0.0 110.544 -179.233 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 9.5 p -109.2 -8.67 15.09 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.037 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' CYS . . . . . 0.536 ' N ' ' O ' ' A' ' 38' ' ' VAL . 16.9 m 42.43 55.9 10.3 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.498 -179.526 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' PRO . . . . . 0.53 ' C ' ' H ' ' A' ' 45' ' ' PHE . 74.3 Cg_endo -78.33 -26.63 5.99 Favored 'Trans proline' 0 N--CA 1.491 1.361 0 C-N-CA 122.491 2.127 . . . . 0.0 112.997 -179.358 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' TRP . . . . . 0.413 ' CH2' ' CE3' ' A' ' 56' ' ' TRP . 0.0 OUTLIER -71.78 22.49 0.05 OUTLIER 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.968 -179.624 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.53 ' H ' ' C ' ' A' ' 43' ' ' PRO . 33.6 t80 40.03 61.63 6.16 Favored Pre-proline 0 C--N 1.326 -0.423 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.214 -179.091 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.468 ' HD3' ' N ' ' A' ' 45' ' ' PHE . 32.4 Cg_exo -60.39 -12.1 19.11 Favored 'Trans proline' 0 N--CA 1.496 1.657 0 C-N-CA 122.654 2.236 . . . . 0.0 112.257 -179.68 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 88.6 mt-30 -53.31 -53.96 43.32 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 120.534 -0.466 . . . . 0.0 110.45 -179.01 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.434 ' O ' ' H51' ' A' ' 201' ' ' MYR . 34.0 tp10 -88.93 -29.46 19.55 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.886 -0.413 . . . . 0.0 109.886 178.819 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' GLY . . . . . 0.5 ' HA3' ' H82' ' A' ' 201' ' ' MYR . . . 83.9 61.77 1.82 Allowed Glycine 0 CA--C 1.528 0.847 0 N-CA-C 110.01 -1.236 . . . . 0.0 110.01 -178.33 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 13.8 t -131.2 169.91 15.29 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-O 120.664 0.269 . . . . 0.0 110.524 -179.115 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.1 mt -87.02 132.14 33.21 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.314 0 C-N-CA 120.709 -0.397 . . . . 0.0 110.228 178.939 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -118.37 121.0 39.29 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.221 179.54 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 16.8 mm -91.74 -47.07 14.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.195 -179.578 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.449 ' HA ' ' HE ' ' A' ' 57' ' ' ARG . 88.3 tttt -64.11 -48.93 74.22 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-O 121.01 0.433 . . . . 0.0 111.152 -179.398 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 78.6 mmt-85 -64.7 -33.58 76.29 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.116 -179.745 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' TRP . . . . . 0.413 ' CE3' ' CH2' ' A' ' 44' ' ' TRP . 37.5 t-105 -59.81 -39.87 86.46 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-O 120.955 0.407 . . . . 0.0 110.269 -179.803 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.449 ' HE ' ' HA ' ' A' ' 54' ' ' LYS . 87.7 mtm180 -64.67 -38.34 90.67 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.453 -179.922 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 68.4 mmt-85 -60.59 -51.69 68.34 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.824 -0.35 . . . . 0.0 111.218 -179.643 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 3.5 p -66.16 -35.52 75.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.329 179.707 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -66.96 -45.03 87.07 Favored Glycine 0 CA--C 1.526 0.733 0 N-CA-C 111.246 -0.742 . . . . 0.0 111.246 179.867 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 99.8 m-20 -63.34 -43.84 96.57 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.718 0.294 . . . . 0.0 111.28 -179.577 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 74.8 m -64.14 -47.42 80.01 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.012 0.434 . . . . 0.0 110.557 -179.738 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 8.0 m-85 -66.4 -33.85 76.63 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.534 179.55 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 70.4 tp60 -57.69 -43.07 84.84 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.843 0.354 . . . . 0.0 110.295 -179.831 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -62.92 -52.8 61.65 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.922 0.391 . . . . 0.0 110.542 179.612 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' TYR . . . . . 0.413 ' O ' ' OG1' ' A' ' 69' ' ' THR . 38.7 m-85 -65.03 -25.23 67.75 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.476 179.399 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 61.5 t80 -65.5 -45.13 84.78 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.424 -179.912 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 88.6 m-20 -64.4 -39.45 93.87 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.592 -179.523 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.413 ' OG1' ' O ' ' A' ' 66' ' ' TYR . 82.2 p -49.77 -35.62 23.06 Favored 'General case' 0 C--N 1.324 -0.53 0 C-N-CA 120.578 -0.449 . . . . 0.0 111.159 -179.039 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 14.9 m-85 -67.36 -46.56 73.01 Favored 'General case' 0 C--N 1.321 -0.653 0 C-N-CA 119.888 -0.725 . . . . 0.0 111.056 -179.09 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' GLY . . . . . 0.509 ' H ' ' HD3' ' A' ' 72' ' ' PRO . . . 112.6 71.91 0.6 Allowed Glycine 0 N--CA 1.471 1.003 0 N-CA-C 110.952 -0.859 . . . . 0.0 110.952 -179.933 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 72' ' ' PRO . . . . . 0.509 ' HD3' ' H ' ' A' ' 71' ' ' GLY . 25.1 Cg_exo -62.02 143.69 95.36 Favored 'Trans proline' 0 N--CA 1.498 1.766 0 C-N-CA 123.247 2.631 . . . . 0.0 111.379 179.809 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 83.5 tt0 -74.93 -49.79 18.99 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-O 120.874 0.368 . . . . 0.0 110.544 -179.728 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.513 ' HD3' ' H ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -138.46 4.42 2.4 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.594 -179.547 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 63.8 t 57.42 92.97 0.06 OUTLIER Pre-proline 0 CA--C 1.534 0.331 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.068 -178.632 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_exo -54.15 125.71 19.71 Favored 'Trans proline' 0 N--CA 1.491 1.348 0 C-N-CA 121.722 1.615 . . . . 0.0 112.303 -178.982 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.456 ' O ' ' N ' ' A' ' 80' ' ' PHE . 43.6 t -84.67 -20.22 8.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.773 179.313 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 57.9 p -41.54 -27.49 0.1 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.585 -179.031 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' ALA . . . . . 0.409 ' N ' ' O ' ' A' ' 77' ' ' VAL . . . -62.39 -39.91 94.78 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.12 0.486 . . . . 0.0 110.64 179.839 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 80' ' ' PHE . . . . . 0.456 ' N ' ' O ' ' A' ' 77' ' ' VAL . 3.3 m-85 -62.19 -35.89 80.22 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.428 179.907 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 54.2 p -60.22 -40.04 88.74 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.244 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 13.7 m-85 -60.6 -53.4 57.95 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 120.696 -0.402 . . . . 0.0 110.707 179.816 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' TRP . . . . . . . . . . . . . 31.0 t90 -58.25 -38.68 77.4 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.738 179.806 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 82.3 m-20 -62.01 -45.7 92.43 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 120.684 -0.406 . . . . 0.0 110.957 -179.536 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 43.5 tp -71.45 -54.0 12.11 Favored 'General case' 0 C--O 1.218 -0.561 0 C-N-CA 120.439 -0.505 . . . . 0.0 110.466 179.606 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -57.23 -26.36 25.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-O 120.794 0.33 . . . . 0.0 110.61 179.622 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 66.4 tttt -65.59 -50.84 63.59 Favored 'General case' 0 C--N 1.32 -0.692 0 C-N-CA 120.32 -0.552 . . . . 0.0 110.107 -179.839 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' GLU . . . . . 0.438 ' OE1' ' O ' ' A' ' 88' ' ' GLU . 1.0 OUTLIER -80.38 -20.03 45.0 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.84 -179.815 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.419 HD12 ' HA ' ' A' ' 89' ' ' LEU . 14.1 tp -61.42 -44.42 97.17 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.47 -179.245 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 3.2 mt -63.52 -43.47 98.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 C-N-CA 120.25 -0.58 . . . . 0.0 109.841 -179.66 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 68.0 t0 -53.0 -43.46 66.49 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.751 -178.739 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 68.2 mmtt -62.5 134.91 57.07 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.954 0.406 . . . . 0.0 110.413 -179.779 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 93' ' ' LYS . . . . . 0.443 ' C ' ' H ' ' A' ' 95' ' ' VAL . 98.6 mttt -72.52 -9.87 59.09 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.539 -179.921 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 80.3 mm-40 -72.34 43.56 0.11 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.561 179.904 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.443 ' H ' ' C ' ' A' ' 93' ' ' LYS . 5.7 m -120.03 132.43 69.73 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.19 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.42 179.874 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 96' ' ' ASN . . . . . . . . . . . . . 7.2 m-20 -49.21 158.82 0.68 Allowed Pre-proline 0 C--N 1.327 -0.389 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.493 -179.628 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -60.55 -12.64 21.79 Favored 'Trans proline' 0 N--CA 1.495 1.59 0 C-N-CA 122.829 2.353 . . . . 0.0 112.061 179.543 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 98' ' ' GLN . . . . . 0.697 ' OE1' ' H71' ' A' ' 201' ' ' MYR . 8.6 pt20 -47.79 -31.49 4.95 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.785 -179.711 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 81.0 t -62.52 -48.59 87.52 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.928 -179.579 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 91.7 mmm -67.84 -40.38 83.72 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.854 -179.87 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -62.42 -25.31 67.88 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.69 -179.732 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -65.18 -15.8 62.83 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.189 179.798 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.445 ' O ' ' O ' ' A' ' 106' ' ' THR . 71.0 t -63.39 -20.25 25.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.132 179.534 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -49.93 -23.11 1.79 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.654 -179.859 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 69.1 tp60 -63.1 -39.62 95.23 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.411 -179.985 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 106' ' ' THR . . . . . 0.445 ' O ' ' O ' ' A' ' 103' ' ' VAL . 75.2 p -130.78 152.35 50.23 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.905 0.383 . . . . 0.0 110.762 -179.999 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 107' ' ' GLU . . . . . 0.525 ' OE1' ' N ' ' A' ' 107' ' ' GLU . 44.3 mp0 -139.71 167.26 22.5 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.349 -179.752 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 108' ' ' GLU . . . . . 0.461 ' C ' ' N ' ' A' ' 110' ' ' LEU . 81.2 mm-40 -94.21 128.86 40.91 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.071 179.49 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 45.4 pt -47.23 -15.85 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.187 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.461 ' N ' ' C ' ' A' ' 108' ' ' GLU . 34.8 mt -64.01 -42.86 97.01 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.367 179.767 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -70.52 -32.33 69.75 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.542 179.692 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 14.2 t -58.91 -45.77 89.51 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.908 -178.973 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 32.0 t30 -66.37 -46.59 76.17 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.871 0.367 . . . . 0.0 110.858 179.801 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 31.2 p -162.28 158.81 24.78 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.61 179.785 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 115' ' ' GLN . . . . . 0.406 ' O ' ' O ' ' A' ' 118' ' ' LEU . 33.8 mt-30 -99.06 13.04 34.22 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.79 0.329 . . . . 0.0 110.382 179.769 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 14.8 m -59.23 -47.59 84.8 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.147 -179.751 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 99.4 m-20 -65.06 -43.75 91.22 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.568 179.543 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.406 ' O ' ' O ' ' A' ' 115' ' ' GLN . 94.5 mt -128.65 129.95 46.56 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.5 -179.939 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 99.3 mt-10 -118.7 137.22 53.48 Favored 'General case' 0 C--O 1.231 0.094 0 CA-C-N 116.632 -0.258 . . . . 0.0 110.354 179.925 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 79.4 m80 -124.42 139.73 53.62 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.43 -179.932 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 96.1 m-70 -125.49 153.76 43.09 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.471 -179.873 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 42.3 m170 -59.32 -42.88 92.44 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.537 -179.892 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 95.7 m-70 -101.92 130.59 48.46 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.546 179.998 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 124' ' ' HIS . . . . . . . . . . . . . 69.7 m80 -66.3 -39.08 89.1 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.501 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 85.1 t60 . . . . . 0 C--O 1.22 -0.46 0 CA-C-O 117.97 -1.014 . . . . 0.0 110.611 -179.896 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 201' ' ' MYR . . . . . 0.697 ' H71' ' OE1' ' A' ' 98' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.682 0 N-CA-C 111.033 -0.827 . . . . 0.0 111.033 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 87.6 mt-30 -61.78 -23.22 66.05 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.902 0.382 . . . . 0.0 110.315 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.409 ' HG2' ' H61' ' A' ' 201' ' ' MYR . 34.1 tp10 -51.92 -21.68 3.21 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.519 179.898 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.48 ' O ' ' OE1' ' A' ' 9' ' ' GLU . 33.6 tp -41.07 -39.59 1.27 Allowed 'General case' 0 C--O 1.235 0.312 0 CA-C-O 121.026 0.441 . . . . 0.0 110.284 -179.348 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 89.9 p -47.53 -36.76 10.9 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 120.758 -0.377 . . . . 0.0 110.244 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 72.3 tp60 -63.77 -32.46 73.97 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.467 179.608 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 53.9 t60 -59.24 -44.8 92.35 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 120.664 -0.414 . . . . 0.0 110.235 -179.932 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.48 ' OE1' ' O ' ' A' ' 5' ' ' LEU . 56.5 mp0 -61.73 -49.19 77.44 Favored 'General case' 0 C--O 1.244 0.77 0 C-N-CA 120.36 -0.536 . . . . 0.0 110.342 179.707 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.442 ' O ' ' CB ' ' A' ' 14' ' ' GLN . 75.3 mtm-85 -63.8 -31.73 73.0 Favored 'General case' 0 C--O 1.211 -0.968 0 C-N-CA 120.19 -0.604 . . . . 0.0 109.429 179.485 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.555 ' CE1' H142 ' A' ' 201' ' ' MYR . 31.5 t80 -59.86 -36.69 77.4 Favored 'General case' 0 C--N 1.323 -0.575 0 C-N-CA 120.889 -0.324 . . . . 0.0 110.315 -179.664 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 4.0 t -63.78 -49.34 82.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 C-N-CA 120.077 -0.649 . . . . 0.0 111.196 179.924 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -81.22 -34.28 32.3 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 120.438 -0.505 . . . . 0.0 111.874 -179.265 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' GLN . . . . . 0.442 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 70.5 tp60 -70.39 -52.98 18.51 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.049 -178.93 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.573 HD13 ' O ' ' A' ' 15' ' ' LEU . 0.2 OUTLIER -62.7 -47.01 85.49 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 109.988 -0.375 . . . . 0.0 109.988 -179.501 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.431 ' HB3' HG11 ' A' ' 26' ' ' VAL . 97.0 mttt -57.32 -32.73 66.99 Favored 'General case' 0 C--N 1.33 -0.257 0 C-N-CA 120.667 -0.413 . . . . 0.0 110.143 179.355 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 56.1 tt0 -71.05 -37.6 72.53 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.98 0.419 . . . . 0.0 110.467 179.304 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -58.14 -36.97 73.75 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.184 -179.858 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.4 mt -82.16 -27.04 32.91 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.01 0.433 . . . . 0.0 110.48 179.376 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -55.77 -37.73 68.93 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.072 -179.783 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.424 HG22 ' H ' ' A' ' 21' ' ' THR . 1.3 t -76.56 -20.82 56.44 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.633 179.817 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 61.0 mmt-85 -73.7 -3.31 27.52 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 120.769 0.318 . . . . 0.0 110.308 179.67 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 107.0 19.67 9.37 Favored Glycine 0 CA--C 1.526 0.747 0 N-CA-C 110.728 -0.949 . . . . 0.0 110.728 -179.601 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.613 HG12 ' N ' ' A' ' 25' ' ' LYS . 26.2 t -105.35 167.43 3.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 N-CA-C 110.327 -0.249 . . . . 0.0 110.327 -179.934 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.613 ' N ' HG12 ' A' ' 24' ' ' VAL . 99.6 mttt -125.86 131.99 52.28 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.348 179.359 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.431 HG11 ' HB3' ' A' ' 16' ' ' LYS . 1.7 m -134.79 108.94 11.09 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.289 0 CA-C-N 116.506 -0.315 . . . . 0.0 110.355 179.838 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.6 ' HD3' ' H ' ' A' ' 29' ' ' ALA . 14.5 tmtt? -109.25 161.72 14.97 Favored 'General case' 0 C--O 1.221 -0.398 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 179.976 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.478 ' CE2' HD21 ' A' ' 32' ' ' LEU . 58.0 t80 -40.58 -29.58 0.09 Allowed 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.095 0.474 . . . . 0.0 110.966 179.588 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.6 ' H ' ' HD3' ' A' ' 27' ' ' LYS . . . -60.65 -24.44 65.56 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.835 -179.797 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.84 -45.77 91.05 Favored 'General case' 0 C--O 1.221 -0.426 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.406 -179.335 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.494 ' H ' HD12 ' A' ' 31' ' ' LEU . 5.5 mp -64.77 -41.03 96.17 Favored 'General case' 0 C--O 1.216 -0.693 0 CA-C-O 120.989 0.423 . . . . 0.0 110.156 179.591 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.478 HD21 ' CE2' ' A' ' 28' ' ' TYR . 56.2 mt -55.34 -46.1 76.4 Favored 'General case' 0 C--N 1.316 -0.869 0 C-N-CA 119.453 -0.899 . . . . 0.0 111.118 -178.765 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 63.9 tttm -84.68 -50.45 7.63 Favored 'General case' 0 C--N 1.32 -0.676 0 C-N-CA 120.496 -0.482 . . . . 0.0 111.771 -179.25 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' PHE . . . . . 0.441 ' O ' HG22 ' A' ' 38' ' ' VAL . 74.9 t80 -61.16 -50.42 73.25 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.312 -178.786 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.485 ' CB ' ' O ' ' A' ' 31' ' ' LEU . 17.7 t80 -60.75 -46.12 91.66 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.29 -179.36 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 91.7 m-20 -70.17 -25.27 63.36 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 120.601 -0.44 . . . . 0.0 111.339 -179.541 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -65.03 -53.43 46.05 Favored 'General case' 0 N--CA 1.462 0.143 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.593 -179.074 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.505 ' O ' ' N ' ' A' ' 42' ' ' CYS . 2.6 m -72.86 -39.46 58.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 C-N-CA 120.481 -0.488 . . . . 0.0 111.037 -179.579 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 25.1 mmtt -57.93 -25.82 61.4 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.724 -179.528 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 85.3 m-20 -49.84 -63.6 1.06 Allowed 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 120.684 -0.406 . . . . 0.0 111.004 179.933 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.4 ' C ' ' SG ' ' A' ' 42' ' ' CYS . 1.6 p -114.59 -11.01 12.45 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.538 -0.301 . . . . 0.0 111.319 -179.939 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' CYS . . . . . 0.505 ' N ' ' O ' ' A' ' 38' ' ' VAL . 1.5 m 63.72 47.35 0.77 Allowed Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.697 -179.385 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' PRO . . . . . 0.499 ' CD ' ' N ' ' A' ' 42' ' ' CYS . 57.9 Cg_endo -72.23 -30.45 13.03 Favored 'Trans proline' 0 N--CA 1.493 1.458 0 C-N-CA 122.699 2.266 . . . . 0.0 112.432 179.928 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' TRP . . . . . 0.69 ' CE2' H141 ' A' ' 201' ' ' MYR . 2.0 t-105 -58.32 -3.41 0.27 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.433 -179.643 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.494 ' H ' ' C ' ' A' ' 43' ' ' PRO . 2.9 t80 50.45 53.45 14.06 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.168 0.508 . . . . 0.0 110.16 -179.837 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.477 ' CD ' ' N ' ' A' ' 45' ' ' PHE . 38.3 Cg_endo -67.94 -12.35 35.01 Favored 'Trans proline' 0 C--N 1.308 -1.602 0 C-N-CA 122.835 2.357 . . . . 0.0 112.065 179.846 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 52.9 tt0 -59.11 -46.43 88.35 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.194 -179.688 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.515 ' O ' ' H42' ' A' ' 201' ' ' MYR . 44.9 tt0 -89.27 -18.03 27.82 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.029 0.443 . . . . 0.0 110.332 179.584 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 49' ' ' GLY . . . . . 0.789 ' O ' ' H71' ' A' ' 201' ' ' MYR . . . 77.11 66.56 1.79 Allowed Glycine 0 CA--C 1.525 0.696 0 N-CA-C 110.247 -1.141 . . . . 0.0 110.247 -178.921 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' THR . . . . . 0.506 ' OG1' ' NE2' ' A' ' 98' ' ' GLN . 2.9 t -138.0 155.67 48.61 Favored 'General case' 0 C--N 1.33 -0.282 0 C-N-CA 121.043 -0.263 . . . . 0.0 110.658 -179.548 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.429 ' HA ' ' HE1' ' A' ' 44' ' ' TRP . 1.5 mt -87.7 140.6 15.54 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.2 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.305 179.3 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' ASP . . . . . 0.432 ' OD2' ' O ' ' A' ' 43' ' ' PRO . 69.8 m-20 -111.14 120.12 41.25 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.191 179.631 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.511 ' CG1' HD12 ' A' ' 90' ' ' ILE . 24.9 mm -94.78 -56.07 5.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.893 179.215 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -78.0 -49.41 14.12 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.561 -179.464 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.569 ' CG ' HH21 ' A' ' 58' ' ' ARG . 83.8 mtt85 -59.95 -32.59 70.95 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.132 -0.486 . . . . 0.0 109.958 -179.708 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' TRP . . . . . 0.748 ' HE1' ' HE1' ' A' ' 83' ' ' TRP . 18.2 t-105 -62.89 -39.9 95.91 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.52 179.359 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 83.6 mtp180 -63.48 -35.24 79.8 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.444 -179.794 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' ARG . . . . . 0.569 HH21 ' CG ' ' A' ' 55' ' ' ARG . 43.6 mtm-85 -60.16 -50.92 71.77 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 120.509 -0.476 . . . . 0.0 111.006 -179.96 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.405 HG13 ' N ' ' A' ' 60' ' ' GLY . 7.4 p -73.96 -39.48 51.39 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.377 0 C-N-CA 120.861 -0.335 . . . . 0.0 110.644 179.581 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' GLY . . . . . 0.433 ' O ' ' CB ' ' A' ' 64' ' ' GLN . . . -63.07 -49.21 73.67 Favored Glycine 0 C--O 1.222 -0.634 0 N-CA-C 111.353 -0.699 . . . . 0.0 111.353 -179.225 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 66.2 t0 -61.82 -44.87 95.99 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 120.625 0.25 . . . . 0.0 111.156 -179.497 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' CYS . . . . . 0.436 ' SG ' ' O ' ' A' ' 58' ' ' ARG . 73.3 m -62.9 -55.83 22.57 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.207 -179.227 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 12.6 m-85 -64.22 -43.23 95.63 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.1 -179.821 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' GLN . . . . . 0.585 ' HG2' HD22 ' A' ' 68' ' ' ASN . 61.3 tt0 -62.37 -39.82 94.43 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.651 -179.45 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -57.01 -54.07 50.93 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 120.765 -0.374 . . . . 0.0 110.849 -179.865 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 66.4 m-85 -67.86 -39.77 83.72 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.706 179.764 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.523 ' O ' ' N ' ' A' ' 71' ' ' GLY . 57.1 t80 -58.75 -41.88 87.52 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.427 -179.501 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 68' ' ' ASN . . . . . 0.585 HD22 ' HG2' ' A' ' 64' ' ' GLN . 39.9 m-20 -62.79 -45.29 93.35 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.331 -178.964 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 24.6 p -74.98 -20.12 59.8 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 120.608 -0.437 . . . . 0.0 109.985 -179.433 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 47.6 m-85 -114.11 16.28 18.14 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.401 179.945 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' GLY . . . . . 0.523 ' N ' ' O ' ' A' ' 67' ' ' TYR . . . -154.18 -111.03 0.41 Allowed Glycine 0 CA--C 1.534 1.239 0 N-CA-C 111.06 -0.816 . . . . 0.0 111.06 -179.984 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -73.06 140.1 30.78 Favored 'Trans proline' 0 N--CA 1.494 1.548 0 C-N-CA 121.989 1.793 . . . . 0.0 113.177 -179.34 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 80.7 mm-40 -86.28 -42.84 13.41 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.487 179.326 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.694 ' CD ' ' H ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -80.78 -24.63 38.48 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.027 179.933 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.498 ' H ' ' HD3' ' A' ' 74' ' ' LYS . 75.2 t 53.91 101.04 0.03 OUTLIER Pre-proline 0 N--CA 1.449 -0.481 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.189 -179.719 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 44.5 Cg_exo -55.05 129.28 34.44 Favored 'Trans proline' 0 N--CA 1.492 1.413 0 C-N-CA 121.666 1.578 . . . . 0.0 111.758 179.845 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.504 ' O ' HG12 ' A' ' 77' ' ' VAL . 48.3 t -82.31 -6.81 10.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.835 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 43.2 p -44.26 -23.23 0.09 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.64 -179.817 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' ALA . . . . . 0.407 ' N ' ' C ' ' A' ' 77' ' ' VAL . . . -57.62 -28.91 64.09 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.079 0.466 . . . . 0.0 110.431 179.73 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 48.8 t80 -61.19 -39.63 90.9 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.153 179.529 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 66.9 m -56.14 -40.14 73.36 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.391 -179.9 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 14.2 m-85 -60.99 -48.94 79.49 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 120.737 -0.385 . . . . 0.0 110.792 179.65 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' TRP . . . . . 0.748 ' HE1' ' HE1' ' A' ' 56' ' ' TRP . 40.5 m0 -57.72 -36.11 71.58 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.57 -179.652 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 78.7 m-20 -62.77 -47.47 83.37 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 120.388 -0.525 . . . . 0.0 110.899 -179.863 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 36.7 tp -71.25 -52.47 18.84 Favored 'General case' 0 C--O 1.219 -0.524 0 C-N-CA 120.333 -0.547 . . . . 0.0 110.588 179.611 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -58.42 -26.68 31.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 C-N-CA 120.804 -0.358 . . . . 0.0 110.552 -179.889 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.405 ' CB ' ' O ' ' A' ' 83' ' ' TRP . 63.4 tttt -65.97 -49.65 67.12 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.634 179.884 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.1 pp20? -80.07 -20.72 44.53 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.007 -179.665 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.538 ' O ' HD13 ' A' ' 89' ' ' LEU . 0.2 OUTLIER -61.49 -47.12 87.11 Favored 'General case' 0 N--CA 1.443 -0.793 0 C-N-CA 120.172 -0.611 . . . . 0.0 110.322 -179.111 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.511 HD12 ' CG1' ' A' ' 53' ' ' ILE . 3.4 mt -64.4 -44.4 97.11 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.156 0 C-N-CA 120.174 -0.611 . . . . 0.0 109.775 -179.815 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 91' ' ' ASP . . . . . 0.458 ' O ' ' OD1' ' A' ' 91' ' ' ASP . 64.6 t0 -62.19 -37.22 84.46 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.063 -179.16 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 92' ' ' LYS . . . . . 0.639 ' O ' HG23 ' A' ' 95' ' ' VAL . 26.6 tttm -42.12 145.57 0.36 Allowed 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.929 0.395 . . . . 0.0 110.363 -179.58 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 57.5 mttp -79.43 -17.09 55.01 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.669 -179.637 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 71.1 mm-40 -109.64 53.14 0.7 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.642 -179.777 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.639 HG23 ' O ' ' A' ' 92' ' ' LYS . 44.9 t -73.09 148.08 9.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-O 120.911 0.386 . . . . 0.0 110.431 179.696 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 96' ' ' ASN . . . . . 0.614 ' O ' ' N ' ' A' ' 98' ' ' GLN . 0.0 OUTLIER -41.91 166.81 0.07 OUTLIER Pre-proline 0 C--N 1.327 -0.402 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.291 179.971 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_exo -39.59 -13.16 0.02 OUTLIER 'Trans proline' 0 N--CA 1.493 1.471 0 C-N-CA 123.079 2.52 . . . . 0.0 112.713 178.868 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 98' ' ' GLN . . . . . 0.614 ' N ' ' O ' ' A' ' 96' ' ' ASN . 8.8 tt0 -45.4 -31.65 1.77 Allowed 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.101 179.197 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 50.1 t -61.82 -56.43 17.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 C-N-CA 120.333 -0.547 . . . . 0.0 110.503 -178.909 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 88.9 mtp -72.15 -41.37 67.18 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.247 179.564 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -63.36 -28.4 69.97 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.769 -179.192 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 102' ' ' ALA . . . . . 0.438 ' HB2' ' O ' ' A' ' 98' ' ' GLN . . . -65.63 -15.52 62.84 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.507 -179.978 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 76.7 t -60.01 -18.64 16.07 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.487 179.83 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -61.81 -25.98 67.83 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.678 179.982 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 98.6 mm-40 -49.71 103.06 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.938 0.399 . . . . 0.0 110.532 179.998 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 11.0 m -61.66 -43.22 99.26 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.329 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 94.4 mt-10 -117.54 141.33 48.49 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.498 -179.794 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 108' ' ' GLU . . . . . 0.551 ' C ' ' H ' ' A' ' 110' ' ' LEU . 95.2 mt-10 -66.45 133.12 49.78 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 120.644 -0.423 . . . . 0.0 110.132 179.325 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 42.2 pt -55.39 -2.14 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.19 179.466 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.551 ' H ' ' C ' ' A' ' 108' ' ' GLU . 95.6 mt -96.45 5.96 49.75 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-O 120.806 0.336 . . . . 0.0 110.463 -179.762 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -114.45 129.68 56.67 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.385 179.904 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 30.2 p -136.86 -119.94 0.15 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.273 179.884 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 113' ' ' ASN . . . . . 0.416 ' C ' ' OD1' ' A' ' 113' ' ' ASN . 43.4 t-20 -64.39 -41.39 96.7 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.371 179.8 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 68.6 m -134.27 154.8 51.08 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.61 -179.848 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 115' ' ' GLN . . . . . 0.446 ' O ' ' O ' ' A' ' 118' ' ' LEU . 87.4 mt-30 -87.08 85.42 7.23 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.391 179.9 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 7.3 m -63.58 -45.26 91.23 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.63 -179.771 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 72.7 m-20 -61.53 -45.12 95.52 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.763 -179.397 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.446 ' O ' ' O ' ' A' ' 115' ' ' GLN . 91.1 mt -116.49 123.91 48.64 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.435 179.877 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 88.9 mt-10 -110.45 124.01 50.96 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-O 120.655 0.264 . . . . 0.0 110.425 179.954 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 41.7 m80 -115.75 147.45 40.92 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.465 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 96.9 m-70 -111.43 143.93 41.46 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.455 -179.824 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 67.2 m80 -66.12 -40.6 90.81 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.631 -179.929 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 32.7 m170 -122.22 135.28 54.74 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.54 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 124' ' ' HIS . . . . . . . . . . . . . 44.7 t60 -60.67 -45.36 94.41 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.552 -179.881 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 60.5 t-80 . . . . . 0 C--O 1.22 -0.453 0 CA-C-O 117.967 -1.016 . . . . 0.0 110.573 179.948 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 201' ' ' MYR . . . . . 0.789 ' H71' ' O ' ' A' ' 49' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 2' ' ' GLY . . . . . 0.526 ' O ' ' N ' ' A' ' 6' ' ' SER . . . . . . . . 0 CA--C 1.523 0.592 0 N-CA-C 110.464 -1.054 . . . . 0.0 110.464 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 20.6 pt20 -43.09 -24.94 0.09 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.847 0.356 . . . . 0.0 110.658 -179.679 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.415 ' N ' ' O ' ' A' ' 2' ' ' GLY . 98.0 mt-10 -73.8 -64.69 0.95 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.69 -179.862 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.734 HD12 ' N ' ' A' ' 6' ' ' SER . 4.0 pp -83.83 -41.07 17.9 Favored 'General case' 0 C--O 1.223 -0.32 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.246 -179.944 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.734 ' N ' HD12 ' A' ' 5' ' ' LEU . 16.5 m -49.95 -45.91 51.77 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 120.823 -0.351 . . . . 0.0 110.695 -178.7 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' GLN . . . . . 0.583 ' NE2' ' O ' ' A' ' 46' ' ' PRO . 25.2 mt-30 -62.14 -29.18 70.16 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 120.751 -0.38 . . . . 0.0 110.536 179.483 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' HIS . . . . . 0.489 ' O ' HG23 ' A' ' 12' ' ' VAL . 33.3 m170 -80.15 -53.41 6.71 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.807 0.336 . . . . 0.0 111.616 -179.408 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 80.4 mm-40 -65.78 -43.7 87.98 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.282 -179.096 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.536 ' O ' ' N ' ' A' ' 14' ' ' GLN . 96.1 mtt-85 -68.98 -55.24 11.52 Favored 'General case' 0 C--O 1.216 -0.668 0 C-N-CA 120.531 -0.468 . . . . 0.0 110.582 -179.369 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.434 ' CD1' H143 ' A' ' 201' ' ' MYR . 46.3 t80 -46.68 -38.7 10.18 Favored 'General case' 0 C--N 1.319 -0.759 0 C-N-CA 119.793 -0.763 . . . . 0.0 110.903 -179.215 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.489 HG23 ' O ' ' A' ' 8' ' ' HIS . 73.9 t -71.41 -60.15 2.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 N-CA-C 112.337 0.495 . . . . 0.0 112.337 -179.389 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.477 ' O ' ' CB ' ' A' ' 17' ' ' GLN . 95.3 mt-10 -80.16 -47.68 14.34 Favored 'General case' 0 C--O 1.213 -0.861 0 C-N-CA 120.804 -0.359 . . . . 0.0 111.431 -178.77 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' GLN . . . . . 0.536 ' N ' ' O ' ' A' ' 10' ' ' ARG . 51.5 tp60 -50.9 -44.16 59.94 Favored 'General case' 0 C--N 1.317 -0.83 0 C-N-CA 120.794 -0.363 . . . . 0.0 110.577 -179.192 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.5 HD13 ' O ' ' A' ' 15' ' ' LEU . 0.2 OUTLIER -78.01 -59.15 2.9 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 120.123 -0.631 . . . . 0.0 111.896 -179.041 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.667 ' HB3' HG11 ' A' ' 26' ' ' VAL . 98.5 mttt -56.8 -35.49 68.8 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.882 -178.54 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' GLN . . . . . 0.477 ' CB ' ' O ' ' A' ' 13' ' ' GLU . 60.3 tt0 -71.61 -40.24 69.95 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.499 179.885 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -55.64 -32.8 63.48 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 -179.783 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.444 HD13 ' CZ ' ' A' ' 82' ' ' TYR . 3.5 mt -86.09 -31.81 21.7 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.151 179.132 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -51.62 -43.97 62.73 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.933 -178.696 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.462 HG22 ' H ' ' A' ' 21' ' ' THR . 0.2 OUTLIER -64.96 -30.45 71.44 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.577 179.91 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 78.5 mmt-85 -67.7 -7.56 28.01 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.318 -179.772 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 107.17 19.52 9.4 Favored Glycine 0 CA--C 1.525 0.683 0 N-CA-C 111.121 -0.792 . . . . 0.0 111.121 179.696 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.63 HG12 ' N ' ' A' ' 25' ' ' LYS . 38.8 t -101.82 167.95 2.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 N-CA-C 110.212 -0.292 . . . . 0.0 110.212 179.897 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.63 ' N ' HG12 ' A' ' 24' ' ' VAL . 99.0 mttt -132.74 144.63 50.41 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.399 179.57 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.667 HG11 ' HB3' ' A' ' 16' ' ' LYS . 30.0 m -132.12 130.55 60.93 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.354 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.699 179.91 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 14.3 pttp -109.81 163.78 13.2 Favored 'General case' 0 C--O 1.228 -0.056 0 CA-C-O 120.741 0.305 . . . . 0.0 110.499 179.66 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 93.6 m-85 -49.77 -32.13 13.14 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.959 0.409 . . . . 0.0 110.519 179.999 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -55.12 -24.35 25.6 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.39 179.84 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.46 ' O ' ' CB ' ' A' ' 34' ' ' PHE . 99.0 m-20 -64.44 -46.1 84.62 Favored 'General case' 0 C--O 1.22 -0.492 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.808 -179.987 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.478 ' O ' ' CB ' ' A' ' 35' ' ' PHE . 5.3 mp -63.53 -40.42 96.99 Favored 'General case' 0 C--N 1.315 -0.902 0 C-N-CA 120.23 -0.588 . . . . 0.0 110.407 -179.747 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 30.8 mt -58.8 -49.78 76.39 Favored 'General case' 0 C--N 1.313 -0.98 0 C-N-CA 119.634 -0.826 . . . . 0.0 111.549 -178.179 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -87.75 -51.19 6.0 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 112.591 0.589 . . . . 0.0 112.591 -178.58 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' PHE . . . . . 0.682 ' O ' HG22 ' A' ' 38' ' ' VAL . 9.7 t80 -59.68 -50.25 74.56 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.805 -178.344 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.478 ' CB ' ' O ' ' A' ' 31' ' ' LEU . 10.0 t80 -63.47 -47.91 79.82 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.499 -0.48 . . . . 0.0 110.666 -179.966 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 55.1 t0 -67.69 -29.19 68.39 Favored 'General case' 0 N--CA 1.456 -0.145 0 C-N-CA 120.426 -0.51 . . . . 0.0 111.176 -179.418 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.572 ' CZ ' HG22 ' A' ' 59' ' ' VAL . 9.9 t80 -66.34 -51.53 56.25 Favored 'General case' 0 C--N 1.332 -0.173 0 C-N-CA 120.642 -0.423 . . . . 0.0 111.611 -178.255 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.682 HG22 ' O ' ' A' ' 34' ' ' PHE . 9.1 m -76.47 -39.14 33.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.95 -179.708 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -62.74 -26.78 68.86 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.596 -179.555 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 40.5 t0 -52.97 -52.95 56.43 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.856 -179.299 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 12.0 p -114.07 -6.65 13.1 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.143 179.947 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' CYS . . . . . 0.522 ' N ' ' O ' ' A' ' 38' ' ' VAL . 3.3 m 43.44 56.52 12.22 Favored Pre-proline 0 CA--C 1.532 0.267 0 CA-C-O 120.885 0.374 . . . . 0.0 110.28 -178.967 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' PRO . . . . . 0.539 ' C ' ' H ' ' A' ' 45' ' ' PHE . 61.2 Cg_endo -79.34 -15.19 12.76 Favored 'Trans proline' 0 C--N 1.313 -1.304 0 C-N-CA 122.378 2.052 . . . . 0.0 112.428 -179.795 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' TRP . . . . . 0.894 ' NE1' H141 ' A' ' 201' ' ' MYR . 0.0 OUTLIER -69.71 22.06 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.474 -179.238 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.539 ' H ' ' C ' ' A' ' 43' ' ' PRO . 18.1 t80 36.25 68.86 1.33 Allowed Pre-proline 0 C--O 1.233 0.191 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.343 179.981 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.583 ' O ' ' NE2' ' A' ' 7' ' ' GLN . 48.9 Cg_endo -75.18 -0.45 10.04 Favored 'Trans proline' 0 C--N 1.305 -1.751 0 C-N-CA 122.69 2.26 . . . . 0.0 112.189 -179.252 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 86.9 mt-30 -60.31 -52.83 63.6 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 120.604 -0.438 . . . . 0.0 110.538 -179.797 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 58.9 tt0 -89.23 -14.49 35.83 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.778 0.323 . . . . 0.0 110.448 179.717 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' GLY . . . . . 0.471 ' O ' ' CB ' ' A' ' 98' ' ' GLN . . . 72.94 58.02 5.0 Favored Glycine 0 CA--C 1.524 0.63 0 N-CA-C 110.336 -1.106 . . . . 0.0 110.336 -178.929 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 2.6 t -132.54 169.2 16.94 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.886 0.374 . . . . 0.0 110.79 -179.331 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.478 ' CD1' HD23 ' A' ' 89' ' ' LEU . 1.4 mt -85.02 142.17 13.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.434 179.345 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 80.0 m-20 -111.25 121.54 45.53 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.648 -0.705 . . . . 0.0 111.246 179.468 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.459 ' CG1' HD12 ' A' ' 90' ' ' ILE . 31.1 mm -94.11 -55.0 6.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.28 179.231 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -71.96 -55.23 7.83 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-O 120.873 0.368 . . . . 0.0 111.796 -178.708 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 86.5 mtm-85 -57.51 -30.49 65.18 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.178 -0.465 . . . . 0.0 109.999 -179.607 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' TRP . . . . . 0.503 ' CE3' ' CZ3' ' A' ' 44' ' ' TRP . 12.5 t-105 -62.73 -41.36 99.13 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.727 178.856 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 96.5 mtt-85 -63.24 -33.57 75.77 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.453 -179.835 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' ARG . . . . . 0.489 ' O ' ' SG ' ' A' ' 62' ' ' CYS . 96.7 mtt180 -63.14 -51.77 65.15 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.552 -0.459 . . . . 0.0 111.285 -179.384 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.572 HG22 ' CZ ' ' A' ' 37' ' ' PHE . 3.3 p -66.24 -35.52 75.17 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.333 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.678 179.84 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -73.22 -48.87 17.74 Favored Glycine 0 CA--C 1.528 0.861 0 C-N-CA 120.911 -0.662 . . . . 0.0 111.778 -179.674 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 95.8 m-20 -62.92 -44.51 95.88 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.669 0.271 . . . . 0.0 111.473 -179.074 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' CYS . . . . . 0.489 ' SG ' ' O ' ' A' ' 58' ' ' ARG . 74.6 m -60.73 -58.93 6.36 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.877 0.37 . . . . 0.0 110.877 -179.356 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 24.7 m-85 -61.64 -41.0 96.88 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.81 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 53.9 tt0 -60.59 -39.29 87.56 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.5 -0.318 . . . . 0.0 111.055 -179.873 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.472 ' O ' ' OD1' ' A' ' 68' ' ' ASN . 20.2 t0 -58.25 -52.1 67.01 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 120.943 0.402 . . . . 0.0 110.68 -179.704 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 83.6 m-85 -73.18 -41.14 64.18 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 120.473 -0.491 . . . . 0.0 111.309 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 62.6 t80 -57.55 -47.39 82.16 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.803 -178.78 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' ASN . . . . . 0.472 ' OD1' ' O ' ' A' ' 65' ' ' ASP . 0.2 OUTLIER -62.8 -41.65 99.37 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.676 -179.853 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.468 ' N ' ' ND2' ' A' ' 68' ' ' ASN . 40.8 p -66.43 -17.97 65.09 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.268 179.972 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 7.9 m-85 -98.8 14.87 27.28 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.547 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 166.22 -87.71 0.1 OUTLIER Glycine 0 CA--C 1.535 1.328 0 C-N-CA 120.764 -0.731 . . . . 0.0 111.734 179.53 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' PRO . . . . . 0.423 ' O ' ' O ' ' A' ' 68' ' ' ASN . 33.7 Cg_exo -51.13 126.59 19.38 Favored 'Trans proline' 0 N--CA 1.496 1.624 0 C-N-CA 121.866 1.711 . . . . 0.0 112.592 179.938 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.521 ' N ' ' OE1' ' A' ' 73' ' ' GLU . 58.4 mp0 -86.82 -43.93 12.11 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.905 -0.588 . . . . 0.0 110.506 179.286 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.628 ' CD ' ' H ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -104.26 -7.57 19.95 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.108 -179.695 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.419 ' N ' ' HD3' ' A' ' 74' ' ' LYS . 30.2 t 59.41 133.38 0.03 OUTLIER Pre-proline 0 N--CA 1.448 -0.551 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.718 -178.978 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -53.43 129.21 32.58 Favored 'Trans proline' 0 N--CA 1.493 1.459 0 C-N-CA 121.535 1.49 . . . . 0.0 111.238 178.043 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.425 ' O ' ' N ' ' A' ' 80' ' ' PHE . 59.6 t -80.85 -16.54 12.47 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.687 179.891 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 65.7 p -45.94 -22.82 0.23 Allowed 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.945 0.402 . . . . 0.0 110.072 -179.931 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -67.6 -34.8 77.74 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.68 179.403 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' PHE . . . . . 0.425 ' N ' ' O ' ' A' ' 77' ' ' VAL . 10.2 m-85 -57.74 -35.38 70.63 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.33 -179.633 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 94.9 p -60.36 -40.29 90.22 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.355 179.87 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' TYR . . . . . 0.444 ' CZ ' HD13 ' A' ' 19' ' ' LEU . 13.8 m-85 -60.17 -49.39 77.81 Favored 'General case' 0 C--O 1.223 -0.29 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.797 179.81 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 83' ' ' TRP . . . . . 0.519 ' N ' ' CD1' ' A' ' 83' ' ' TRP . 9.6 m0 -59.12 -40.39 85.24 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.311 179.956 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 78.0 m-20 -62.68 -43.23 99.33 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 120.691 -0.404 . . . . 0.0 110.572 -179.923 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -70.25 -55.43 9.29 Favored 'General case' 0 C--O 1.221 -0.416 0 N-CA-C 110.215 -0.291 . . . . 0.0 110.215 179.409 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -60.88 -25.52 35.95 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.884 0 C-N-CA 120.959 -0.296 . . . . 0.0 110.717 -179.66 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.426 ' CB ' ' O ' ' A' ' 83' ' ' TRP . 42.2 tttp -65.26 -50.16 66.83 Favored 'General case' 0 C--N 1.317 -0.807 0 C-N-CA 120.467 -0.493 . . . . 0.0 110.555 179.716 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.1 pp20? -80.34 -19.69 45.91 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.679 -179.891 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.478 HD23 ' CD1' ' A' ' 51' ' ' ILE . 14.5 tp -61.5 -45.02 96.0 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.354 -179.015 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.459 HD12 ' CG1' ' A' ' 53' ' ' ILE . 3.6 mt -65.04 -43.86 95.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 C-N-CA 120.293 -0.563 . . . . 0.0 109.956 -179.778 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 94.1 m-20 -65.16 -8.02 15.15 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.841 -178.938 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 84.7 tttt -66.9 146.13 54.73 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.42 179.91 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -61.7 -41.64 97.87 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.661 -179.843 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 94' ' ' GLU . . . . . 0.46 ' O ' ' C ' ' A' ' 95' ' ' VAL . 97.9 mt-10 -77.66 6.94 6.34 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.828 -179.82 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.46 ' C ' ' O ' ' A' ' 94' ' ' GLU . 2.7 m 30.72 -110.62 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.283 0 O-C-N 123.692 0.62 . . . . 0.0 110.707 -179.806 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 96' ' ' ASN . . . . . 0.531 ' O ' ' N ' ' A' ' 98' ' ' GLN . 0.8 OUTLIER -153.32 160.86 30.43 Favored Pre-proline 0 N--CA 1.45 -0.438 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.568 179.356 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 97' ' ' PRO . . . . . 0.482 ' O ' ' N ' ' A' ' 99' ' ' VAL . 53.7 Cg_exo -44.5 -12.23 0.05 OUTLIER 'Trans proline' 0 C--N 1.31 -1.473 0 C-N-CA 122.689 2.259 . . . . 0.0 112.146 178.974 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 98' ' ' GLN . . . . . 0.531 ' N ' ' O ' ' A' ' 96' ' ' ASN . 6.0 pt20 -46.27 -15.39 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.896 -179.861 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 99' ' ' VAL . . . . . 0.482 ' N ' ' O ' ' A' ' 97' ' ' PRO . 74.9 t -60.83 -49.37 84.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 C-N-CA 120.834 -0.347 . . . . 0.0 111.017 -179.442 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 97.9 mmm -73.01 -43.15 62.48 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.922 0.391 . . . . 0.0 111.056 -179.748 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 101' ' ' ALA . . . . . 0.728 ' HB2' ' H51' ' A' ' 201' ' ' MYR . . . -63.95 -21.65 66.58 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.482 -179.737 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -55.99 -15.32 3.34 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.656 -179.906 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 51.6 t -63.63 -21.26 28.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.414 179.516 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -55.69 -46.69 77.58 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.611 -179.864 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 88.0 mt-30 -86.04 110.41 19.49 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.317 -0.402 . . . . 0.0 110.576 179.899 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 24.1 p -66.98 -31.95 72.86 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.623 179.912 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 85.4 mt-10 -56.99 142.52 41.62 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.385 -179.587 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 108' ' ' GLU . . . . . 0.555 ' C ' ' H ' ' A' ' 110' ' ' LEU . 92.2 mt-10 -65.4 136.25 56.26 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.768 -0.373 . . . . 0.0 110.201 179.626 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 45.3 pt -61.14 4.14 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.364 179.622 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.555 ' H ' ' C ' ' A' ' 108' ' ' GLU . 96.4 mt -101.73 -5.98 24.26 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.892 0.377 . . . . 0.0 110.538 -179.735 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 63.2 tttm -102.37 128.77 48.81 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.683 -179.969 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 112' ' ' SER . . . . . 0.532 ' OG ' ' N ' ' A' ' 113' ' ' ASN . 3.1 p -87.57 -147.13 0.14 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.463 -179.875 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 113' ' ' ASN . . . . . 0.532 ' N ' ' OG ' ' A' ' 112' ' ' SER . 90.5 m-20 -62.09 -42.32 99.09 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.385 -179.442 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 92.9 p -153.86 -5.74 0.17 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.582 179.941 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 94.9 mm-40 -70.82 150.3 45.96 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.422 -179.695 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 73.1 p -72.8 169.73 16.14 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.405 -179.873 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 88.8 m-20 -62.62 -17.44 60.29 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.47 -179.69 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 82.2 mt -63.47 -40.66 97.69 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.403 179.503 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 55.49 78.57 0.18 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.539 -179.921 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 58.1 t-80 -61.66 -44.92 96.05 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.558 -179.752 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 74.4 m-70 -99.5 123.53 43.85 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.38 179.973 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 58.0 t-80 -60.51 -42.46 96.45 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.591 -179.909 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 98.5 m-70 -109.02 143.38 38.4 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.456 -179.945 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 124' ' ' HIS . . . . . . . . . . . . . 76.2 m80 -61.07 -42.52 98.65 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.458 -179.78 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 79.3 m80 . . . . . 0 C--O 1.22 -0.478 0 CA-C-O 117.99 -1.005 . . . . 0.0 110.581 -179.959 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 201' ' ' MYR . . . . . 0.894 H141 ' NE1' ' A' ' 44' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.752 0 N-CA-C 110.984 -0.846 . . . . 0.0 110.984 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 88.1 mt-30 -64.24 -38.97 92.95 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.779 0.323 . . . . 0.0 110.733 179.997 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.774 ' OE1' ' HB2' ' A' ' 101' ' ' ALA . 90.4 mt-10 -47.96 -22.95 0.66 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.509 -179.969 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 51.8 tp -41.97 -34.57 0.71 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.26 -179.55 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 42.6 m -55.09 -42.05 72.34 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.077 0.465 . . . . 0.0 110.327 -179.899 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' GLN . . . . . 0.412 ' N ' ' O ' ' A' ' 4' ' ' GLU . 95.2 mt-30 -61.1 -30.8 70.57 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.883 -0.598 . . . . 0.0 110.689 179.614 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 59.4 t-80 -62.1 -41.72 98.5 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.023 0.439 . . . . 0.0 110.117 179.72 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 80.1 mm-40 -60.27 -46.65 89.07 Favored 'General case' 0 C--O 1.245 0.819 0 CA-C-O 121.562 0.696 . . . . 0.0 110.026 179.937 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.41 ' O ' ' CB ' ' A' ' 14' ' ' GLN . 24.5 mtm180 -63.48 -29.02 70.37 Favored 'General case' 0 C--O 1.217 -0.608 0 C-N-CA 120.241 -0.583 . . . . 0.0 109.799 179.506 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 37.8 t80 -62.86 -36.71 84.16 Favored 'General case' 0 C--N 1.328 -0.327 0 O-C-N 123.562 0.539 . . . . 0.0 109.888 179.902 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 3.7 t -62.66 -48.32 88.71 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 C-N-CA 119.837 -0.745 . . . . 0.0 110.834 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 79.8 mm-40 -80.87 -38.9 27.31 Favored 'General case' 0 C--N 1.322 -0.595 0 C-N-CA 119.935 -0.706 . . . . 0.0 111.767 -179.173 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' GLN . . . . . 0.41 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 63.9 tp60 -65.38 -53.05 48.92 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.538 -0.755 . . . . 0.0 110.865 -179.171 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.577 HD13 ' O ' ' A' ' 15' ' ' LEU . 0.3 OUTLIER -63.12 -45.86 90.02 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.453 -0.499 . . . . 0.0 109.917 -179.126 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 53.8 mttp -54.82 -32.5 60.48 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 120.204 -0.599 . . . . 0.0 110.503 179.79 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 59.9 tt0 -67.16 -41.32 86.19 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.556 179.994 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -57.58 -30.35 65.2 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.617 -0.72 . . . . 0.0 109.763 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.2 mt -86.44 -28.82 23.28 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.253 0.549 . . . . 0.0 110.651 178.848 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -51.12 -43.02 61.06 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.779 -178.784 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.73 -28.87 69.89 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.55 179.762 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 82.8 mmt-85 -71.01 -6.34 38.21 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.353 -179.831 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 108.04 20.12 8.57 Favored Glycine 0 CA--C 1.524 0.65 0 N-CA-C 111.16 -0.776 . . . . 0.0 111.16 179.93 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.609 HG12 ' N ' ' A' ' 25' ' ' LYS . 18.3 t -102.29 169.38 1.88 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 N-CA-C 110.345 -0.243 . . . . 0.0 110.345 179.857 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.609 ' N ' HG12 ' A' ' 24' ' ' VAL . 99.4 mttt -115.43 146.69 41.38 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.368 179.803 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.474 ' O ' HG23 ' A' ' 26' ' ' VAL . 2.3 m -115.31 23.4 5.34 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.272 0 CA-C-O 120.996 0.427 . . . . 0.0 110.662 -179.584 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.517 ' N ' ' OD2' ' A' ' 30' ' ' ASP . 33.5 pttt -51.97 163.58 0.34 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.219 -179.712 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 75.8 m-85 -58.15 -35.83 72.12 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.819 -0.352 . . . . 0.0 110.654 -179.727 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.42 ' HB3' ' HD2' ' A' ' 27' ' ' LYS . . . -53.84 -23.8 13.6 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.691 -179.953 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.517 ' OD2' ' N ' ' A' ' 27' ' ' LYS . 59.3 m-20 -63.5 -46.68 84.97 Favored 'General case' 0 C--O 1.223 -0.335 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.685 -179.509 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.502 ' H ' HD12 ' A' ' 31' ' ' LEU . 5.4 mp -67.28 -41.09 86.03 Favored 'General case' 0 C--O 1.221 -0.446 0 CA-C-O 121.251 0.548 . . . . 0.0 110.487 179.575 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.411 HD12 ' HA ' ' A' ' 29' ' ' ALA . 55.7 mt -56.73 -44.84 82.06 Favored 'General case' 0 C--N 1.314 -0.948 0 C-N-CA 119.546 -0.862 . . . . 0.0 111.057 -178.927 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 86.5 tttt -86.09 -49.38 7.82 Favored 'General case' 0 C--N 1.32 -0.714 0 C-N-CA 120.475 -0.49 . . . . 0.0 111.421 -178.922 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 58.0 t80 -61.93 -49.88 74.36 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.237 -178.687 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.482 ' CB ' ' O ' ' A' ' 31' ' ' LEU . 7.9 t80 -62.96 -46.9 85.57 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.189 -179.827 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 94.4 m-20 -65.31 -34.32 78.07 Favored 'General case' 0 C--N 1.347 0.477 0 CA-C-O 120.721 0.296 . . . . 0.0 111.167 -179.432 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.458 ' CE2' ' CD2' ' A' ' 63' ' ' PHE . 1.9 m-85 -60.53 -47.85 84.35 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.919 0.39 . . . . 0.0 111.111 -179.053 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.529 ' O ' ' N ' ' A' ' 42' ' ' CYS . 27.8 m -77.82 -40.2 26.98 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.592 -179.704 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.43 ' N ' HG23 ' A' ' 38' ' ' VAL . 88.2 tttt -56.59 -26.93 56.78 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.635 -179.847 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 93.2 m-20 -54.4 -62.38 1.69 Allowed 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 120.748 -0.381 . . . . 0.0 111.292 -179.043 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.478 ' O ' ' SG ' ' A' ' 42' ' ' CYS . 45.8 p -114.0 5.53 16.14 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.101 -179.506 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' CYS . . . . . 0.529 ' N ' ' O ' ' A' ' 38' ' ' VAL . 28.1 p 37.5 57.97 4.28 Favored Pre-proline 0 N--CA 1.465 0.288 0 CA-C-O 120.772 0.32 . . . . 0.0 110.341 -179.235 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 69.3 Cg_endo -75.79 -11.92 20.04 Favored 'Trans proline' 0 C--N 1.312 -1.343 0 C-N-CA 122.779 2.32 . . . . 0.0 112.339 -179.312 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' TRP . . . . . 0.463 ' NE1' H141 ' A' ' 201' ' ' MYR . 0.0 OUTLIER -82.5 12.48 4.51 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.024 -179.569 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.454 ' CE1' ' OE1' ' A' ' 47' ' ' GLN . 21.3 t80 39.85 54.59 5.99 Favored Pre-proline 0 C--N 1.331 -0.206 0 CA-C-O 120.864 0.364 . . . . 0.0 110.227 179.882 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.438 ' CD ' ' N ' ' A' ' 45' ' ' PHE . 19.1 Cg_endo -58.88 -2.62 1.18 Allowed 'Trans proline' 0 C--N 1.308 -1.598 0 C-N-CA 122.898 2.399 . . . . 0.0 112.256 -179.522 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.454 ' OE1' ' CE1' ' A' ' 45' ' ' PHE . 88.2 mt-30 -60.73 -52.62 64.33 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.238 179.933 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.427 ' O ' ' H51' ' A' ' 201' ' ' MYR . 76.9 tt0 -89.09 -21.92 23.15 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-O 121.053 0.454 . . . . 0.0 110.397 179.104 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' GLY . . . . . 0.477 ' O ' ' H71' ' A' ' 201' ' ' MYR . . . 78.89 63.24 2.11 Favored Glycine 0 CA--C 1.523 0.554 0 N-CA-C 110.534 -1.026 . . . . 0.0 110.534 -179.486 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' THR . . . . . 0.427 ' OG1' ' NE2' ' A' ' 98' ' ' GLN . 11.2 t -137.19 160.8 37.96 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.836 0.351 . . . . 0.0 110.748 -179.411 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.3 mt -83.53 133.53 28.95 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.425 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.521 179.603 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -116.95 120.83 39.64 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.373 -0.83 . . . . 0.0 110.345 179.298 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 20.3 mm -91.43 -48.13 13.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.922 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -63.17 -44.98 93.91 Favored 'General case' 0 C--O 1.238 0.46 0 CA-C-O 121.255 0.55 . . . . 0.0 110.66 -179.399 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 85.0 mtt85 -64.14 -34.36 77.89 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.115 -0.493 . . . . 0.0 109.903 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 29.4 t-105 -59.39 -39.13 82.38 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-O 121.125 0.488 . . . . 0.0 110.4 -179.466 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 83.7 mtp180 -64.12 -39.08 93.26 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.347 179.949 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' ARG . . . . . 0.442 ' O ' ' OD2' ' A' ' 61' ' ' ASP . 83.9 mtt85 -60.88 -52.06 66.64 Favored 'General case' 0 C--N 1.331 -0.228 0 C-N-CA 120.715 -0.394 . . . . 0.0 111.209 -179.972 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 5.9 p -69.01 -31.05 48.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.13 179.179 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -67.71 -44.58 80.61 Favored Glycine 0 CA--C 1.526 0.74 0 N-CA-C 111.344 -0.703 . . . . 0.0 111.344 -179.819 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' ASP . . . . . 0.442 ' OD2' ' O ' ' A' ' 58' ' ' ARG . 0.5 OUTLIER -65.87 -38.01 87.66 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.779 0.323 . . . . 0.0 110.609 -179.42 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 76.1 m -64.98 -49.57 69.78 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.04 0.448 . . . . 0.0 110.678 -179.45 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' PHE . . . . . 0.458 ' CD2' ' CE2' ' A' ' 37' ' ' PHE . 12.0 m-85 -67.29 -28.94 68.43 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.282 179.626 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 56.9 tt0 -61.48 -45.42 94.32 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 120.658 -0.417 . . . . 0.0 110.967 -179.872 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 24.4 t0 -62.97 -51.83 65.37 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.005 0.431 . . . . 0.0 110.595 179.699 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 54.1 m-85 -62.34 -32.81 73.64 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.037 -0.528 . . . . 0.0 110.234 179.819 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.416 ' OH ' ' CD ' ' A' ' 76' ' ' PRO . 58.2 t80 -61.83 -40.2 94.46 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.312 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 88.6 m-20 -63.96 -39.92 95.23 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.343 -179.626 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 61.4 p -49.3 -34.3 15.17 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.693 -179.31 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 69.1 m-85 -65.58 -47.0 77.25 Favored 'General case' 0 C--N 1.322 -0.609 0 C-N-CA 120.075 -0.65 . . . . 0.0 111.134 -179.906 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' GLY . . . . . 0.497 ' H ' ' HD3' ' A' ' 72' ' ' PRO . . . 110.91 71.48 0.64 Allowed Glycine 0 N--CA 1.472 1.036 0 N-CA-C 110.853 -0.899 . . . . 0.0 110.853 -179.545 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 72' ' ' PRO . . . . . 0.497 ' HD3' ' H ' ' A' ' 71' ' ' GLY . 24.5 Cg_exo -62.78 142.06 87.46 Favored 'Trans proline' 0 C--N 1.305 -1.74 0 C-N-CA 123.241 2.628 . . . . 0.0 111.891 -179.861 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 97.6 mt-10 -83.2 -46.29 12.88 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-O 121.047 0.451 . . . . 0.0 110.206 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.548 ' HD3' ' H ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -137.14 3.87 2.66 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.573 -0.739 . . . . 0.0 111.861 -179.72 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 54.1 t 57.1 100.11 0.04 OUTLIER Pre-proline 0 C--N 1.325 -0.486 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.485 -178.248 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' PRO . . . . . 0.416 ' CD ' ' OH ' ' A' ' 67' ' ' TYR . 48.6 Cg_exo -53.38 126.8 22.84 Favored 'Trans proline' 0 N--CA 1.494 1.556 0 C-N-CA 122.032 1.821 . . . . 0.0 112.176 -179.647 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.477 ' O ' ' N ' ' A' ' 79' ' ' ALA . 45.3 t -84.01 -20.81 8.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.875 179.497 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 71.5 p -40.75 -24.99 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.464 -179.262 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' ALA . . . . . 0.477 ' N ' ' O ' ' A' ' 77' ' ' VAL . . . -65.5 -41.83 92.79 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.144 0.497 . . . . 0.0 110.868 179.597 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 80' ' ' PHE . . . . . 0.454 ' N ' ' O ' ' A' ' 77' ' ' VAL . 2.4 m-85 -62.77 -39.37 93.96 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.644 179.853 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 73.4 p -54.17 -42.39 69.58 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.355 -179.725 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 9.5 m-85 -61.05 -54.24 47.22 Favored 'General case' 0 CA--C 1.52 -0.208 0 C-N-CA 120.847 -0.341 . . . . 0.0 110.659 179.832 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' TRP . . . . . . . . . . . . . 37.7 t90 -56.78 -36.7 70.15 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.543 179.724 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 92.6 m-20 -62.86 -48.54 78.56 Favored 'General case' 0 C--O 1.235 0.327 0 C-N-CA 120.775 -0.37 . . . . 0.0 111.155 -179.409 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 33.1 tp -70.41 -51.53 28.86 Favored 'General case' 0 N--CA 1.447 -0.62 0 C-N-CA 120.532 -0.467 . . . . 0.0 110.376 179.676 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -58.22 -27.35 32.1 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 C-N-CA 120.511 -0.475 . . . . 0.0 110.513 -179.766 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 64.5 tttt -65.11 -48.9 72.0 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.666 -178.898 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.2 pp20? -80.48 -21.33 42.11 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.739 -179.876 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.537 ' O ' HD13 ' A' ' 89' ' ' LEU . 0.2 OUTLIER -62.11 -43.09 99.59 Favored 'General case' 0 N--CA 1.447 -0.625 0 C-N-CA 120.046 -0.662 . . . . 0.0 110.113 -178.68 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 2.2 mt -63.33 -43.12 98.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 C-N-CA 119.949 -0.7 . . . . 0.0 110.052 -179.618 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 -55.57 -17.1 4.81 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.764 -178.478 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 75.3 tttt -61.52 134.28 56.68 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.315 179.635 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -62.37 -41.22 98.46 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.683 -179.806 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' GLU . . . . . 0.448 ' O ' ' C ' ' A' ' 95' ' ' VAL . 81.0 mm-40 -74.85 -2.22 25.78 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.971 -179.603 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.448 ' C ' ' O ' ' A' ' 94' ' ' GLU . 1.9 m 30.55 -106.71 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.29 0 O-C-N 123.831 0.707 . . . . 0.0 110.442 179.939 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 96' ' ' ASN . . . . . 0.439 ' O ' ' N ' ' A' ' 98' ' ' GLN . 0.5 OUTLIER -152.63 164.43 20.33 Favored Pre-proline 0 C--N 1.322 -0.596 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.658 179.047 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 97' ' ' PRO . . . . . 0.413 ' HB2' ' H72' ' A' ' 201' ' ' MYR . 50.9 Cg_exo -46.07 -13.28 0.09 OUTLIER 'Trans proline' 0 N--CA 1.494 1.52 0 C-N-CA 122.797 2.332 . . . . 0.0 112.464 179.079 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 98' ' ' GLN . . . . . 0.439 ' N ' ' O ' ' A' ' 96' ' ' ASN . 3.5 pt20 -54.11 -15.88 1.71 Allowed 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.856 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 71.8 t -61.87 -50.19 81.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 C-N-CA 120.82 -0.352 . . . . 0.0 111.108 -179.152 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 90.9 mmm -73.61 -42.2 61.81 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.988 0.423 . . . . 0.0 111.059 179.948 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 101' ' ' ALA . . . . . 0.774 ' HB2' ' OE1' ' A' ' 4' ' ' GLU . . . -63.43 -26.88 68.94 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.679 -179.737 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -51.43 -15.55 0.43 Allowed 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.686 -179.922 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.401 ' O ' HG12 ' A' ' 103' ' ' VAL . 74.0 t -65.49 -17.45 22.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.392 179.439 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -58.92 -39.36 81.32 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.601 -179.722 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 97.9 mt-30 51.98 176.33 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.68 179.826 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 19.4 m -61.73 -44.46 96.86 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.691 -179.891 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 93.8 mt-10 -125.18 163.28 22.8 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.485 -179.709 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 108' ' ' GLU . . . . . 0.536 ' OE1' ' N ' ' A' ' 108' ' ' GLU . 54.5 mp0 -90.41 120.19 31.32 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.061 -0.518 . . . . 0.0 109.937 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 42.4 pt -43.1 -19.15 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.491 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.514 ' N ' ' O ' ' A' ' 108' ' ' GLU . 35.1 mt -63.61 -42.04 98.25 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.429 -179.821 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 66.4 tttm -67.57 -38.34 83.92 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.449 179.895 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 51.2 m -59.47 -47.29 86.05 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.79 -179.211 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 90.1 m-20 -65.82 -42.51 90.54 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.633 179.823 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 114' ' ' SER . . . . . 0.701 ' OG ' HG23 ' A' ' 116' ' ' THR . 23.1 t -158.23 139.12 13.04 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.526 179.78 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 75.2 mt-30 -89.44 20.72 3.72 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.805 179.824 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 116' ' ' THR . . . . . 0.701 HG23 ' OG ' ' A' ' 114' ' ' SER . 41.3 p -63.37 -32.51 73.96 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.44 179.873 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 65.6 t0 -65.68 -47.24 76.1 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.677 179.832 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 92.8 mt -125.99 76.61 1.61 Allowed 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.546 -179.878 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 83.4 tt0 -65.46 -40.47 93.24 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.393 179.856 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 39.5 p-80 -154.15 167.34 30.2 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.568 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 63.2 m80 -119.79 144.19 47.43 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.326 179.988 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 54.7 m-70 -113.25 138.67 49.66 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.507 179.939 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 85.5 t60 -62.47 -40.92 98.2 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.458 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 124' ' ' HIS . . . . . . . . . . . . . 29.4 m80 -60.98 -43.32 99.0 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.597 179.973 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 97.9 m-70 . . . . . 0 C--O 1.22 -0.472 0 CA-C-O 118.013 -0.994 . . . . 0.0 110.591 179.956 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 201' ' ' MYR . . . . . 0.656 ' H52' ' OE1' ' A' ' 4' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.71 0 N-CA-C 110.887 -0.885 . . . . 0.0 110.887 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 99.2 mm-40 -61.81 -39.79 92.99 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.825 0.345 . . . . 0.0 110.573 179.803 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -55.52 -22.4 21.15 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.517 179.765 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.579 ' HB2' ' H21' ' A' ' 201' ' ' MYR . 51.2 tp -42.31 -34.14 0.74 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.564 -179.999 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 56.2 m -54.21 -37.48 64.6 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.568 179.362 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 97.8 mm-40 -62.49 -37.3 85.48 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.588 179.741 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' HIS . . . . . 0.41 ' CD2' H102 ' A' ' 201' ' ' MYR . 59.1 t-80 -56.03 -43.93 78.28 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.585 179.689 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 81.9 tt0 -59.85 -53.16 61.18 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.563 179.114 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.479 ' O ' ' N ' ' A' ' 14' ' ' GLN . 86.8 mtt180 -60.61 -31.65 70.82 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.597 179.085 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.501 ' O ' ' HB2' ' A' ' 15' ' ' LEU . 51.1 t80 -60.66 -36.47 78.77 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.563 -179.601 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 3.0 t -63.24 -48.66 86.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.604 -179.198 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -83.49 -41.97 17.41 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.629 -179.571 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' GLN . . . . . 0.479 ' N ' ' O ' ' A' ' 10' ' ' ARG . 67.6 tp60 -61.39 -52.87 62.83 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.602 -179.119 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.708 HD13 ' O ' ' A' ' 15' ' ' LEU . 0.3 OUTLIER -61.25 -47.43 86.08 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.575 -179.976 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.478 ' HB3' HG11 ' A' ' 26' ' ' VAL . 87.0 mttt -56.29 -35.28 67.32 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.59 179.487 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 80.0 mt-30 -72.94 -36.08 67.13 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.622 178.636 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.416 ' O ' HG23 ' A' ' 21' ' ' THR . . . -57.22 -32.59 66.68 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.58 179.512 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.1 mt -85.59 -33.34 21.71 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.576 177.997 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -46.97 -42.37 17.79 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.529 -179.541 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.512 ' C ' ' H ' ' A' ' 23' ' ' GLY . 0.2 OUTLIER -71.43 -25.75 62.45 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.581 -179.578 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 82.6 mmt-85 -72.88 19.52 0.09 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.562 179.674 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' GLY . . . . . 0.512 ' H ' ' C ' ' A' ' 21' ' ' THR . . . 86.31 18.26 59.3 Favored Glycine 0 CA--C 1.524 0.627 0 N-CA-C 110.934 -0.866 . . . . 0.0 110.934 -179.604 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.634 HG12 ' N ' ' A' ' 25' ' ' LYS . 22.8 t -105.39 168.85 2.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 120.787 0.327 . . . . 0.0 110.622 -179.927 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.634 ' N ' HG12 ' A' ' 24' ' ' VAL . 63.1 mttp -131.01 136.43 48.5 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.524 179.305 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.478 HG11 ' HB3' ' A' ' 16' ' ' LYS . 4.8 m -134.37 108.3 10.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.545 -179.459 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.477 ' O ' ' N ' ' A' ' 30' ' ' ASP . 13.0 ttmt -107.4 158.78 16.9 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.541 178.867 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.422 ' H ' ' HG2' ' A' ' 27' ' ' LYS . 97.9 m-85 -39.01 -34.22 0.15 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.534 179.39 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -60.19 -25.48 65.61 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.575 -179.706 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.487 ' O ' ' CB ' ' A' ' 34' ' ' PHE . 1.0 OUTLIER -60.06 -46.3 90.01 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.614 -179.028 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.566 ' H ' HD12 ' A' ' 31' ' ' LEU . 5.8 mp -63.68 -42.68 97.99 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.493 -179.959 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 36.8 mt -58.49 -46.11 87.34 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.588 -178.465 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.461 ' NZ ' ' CZ ' ' A' ' 37' ' ' PHE . 65.3 tttm -87.53 -49.22 7.33 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.52 -177.038 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 34' ' ' PHE . . . . . 0.487 ' CB ' ' O ' ' A' ' 30' ' ' ASP . 43.0 t80 -60.9 -50.25 74.16 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.53 -178.182 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.521 ' CB ' ' O ' ' A' ' 31' ' ' LEU . 7.1 t80 -61.84 -46.09 90.98 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.614 -178.938 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 86.1 m-20 -65.39 -35.2 80.23 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.574 -179.248 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.544 ' CE2' ' CD2' ' A' ' 63' ' ' PHE . 1.9 m-85 -60.89 -46.74 89.44 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.569 -179.191 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.622 ' O ' ' N ' ' A' ' 42' ' ' CYS . 25.8 m -76.52 -37.46 30.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.532 -178.825 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -62.56 -29.67 70.75 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.584 -179.633 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 81.3 m-20 -59.14 -44.84 92.09 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.557 -178.588 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.524 ' C ' ' SG ' ' A' ' 42' ' ' CYS . 41.6 p -115.06 -3.25 12.63 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.58 -178.849 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 42' ' ' CYS . . . . . 0.622 ' N ' ' O ' ' A' ' 38' ' ' VAL . 1.8 p 36.19 60.48 3.15 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.572 -179.608 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 43' ' ' PRO . . . . . 0.402 ' HD3' ' N ' ' A' ' 42' ' ' CYS . 57.1 Cg_endo -77.7 -40.22 0.43 Allowed 'Trans proline' 0 C--N 1.305 -1.717 0 C-N-CA 122.796 2.331 . . . . 0.0 112.115 -179.334 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' TRP . . . . . 0.801 ' HE1' ' H ' ' A' ' 52' ' ' ASP . 0.0 OUTLIER -73.43 3.44 6.02 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.552 -179.633 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.558 ' O ' ' N ' ' A' ' 47' ' ' GLN . 64.0 m-85 54.91 50.49 6.34 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.577 -179.527 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.528 ' CD ' ' N ' ' A' ' 45' ' ' PHE . 52.9 Cg_exo -40.1 -16.77 0.04 OUTLIER 'Trans proline' 0 C--N 1.305 -1.747 0 C-N-CA 122.835 2.357 . . . . 0.0 112.165 179.116 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.558 ' N ' ' O ' ' A' ' 45' ' ' PHE . 71.9 tp60 -63.84 -48.5 76.52 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.542 -179.532 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.419 ' OE2' ' HB3' ' A' ' 101' ' ' ALA . 51.6 tp10 -89.41 -45.22 9.62 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.636 179.867 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 49' ' ' GLY . . . . . 0.488 ' O ' ' H71' ' A' ' 201' ' ' MYR . . . 96.61 68.45 0.98 Allowed Glycine 0 CA--C 1.524 0.616 0 N-CA-C 110.956 -0.857 . . . . 0.0 110.956 -179.306 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' THR . . . . . 0.698 ' O ' H132 ' A' ' 201' ' ' MYR . 7.0 t -130.03 170.2 14.3 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.842 0.353 . . . . 0.0 110.556 -179.333 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.3 mt -103.75 132.14 50.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.665 178.814 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' ASP . . . . . 0.801 ' H ' ' HE1' ' A' ' 44' ' ' TRP . 96.3 m-20 -118.51 121.42 40.23 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.549 179.04 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 22.0 mm -91.51 -53.86 8.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.584 -179.167 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 88.9 tttt -64.17 -48.27 76.61 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.564 -179.78 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 22.9 ttm-85 -61.53 -40.67 95.49 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.627 -179.611 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' TRP . . . . . 0.598 ' CE3' ' CH2' ' A' ' 44' ' ' TRP . 36.0 t-105 -51.74 -37.28 50.47 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.577 179.706 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -66.61 -38.92 87.97 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.596 -179.959 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 94.2 mtt-85 -61.53 -52.5 64.21 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.586 -179.857 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.443 HG13 ' N ' ' A' ' 60' ' ' GLY . 2.8 p -63.34 -43.62 98.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.628 179.879 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 60' ' ' GLY . . . . . 0.443 ' N ' HG13 ' A' ' 59' ' ' VAL . . . -64.53 -33.46 87.29 Favored Glycine 0 CA--C 1.525 0.697 0 N-CA-C 110.938 -0.865 . . . . 0.0 110.938 -179.709 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 10.9 m-20 -66.1 -37.01 84.7 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.788 0.327 . . . . 0.0 110.615 -179.701 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 84.0 m -63.45 -53.67 48.48 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.572 -179.82 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' PHE . . . . . 0.544 ' CD2' ' CE2' ' A' ' 37' ' ' PHE . 56.2 m-85 -67.66 -30.37 69.9 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.572 -179.608 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 60.0 tt0 -60.72 -42.26 96.92 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.579 179.382 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 29.5 t0 -63.18 -53.8 47.53 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.525 179.581 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' TYR . . . . . 0.457 ' O ' ' OG1' ' A' ' 69' ' ' THR . 60.6 m-85 -63.17 -35.55 80.68 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.518 179.615 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 62.5 t80 -57.9 -38.36 75.7 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.61 179.788 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 98.8 m-20 -66.66 -38.82 87.63 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.553 -179.896 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.457 ' OG1' ' O ' ' A' ' 66' ' ' TYR . 58.1 p -61.38 -29.74 70.1 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.618 -179.337 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -65.81 -40.94 92.33 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.572 -179.718 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' GLY . . . . . 0.506 ' H ' ' HD3' ' A' ' 72' ' ' PRO . . . 104.38 71.75 0.85 Allowed Glycine 0 CA--C 1.525 0.705 0 N-CA-C 110.937 -0.865 . . . . 0.0 110.937 179.665 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 72' ' ' PRO . . . . . 0.506 ' HD3' ' H ' ' A' ' 71' ' ' GLY . 19.3 Cg_exo -65.37 144.49 80.34 Favored 'Trans proline' 0 C--N 1.305 -1.721 0 C-N-CA 122.788 2.325 . . . . 0.0 112.173 179.326 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -76.29 -50.32 14.66 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.572 -179.806 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.519 ' HD3' ' H ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -138.88 6.08 2.4 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.56 -179.495 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 52.0 t 56.06 94.32 0.05 OUTLIER Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.612 -179.775 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -52.38 124.22 14.53 Favored 'Trans proline' 0 C--N 1.304 -1.767 0 C-N-CA 122.796 2.331 . . . . 0.0 112.143 -179.755 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.412 ' O ' ' N ' ' A' ' 80' ' ' PHE . 41.7 t -84.18 -15.43 11.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.565 -179.467 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 69.0 p -42.17 -27.18 0.12 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.546 179.927 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.87 -41.67 98.14 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.596 179.613 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' PHE . . . . . 0.412 ' N ' ' O ' ' A' ' 77' ' ' VAL . 2.3 m-85 -66.4 -33.28 75.35 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.547 -179.984 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 41.8 t -60.56 -42.52 96.78 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.568 179.802 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 7.6 m-85 -59.92 -52.23 66.3 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.553 179.445 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' TRP . . . . . 0.4 ' O ' ' CB ' ' A' ' 87' ' ' LYS . 41.1 t90 -59.03 -36.49 75.08 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.612 179.855 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 78.2 m-20 -62.02 -46.99 86.74 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.576 -179.559 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.402 ' O ' ' HG3' ' A' ' 88' ' ' GLU . 30.9 tp -70.64 -56.96 5.27 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.609 179.506 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -54.93 -24.97 15.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.563 179.547 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.4 ' CB ' ' O ' ' A' ' 83' ' ' TRP . 55.0 tttt -68.89 -47.6 65.46 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.581 -179.825 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 88' ' ' GLU . . . . . 0.463 ' OE1' ' O ' ' A' ' 88' ' ' GLU . 1.3 pp20? -82.71 -18.71 39.88 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.569 -179.802 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.601 ' O ' HD13 ' A' ' 89' ' ' LEU . 0.2 OUTLIER -61.99 -46.15 90.51 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.526 179.504 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 2.7 mt -62.73 -40.68 89.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.606 179.561 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 51.3 t0 -50.72 -42.56 57.41 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.59 -179.943 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 97.2 mttt -68.03 143.63 55.46 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.604 179.888 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -75.5 9.02 2.4 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.622 -179.818 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 40.4 tp10 -59.34 -33.72 71.48 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.499 179.859 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.413 ' H ' HG22 ' A' ' 95' ' ' VAL . 8.3 m -67.18 133.26 31.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.501 179.826 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 96' ' ' ASN . . . . . 0.541 ' O ' ' N ' ' A' ' 98' ' ' GLN . 1.1 m-20 -85.54 162.82 46.84 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.588 -179.624 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_exo -42.64 -13.45 0.04 OUTLIER 'Trans proline' 0 C--N 1.305 -1.763 0 C-N-CA 122.896 2.397 . . . . 0.0 112.101 179.271 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 98' ' ' GLN . . . . . 0.615 ' NE2' ' H91' ' A' ' 201' ' ' MYR . 5.0 pt20 -46.24 -25.42 0.61 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.573 -179.81 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 98.4 t -63.22 -50.6 78.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.557 -179.926 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 47.6 ttp -66.77 -41.25 88.02 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.538 -179.729 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 101' ' ' ALA . . . . . 0.419 ' HB3' ' OE2' ' A' ' 48' ' ' GLU . . . -60.72 -25.31 66.34 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.585 -179.238 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 102' ' ' ALA . . . . . 0.408 ' CB ' HG21 ' A' ' 50' ' ' THR . . . -63.13 -17.08 61.95 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.542 179.998 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 55.8 t -60.46 -19.53 18.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.591 179.413 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -58.3 -38.94 78.04 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.579 179.894 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 98.8 mm-40 -74.04 -38.18 64.08 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.595 -179.913 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 82.0 p -65.58 -20.41 66.31 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.619 179.992 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 92.2 mt-10 54.26 -164.18 0.11 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.508 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 108' ' ' GLU . . . . . 0.577 ' C ' ' H ' ' A' ' 110' ' ' LEU . 72.7 mm-40 -90.04 125.85 35.55 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.589 179.22 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 44.0 pt -58.86 2.26 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.577 -179.976 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.577 ' H ' ' C ' ' A' ' 108' ' ' GLU . 91.6 mt -95.18 -5.65 43.47 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.628 179.871 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 86.5 tttt -121.48 127.13 50.74 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.594 179.948 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 112' ' ' SER . . . . . 0.436 ' OG ' ' N ' ' A' ' 113' ' ' ASN . 95.4 p -148.52 -113.02 0.07 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.563 -179.962 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 113' ' ' ASN . . . . . 0.436 ' N ' ' OG ' ' A' ' 112' ' ' SER . 77.4 m-20 -62.17 -34.79 77.09 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.618 179.617 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 62.4 p -153.07 160.2 42.92 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.53 179.735 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 86.4 mt-30 -90.15 129.65 36.4 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.581 179.993 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 116' ' ' THR . . . . . 0.406 ' OG1' ' N ' ' A' ' 117' ' ' ASP . 67.5 p -108.68 -74.46 0.66 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.602 179.874 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 117' ' ' ASP . . . . . 0.406 ' N ' ' OG1' ' A' ' 116' ' ' THR . 92.5 m-20 -62.36 -44.46 96.41 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.616 179.827 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.638 ' O ' HD13 ' A' ' 118' ' ' LEU . 0.2 OUTLIER -63.54 -44.69 93.48 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.517 179.869 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 80.4 tt0 -60.39 132.64 54.54 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.568 -179.91 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 120' ' ' HIS . . . . . 0.431 ' CD2' ' NE2' ' A' ' 122' ' ' HIS . 15.3 p-80 -147.31 156.85 43.29 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.644 179.932 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 80.7 m80 -112.2 154.96 24.76 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.569 -179.979 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 122' ' ' HIS . . . . . 0.431 ' NE2' ' CD2' ' A' ' 120' ' ' HIS . 97.6 m-70 -117.11 160.57 20.8 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.613 179.962 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 94.7 m-70 -65.78 -42.41 90.82 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.538 -179.94 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 124' ' ' HIS . . . . . . . . . . . . . 71.5 m80 -60.63 -41.3 94.62 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.498 -179.982 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 81.3 t60 . . . . . 0 C--O 1.22 -0.474 0 CA-C-O 118.064 -0.97 . . . . 0.0 110.535 -179.979 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 201' ' ' MYR . . . . . 0.698 H132 ' O ' ' A' ' 50' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.717 0 N-CA-C 110.95 -0.86 . . . . 0.0 110.95 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 99.4 mm-40 -62.61 -36.9 84.23 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.955 0.407 . . . . 0.0 110.369 -179.987 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.457 ' HB3' ' H62' ' A' ' 201' ' ' MYR . 93.7 mt-10 -51.21 -21.75 2.24 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.483 179.846 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 41.5 tp -42.98 -34.86 1.06 Allowed 'General case' 0 C--O 1.236 0.348 0 CA-C-O 120.998 0.427 . . . . 0.0 110.429 -179.625 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.589 ' CB ' HH12 ' A' ' 10' ' ' ARG . 50.2 m -54.15 -35.18 61.96 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 120.493 -0.483 . . . . 0.0 109.958 179.789 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 71.3 tp60 -64.71 -33.24 75.5 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.96 -0.563 . . . . 0.0 110.44 179.504 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 86.3 t60 -59.16 -45.11 91.84 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-O 120.95 0.405 . . . . 0.0 110.069 -179.947 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -60.51 -43.38 97.13 Favored 'General case' 0 C--O 1.241 0.649 0 CA-C-N 116.034 -0.53 . . . . 0.0 109.874 179.478 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.589 HH12 ' CB ' ' A' ' 6' ' ' SER . 80.2 mtt85 -66.22 -37.31 85.24 Favored 'General case' 0 C--O 1.21 -0.974 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 179.61 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.54 ' CD1' H122 ' A' ' 201' ' ' MYR . 0.1 OUTLIER -53.28 -38.76 63.38 Favored 'General case' 0 C--N 1.319 -0.753 0 C-N-CA 120.445 -0.502 . . . . 0.0 110.172 -179.967 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 2.3 t -65.67 -52.93 44.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 C-N-CA 119.932 -0.707 . . . . 0.0 111.497 -179.868 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 77.0 tt0 -80.49 -48.64 12.5 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 120.403 -0.519 . . . . 0.0 112.004 -178.73 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' GLN . . . . . 0.501 ' N ' ' O ' ' A' ' 10' ' ' ARG . 60.9 tp60 -53.64 -53.0 58.12 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.909 -178.848 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.582 HD13 ' O ' ' A' ' 15' ' ' LEU . 0.4 OUTLIER -63.26 -49.29 74.7 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.35 -0.54 . . . . 0.0 110.121 -179.589 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 62.8 mttm -53.25 -33.81 54.55 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 120.499 -0.48 . . . . 0.0 110.268 179.319 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 89.3 mm-40 -75.42 -35.66 60.94 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.566 179.183 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -57.06 -34.44 68.25 Favored 'General case' 0 C--O 1.223 -0.296 0 CA-C-N 116.044 -0.526 . . . . 0.0 109.956 -179.931 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.9 mt -85.42 -33.48 21.93 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.096 0.474 . . . . 0.0 110.564 179.243 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -47.46 -43.28 24.05 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.541 -179.129 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.493 ' C ' ' H ' ' A' ' 23' ' ' GLY . 0.1 OUTLIER -72.02 -24.07 61.5 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.555 -179.908 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 71.8 mmt-85 -74.69 24.08 0.09 Allowed 'General case' 0 C--O 1.233 0.187 0 CA-C-O 120.945 0.402 . . . . 0.0 110.435 179.906 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' GLY . . . . . 0.493 ' H ' ' C ' ' A' ' 21' ' ' THR . . . 82.49 17.96 67.43 Favored Glycine 0 CA--C 1.526 0.724 0 N-CA-C 110.89 -0.884 . . . . 0.0 110.89 179.876 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.593 HG12 ' N ' ' A' ' 25' ' ' LYS . 21.9 t -105.42 167.12 3.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 N-CA-C 110.294 -0.261 . . . . 0.0 110.294 -179.901 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.593 ' N ' HG12 ' A' ' 24' ' ' VAL . 69.9 mmtt -129.43 132.26 46.94 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.26 179.518 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.688 HG23 ' O ' ' A' ' 26' ' ' VAL . 30.8 m -127.83 105.22 13.26 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.252 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.239 -179.956 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.423 ' N ' ' OD1' ' A' ' 30' ' ' ASP . 8.3 pttm -104.89 163.39 12.56 Favored 'General case' 0 C--O 1.218 -0.579 0 N-CA-C 109.806 -0.442 . . . . 0.0 109.806 179.812 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 84.2 m-85 -42.86 -34.89 1.03 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.961 0.41 . . . . 0.0 110.782 179.981 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -56.85 -23.27 42.91 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.819 179.839 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.423 ' OD1' ' N ' ' A' ' 27' ' ' LYS . 1.1 m-20 -61.91 -46.97 87.04 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.613 -179.159 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.5 ' O ' ' CB ' ' A' ' 35' ' ' PHE . 5.8 mp -67.24 -41.56 85.42 Favored 'General case' 0 C--O 1.215 -0.73 0 CA-C-O 120.943 0.401 . . . . 0.0 110.393 179.738 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 42.3 mt -57.27 -45.86 83.64 Favored 'General case' 0 C--N 1.314 -0.973 0 C-N-CA 119.419 -0.913 . . . . 0.0 111.03 -178.359 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -84.32 -50.17 8.07 Favored 'General case' 0 C--N 1.32 -0.696 0 C-N-CA 120.472 -0.491 . . . . 0.0 111.909 -179.089 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' PHE . . . . . 0.858 ' O ' HG22 ' A' ' 38' ' ' VAL . 42.0 t80 -62.47 -49.56 74.92 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.461 -178.531 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.5 ' CB ' ' O ' ' A' ' 31' ' ' LEU . 22.4 t80 -61.22 -44.56 97.08 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.103 -179.567 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -69.37 -40.56 77.39 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 120.275 -0.57 . . . . 0.0 111.663 179.975 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.573 ' CE2' ' CE1' ' A' ' 63' ' ' PHE . 3.0 m-85 -62.08 -48.66 79.22 Favored 'General case' 0 CA--C 1.518 -0.278 0 CA-C-O 120.858 0.361 . . . . 0.0 111.887 -178.281 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.858 HG22 ' O ' ' A' ' 34' ' ' PHE . 17.1 m -70.03 -41.62 79.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.467 -179.745 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -63.04 -31.7 72.89 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.506 -0.316 . . . . 0.0 110.95 -179.732 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 98.8 m-20 -56.66 -49.71 74.24 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 120.906 -0.317 . . . . 0.0 111.113 -179.169 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.46 ' O ' ' SG ' ' A' ' 42' ' ' CYS . 15.4 p -106.64 -7.61 17.29 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.545 -0.298 . . . . 0.0 110.954 -179.741 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' CYS . . . . . 0.554 ' N ' ' O ' ' A' ' 38' ' ' VAL . 28.6 p 38.04 57.52 4.8 Favored Pre-proline 0 N--CA 1.463 0.186 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.303 -179.234 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -75.95 -31.42 5.06 Favored 'Trans proline' 0 C--N 1.314 -1.257 0 C-N-CA 122.551 2.167 . . . . 0.0 112.582 -179.4 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' TRP . . . . . 0.631 ' CH2' ' CE3' ' A' ' 56' ' ' TRP . 0.0 OUTLIER -77.76 13.75 1.25 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.89 -179.646 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.532 ' CD2' ' OD2' ' A' ' 52' ' ' ASP . 6.1 m-85 39.56 53.58 5.06 Favored Pre-proline 0 C--O 1.232 0.142 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.076 -179.874 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.444 ' CD ' ' N ' ' A' ' 45' ' ' PHE . 11.1 Cg_endo -53.38 -5.7 0.28 Allowed 'Trans proline' 0 C--N 1.31 -1.488 0 C-N-CA 122.714 2.276 . . . . 0.0 112.004 -179.688 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.462 ' H ' ' C ' ' A' ' 45' ' ' PHE . 64.1 tp60 -64.17 -48.79 74.6 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.333 -179.448 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.468 ' O ' ' H51' ' A' ' 201' ' ' MYR . 1.2 tp10 -89.42 -30.24 18.47 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-O 120.908 0.385 . . . . 0.0 110.531 179.155 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 49' ' ' GLY . . . . . 0.67 ' CA ' ' H92' ' A' ' 201' ' ' MYR . . . 87.65 75.19 1.28 Allowed Glycine 0 CA--C 1.523 0.573 0 N-CA-C 110.844 -0.902 . . . . 0.0 110.844 -179.445 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 13.6 t -144.11 165.22 28.43 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.623 0.249 . . . . 0.0 110.653 -179.792 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.1 mt -98.96 133.85 40.05 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.265 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 179.283 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' ASP . . . . . 0.611 ' H ' ' HE1' ' A' ' 44' ' ' TRP . 73.7 m-20 -117.91 121.17 40.0 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.276 179.083 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 18.5 mm -87.32 -46.49 16.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.825 179.998 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -66.22 -45.84 79.29 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-O 121.108 0.48 . . . . 0.0 111.283 -179.775 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 77.3 mmt-85 -63.72 -33.97 76.84 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.908 -0.587 . . . . 0.0 109.909 -179.507 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' TRP . . . . . 0.631 ' CE3' ' CH2' ' A' ' 44' ' ' TRP . 50.3 t-105 -59.29 -36.79 76.21 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-O 121.3 0.572 . . . . 0.0 110.049 179.994 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 44.0 ttm180 -65.21 -41.33 94.58 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.308 179.55 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 95.2 mtt-85 -61.75 -53.07 61.01 Favored 'General case' 0 N--CA 1.466 0.334 0 C-N-CA 120.793 -0.363 . . . . 0.0 111.562 -179.491 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.499 HG13 ' N ' ' A' ' 60' ' ' GLY . 4.8 p -63.16 -45.93 97.26 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.391 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.198 179.632 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 60' ' ' GLY . . . . . 0.499 ' N ' HG13 ' A' ' 59' ' ' VAL . . . -63.04 -36.72 93.85 Favored Glycine 0 CA--C 1.524 0.615 0 N-CA-C 111.05 -0.82 . . . . 0.0 111.05 179.903 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 53.9 m-20 -65.24 -35.74 82.0 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.652 0.263 . . . . 0.0 110.692 -179.479 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 80.9 m -64.29 -55.33 22.09 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.821 0.344 . . . . 0.0 110.718 -179.93 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' PHE . . . . . 0.573 ' CE1' ' CE2' ' A' ' 37' ' ' PHE . 59.4 m-85 -64.47 -33.99 77.17 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.427 179.47 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 57.9 tt0 -60.0 -42.89 95.26 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 120.891 -0.324 . . . . 0.0 110.614 -179.88 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 20.8 t0 -61.1 -51.71 68.0 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.825 179.834 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 41.3 m-85 -65.97 -35.03 79.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.739 179.735 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 56.9 t80 -59.57 -44.41 93.31 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.291 -179.424 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 39.6 t30 -64.37 -40.33 95.62 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.579 179.941 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 41.0 p -66.1 -22.5 66.4 Favored 'General case' 0 CA--C 1.516 -0.332 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.342 179.933 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -70.04 -46.85 64.14 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 120.009 -0.676 . . . . 0.0 110.995 179.911 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 71' ' ' GLY . . . . . 0.509 ' H ' ' HD3' ' A' ' 72' ' ' PRO . . . 113.29 70.73 0.55 Allowed Glycine 0 CA--C 1.532 1.101 0 N-CA-C 110.698 -0.961 . . . . 0.0 110.698 -179.494 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 72' ' ' PRO . . . . . 0.509 ' HD3' ' H ' ' A' ' 71' ' ' GLY . 23.6 Cg_exo -63.93 147.34 92.01 Favored 'Trans proline' 0 N--CA 1.499 1.822 0 C-N-CA 123.029 2.486 . . . . 0.0 112.068 179.979 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -80.8 -49.52 11.0 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-O 120.953 0.406 . . . . 0.0 110.338 179.63 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.492 ' HD3' ' H ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -137.46 2.62 2.49 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.654 -179.481 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 68.8 t 57.7 93.5 0.05 OUTLIER Pre-proline 0 C--N 1.325 -0.48 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.211 -178.805 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -53.58 126.66 22.5 Favored 'Trans proline' 0 N--CA 1.495 1.59 0 C-N-CA 121.805 1.67 . . . . 0.0 111.786 -179.583 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.466 ' O ' ' N ' ' A' ' 80' ' ' PHE . 40.8 t -83.25 -20.53 9.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.679 179.822 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 63.6 p -41.55 -26.34 0.07 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.265 -179.27 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' ALA . . . . . 0.433 ' N ' ' O ' ' A' ' 77' ' ' VAL . . . -64.02 -42.69 97.04 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.546 179.654 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 80' ' ' PHE . . . . . 0.466 ' N ' ' O ' ' A' ' 77' ' ' VAL . 10.8 m-85 -64.5 -35.45 80.98 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.143 179.694 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 37.3 m -59.89 -42.09 93.01 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.353 179.814 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 4.1 m-85 -60.17 -51.36 69.91 Favored 'General case' 0 C--N 1.331 -0.215 0 C-N-CA 120.88 -0.328 . . . . 0.0 110.609 -179.951 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' TRP . . . . . . . . . . . . . 47.2 t90 -59.23 -39.01 81.39 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.645 179.66 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 12.4 m120 -61.86 -44.14 97.43 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.562 -179.651 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 25.0 tp -72.14 -59.32 2.8 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 120.358 -0.537 . . . . 0.0 110.135 179.359 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -50.74 -28.79 6.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-O 120.895 0.379 . . . . 0.0 110.395 179.709 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 66.0 tttt -65.26 -50.99 63.67 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.9 -179.293 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.1 pp20? -79.96 -20.1 46.35 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.801 -179.683 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.528 ' O ' HD13 ' A' ' 89' ' ' LEU . 0.2 OUTLIER -61.85 -46.24 90.31 Favored 'General case' 0 N--CA 1.443 -0.815 0 C-N-CA 120.158 -0.617 . . . . 0.0 110.486 -178.771 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 3.2 mt -63.67 -44.21 98.37 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 C-N-CA 119.891 -0.723 . . . . 0.0 109.937 -179.605 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 -64.88 -12.29 47.2 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.785 -178.988 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 68.1 tttt -74.04 139.83 44.98 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.377 179.736 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -74.86 -10.22 59.29 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.84 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 80.3 mm-40 -86.47 52.31 2.46 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.562 179.857 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 27.1 m -115.89 131.71 67.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.485 179.915 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 96' ' ' ASN . . . . . 0.581 ' OD1' ' NE2' ' A' ' 98' ' ' GLN . 0.0 OUTLIER -58.76 161.88 7.73 Favored Pre-proline 0 C--N 1.324 -0.528 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.474 179.777 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -58.98 -13.22 17.86 Favored 'Trans proline' 0 N--CA 1.495 1.597 0 C-N-CA 122.821 2.347 . . . . 0.0 112.153 179.682 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 98' ' ' GLN . . . . . 0.665 ' OE1' ' H81' ' A' ' 201' ' ' MYR . 6.5 pt20 -48.47 -23.08 0.84 Allowed 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.557 179.818 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 77.4 t -63.0 -51.65 69.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 C-N-CA 120.56 -0.456 . . . . 0.0 110.743 -179.692 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 89.0 mmm -71.29 -40.13 71.08 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.578 179.741 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -64.25 -24.01 67.51 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.551 -179.618 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -67.89 -14.95 63.38 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.482 179.896 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.448 ' O ' ' O ' ' A' ' 106' ' ' THR . 55.7 t -63.84 -19.59 24.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.328 179.531 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -60.76 -36.54 79.2 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.718 -179.885 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 105' ' ' GLN . . . . . 0.529 ' NE2' ' CD2' ' A' ' 45' ' ' PHE . 13.4 tt0 -64.79 -42.12 95.3 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.055 -179.652 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 106' ' ' THR . . . . . 0.448 ' O ' ' O ' ' A' ' 103' ' ' VAL . 28.3 m -105.67 125.21 50.73 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.704 -179.762 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -130.31 179.51 5.87 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.57 -179.97 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 108' ' ' GLU . . . . . 0.496 ' C ' ' N ' ' A' ' 110' ' ' LEU . 98.7 mt-10 -108.64 122.82 47.9 Favored 'General case' 0 CA--C 1.513 -0.445 0 CA-C-N 115.943 -0.571 . . . . 0.0 109.895 179.132 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 38.3 pt -49.45 -11.63 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.036 179.779 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.496 ' N ' ' C ' ' A' ' 108' ' ' GLU . 36.3 mt -68.16 -40.88 82.25 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.725 179.779 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -68.47 -39.98 81.16 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.357 -179.921 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 16.2 t -62.52 -44.42 96.4 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.856 -179.549 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 69.8 m-20 -63.03 -40.82 98.86 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.539 -179.941 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 35.6 p -158.04 160.92 37.93 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.593 179.872 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 115' ' ' GLN . . . . . 0.43 ' O ' ' O ' ' A' ' 118' ' ' LEU . 14.8 pt20 -100.88 7.66 43.54 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.377 179.89 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 11.4 m -60.75 -44.63 96.46 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.395 -179.676 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 59.7 t0 -61.49 -49.45 76.74 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.842 -179.962 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.43 ' O ' ' O ' ' A' ' 115' ' ' GLN . 86.0 mt -122.46 132.53 54.39 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.583 -179.857 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 22.4 pt-20 -136.22 161.38 35.93 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.555 -0.293 . . . . 0.0 110.293 -179.93 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 70.3 m80 -115.85 150.24 37.32 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.243 -179.965 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 88.4 m-70 -129.82 157.23 42.78 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.424 -179.933 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 36.0 m80 -120.4 143.75 48.29 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.6 -179.925 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 98.3 m-70 -65.44 -38.55 90.22 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.412 -179.928 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 124' ' ' HIS . . . . . . . . . . . . . 78.1 m80 -117.63 143.43 46.15 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.625 179.908 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 71.7 t60 . . . . . 0 C--O 1.22 -0.464 0 CA-C-O 118.004 -0.998 . . . . 0.0 110.517 179.9 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 201' ' ' MYR . . . . . 0.67 ' H92' ' CA ' ' A' ' 49' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.646 0 N-CA-C 110.987 -0.845 . . . . 0.0 110.987 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 3' ' ' GLN . . . . . 0.489 ' O ' ' N ' ' A' ' 5' ' ' LEU . 89.3 mt-30 -65.37 -22.08 66.76 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.819 0.342 . . . . 0.0 110.576 -179.828 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.496 ' O ' ' N ' ' A' ' 7' ' ' GLN . 91.2 mt-10 -43.09 -20.52 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.558 179.912 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.489 ' N ' ' O ' ' A' ' 3' ' ' GLN . 59.6 tp -41.42 -37.47 1.05 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.602 179.671 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 96.3 p -59.09 -37.0 76.07 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.611 179.675 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' GLN . . . . . 0.496 ' N ' ' O ' ' A' ' 4' ' ' GLU . 58.3 tt0 -65.11 -37.01 86.1 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.552 179.05 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' HIS . . . . . 0.601 ' CE1' H112 ' A' ' 201' ' ' MYR . 78.8 t60 -53.83 -45.81 70.99 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.519 179.636 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -60.77 -46.24 91.22 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.553 179.688 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.487 ' O ' ' CB ' ' A' ' 14' ' ' GLN . 88.5 mtt-85 -64.91 -32.28 73.91 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.566 179.496 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.584 ' CE1' HD23 ' A' ' 15' ' ' LEU . 48.1 t80 -59.72 -35.19 74.03 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.529 179.854 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 4.2 t -65.21 -48.27 84.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.53 -178.935 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -83.79 -32.71 25.22 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.563 -179.82 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' GLN . . . . . 0.487 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 60.8 tp60 -73.58 -50.27 22.11 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.562 -178.186 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.68 HD13 ' O ' ' A' ' 15' ' ' LEU . 0.3 OUTLIER -63.45 -47.6 81.2 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.521 179.761 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.452 ' HB3' HG11 ' A' ' 26' ' ' VAL . 92.7 mttt -57.33 -32.76 67.04 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.582 179.086 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 60.1 tt0 -73.12 -37.52 66.64 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.598 178.461 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -56.76 -32.98 66.13 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.533 179.442 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.416 ' O ' ' N ' ' A' ' 22' ' ' ARG . 2.8 mt -85.73 -33.13 21.55 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.597 178.569 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 63.9 tttm -44.44 -42.65 7.18 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.559 -179.928 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.576 ' C ' ' H ' ' A' ' 23' ' ' GLY . 0.2 OUTLIER -75.39 -27.7 59.19 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.516 -179.706 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.416 ' N ' ' O ' ' A' ' 19' ' ' LEU . 77.8 mmt-85 -68.9 21.64 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.536 -179.874 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' GLY . . . . . 0.576 ' H ' ' C ' ' A' ' 21' ' ' THR . . . 87.56 14.11 64.1 Favored Glycine 0 CA--C 1.525 0.7 0 N-CA-C 110.887 -0.885 . . . . 0.0 110.887 -179.567 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.558 HG12 ' N ' ' A' ' 25' ' ' LYS . 11.3 t -104.89 167.19 2.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-O 120.871 0.367 . . . . 0.0 110.538 179.726 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.558 ' N ' HG12 ' A' ' 24' ' ' VAL . 99.3 mttt -135.23 120.95 19.53 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.534 179.62 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.466 HG23 ' O ' ' A' ' 26' ' ' VAL . 17.2 m -120.53 116.12 49.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.551 -179.769 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 29.9 pttt -108.67 166.93 10.43 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.541 179.953 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 98.4 m-85 -47.29 -40.01 15.86 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.551 179.384 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -57.99 -23.38 53.7 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.609 179.547 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 54.9 t0 -62.08 -43.79 98.08 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.548 -179.647 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.525 ' O ' ' CB ' ' A' ' 35' ' ' PHE . 5.6 mp -66.48 -43.45 85.38 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.588 179.545 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.431 ' O ' ' OD2' ' A' ' 36' ' ' ASP . 35.4 mt -58.4 -42.44 87.18 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.508 -177.852 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 85.3 tttt -86.33 -51.69 6.08 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.577 -178.229 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 57.6 t80 -61.7 -49.53 76.11 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.543 -177.669 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.525 ' CB ' ' O ' ' A' ' 31' ' ' LEU . 6.7 t80 -62.26 -44.83 95.66 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.593 -178.398 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' ASP . . . . . 0.431 ' OD2' ' O ' ' A' ' 32' ' ' LEU . 98.4 m-20 -66.95 -35.45 80.0 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.45 -179.644 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 2.3 m-85 -61.18 -52.56 64.29 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.558 -178.642 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.561 ' O ' ' N ' ' A' ' 42' ' ' CYS . 23.0 m -68.06 -38.89 80.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.623 -178.442 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -61.62 -25.94 67.67 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.517 -179.067 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 67.3 t0 -55.61 -55.3 33.69 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.49 -178.693 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.506 ' O ' ' SG ' ' A' ' 42' ' ' CYS . 15.5 p -115.35 -2.65 12.58 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.561 -178.517 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' CYS . . . . . 0.561 ' N ' ' O ' ' A' ' 38' ' ' VAL . 23.1 p 38.25 59.25 5.05 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.558 -179.418 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 43' ' ' PRO . . . . . 0.418 ' C ' ' H ' ' A' ' 45' ' ' PHE . 64.8 Cg_endo -77.12 -23.97 9.99 Favored 'Trans proline' 0 C--N 1.305 -1.72 0 C-N-CA 122.871 2.38 . . . . 0.0 112.142 -179.57 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 44' ' ' TRP . . . . . 0.534 ' CZ3' ' CE3' ' A' ' 56' ' ' TRP . 0.0 OUTLIER -69.36 5.1 1.41 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.569 -179.477 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.418 ' H ' ' C ' ' A' ' 43' ' ' PRO . 38.4 t80 48.2 57.56 17.97 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.572 179.79 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 23.2 Cg_endo -61.0 -7.09 7.18 Favored 'Trans proline' 0 C--N 1.305 -1.74 0 C-N-CA 122.758 2.305 . . . . 0.0 112.16 -178.777 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 82.6 mt-30 -54.7 -52.91 60.95 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.541 -179.796 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.492 ' O ' ' H51' ' A' ' 201' ' ' MYR . 43.8 tp10 -89.68 -27.69 19.95 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.619 179.317 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 49' ' ' GLY . . . . . 0.5 ' O ' ' H71' ' A' ' 201' ' ' MYR . . . 85.73 66.04 1.43 Allowed Glycine 0 CA--C 1.525 0.671 0 N-CA-C 110.978 -0.849 . . . . 0.0 110.978 -178.847 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 10.7 t -132.77 170.2 15.61 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.788 0.327 . . . . 0.0 110.584 -179.449 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.463 ' HA ' H142 ' A' ' 201' ' ' MYR . 1.8 mt -93.66 141.55 14.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.549 179.532 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 52' ' ' ASP . . . . . 0.522 ' H ' ' HE1' ' A' ' 44' ' ' TRP . 1.2 m-20 -114.51 122.76 47.56 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.542 179.784 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.47 ' CG1' HD12 ' A' ' 90' ' ' ILE . 25.2 mm -96.16 -55.75 5.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.648 179.648 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 67.8 mttm -73.34 -49.26 28.29 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.569 -178.978 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -62.16 -32.01 72.58 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.561 -178.555 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' TRP . . . . . 0.534 ' CE3' ' CZ3' ' A' ' 44' ' ' TRP . 13.0 t-105 -62.86 -38.28 90.2 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.557 179.304 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -64.31 -36.4 83.98 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.523 -179.728 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 94.6 mtt180 -60.54 -53.4 57.93 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.591 -179.294 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.429 HG13 ' N ' ' A' ' 60' ' ' GLY . 2.6 p -66.96 -42.72 89.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.629 -179.862 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 60' ' ' GLY . . . . . 0.429 ' N ' HG13 ' A' ' 59' ' ' VAL . . . -62.72 -37.77 95.37 Favored Glycine 0 CA--C 1.525 0.707 0 N-CA-C 110.915 -0.874 . . . . 0.0 110.915 179.695 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 95.4 m-20 -65.88 -40.37 91.55 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.878 0.371 . . . . 0.0 110.602 -179.238 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 76.7 m -63.34 -57.18 11.2 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.568 -178.927 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 37.8 m-85 -64.4 -42.67 95.96 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.62 -179.153 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 55.8 tt0 -63.92 -34.43 77.95 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.558 -179.345 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.401 ' O ' HG23 ' A' ' 69' ' ' THR . 41.2 t0 -60.33 -53.44 57.62 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.597 -179.945 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 65.7 m-85 -69.81 -39.19 76.67 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.507 179.962 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 69.5 t80 -60.55 -41.07 93.77 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.586 -179.844 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' ASN . . . . . 0.452 ' OD1' ' O ' ' A' ' 72' ' ' PRO . 51.2 t-20 -65.36 -45.52 83.83 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.536 -179.387 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.401 HG23 ' O ' ' A' ' 65' ' ' ASP . 80.4 p -68.87 -16.78 63.86 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.594 -179.185 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 2.3 m-85 -76.02 -5.66 47.45 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.596 -179.325 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' GLY . . . . . 0.493 ' O ' ' N ' ' A' ' 73' ' ' GLU . . . 153.94 -67.14 0.31 Allowed Glycine 0 CA--C 1.525 0.715 0 N-CA-C 110.912 -0.875 . . . . 0.0 110.912 179.535 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 72' ' ' PRO . . . . . 0.452 ' O ' ' OD1' ' A' ' 68' ' ' ASN . 38.6 Cg_exo -39.69 88.12 0.01 OUTLIER 'Trans proline' 0 C--N 1.304 -1.812 0 C-N-CA 122.815 2.344 . . . . 0.0 112.114 -176.874 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.493 ' N ' ' O ' ' A' ' 71' ' ' GLY . 83.2 tt0 -66.24 -34.65 78.49 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.576 179.589 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.7 ' CD ' ' H ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -97.0 -16.72 20.46 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.549 179.9 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.511 ' O ' ' O ' ' A' ' 74' ' ' LYS . 19.8 t 57.4 132.04 0.02 OUTLIER Pre-proline 0 C--N 1.329 -0.323 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.526 179.447 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 41.1 Cg_exo -50.44 123.65 11.68 Favored 'Trans proline' 0 C--N 1.305 -1.737 0 C-N-CA 122.864 2.376 . . . . 0.0 112.101 178.352 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.417 ' O ' ' N ' ' A' ' 80' ' ' PHE . 40.6 t -81.79 -20.33 10.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.531 -179.795 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 78' ' ' THR . . . . . 0.41 ' O ' ' OG ' ' A' ' 81' ' ' SER . 22.7 p -43.1 -24.8 0.09 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.585 178.815 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.91 -37.74 86.88 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.534 179.92 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' PHE . . . . . 0.417 ' N ' ' O ' ' A' ' 77' ' ' VAL . 2.5 m-85 -63.1 -37.17 86.16 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.601 -179.263 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 81' ' ' SER . . . . . 0.41 ' OG ' ' O ' ' A' ' 78' ' ' THR . 93.3 p -58.62 -39.6 80.94 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.574 -179.727 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 11.2 m-85 -61.17 -47.73 84.82 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.601 179.688 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' TRP . . . . . 0.422 ' O ' ' CB ' ' A' ' 87' ' ' LYS . 40.0 t90 -59.19 -37.82 78.35 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.568 -179.528 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 97.5 m-20 -61.24 -47.04 87.87 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.549 -178.598 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 25.4 tp -72.27 -55.44 7.17 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.563 179.782 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -56.11 -25.37 19.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.567 179.506 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.422 ' CB ' ' O ' ' A' ' 83' ' ' TRP . 57.1 tttt -67.56 -50.78 56.89 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.61 179.467 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 88' ' ' GLU . . . . . 0.469 ' C ' ' CD ' ' A' ' 88' ' ' GLU . 0.9 OUTLIER -78.96 -20.17 49.89 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.551 -179.873 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.581 ' O ' HD13 ' A' ' 89' ' ' LEU . 0.2 OUTLIER -60.29 -49.42 77.66 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.535 179.845 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.47 HD12 ' CG1' ' A' ' 53' ' ' ILE . 3.3 mt -63.79 -41.09 91.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.56 179.21 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 97.5 m-20 -69.18 -16.43 63.62 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.572 -179.409 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 70.4 tttt -68.4 140.97 55.83 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.561 -179.886 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -70.9 -4.56 25.05 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.488 -179.522 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 27.5 tp10 -84.57 46.78 1.27 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.562 -179.579 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 34.1 m -125.83 132.91 70.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.519 -179.807 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 96' ' ' ASN . . . . . 0.587 ' O ' ' N ' ' A' ' 98' ' ' GLN . 10.1 m-20 -87.18 157.58 53.54 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.548 -179.249 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_exo -41.35 -13.24 0.03 OUTLIER 'Trans proline' 0 C--N 1.305 -1.733 0 C-N-CA 122.812 2.341 . . . . 0.0 112.147 178.785 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 98' ' ' GLN . . . . . 0.587 ' N ' ' O ' ' A' ' 96' ' ' ASN . 6.9 pt20 -51.75 -34.45 39.36 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.554 179.951 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 90.4 t -64.52 -51.12 71.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.58 179.348 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 81.5 mtp -68.68 -38.35 80.28 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.563 179.907 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -59.36 -27.7 66.18 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.587 -179.854 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -61.72 -16.11 46.4 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.604 179.732 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 83.1 t -64.77 -19.09 24.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.525 179.719 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -55.64 -38.76 69.95 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.502 -179.934 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 77.0 mt-30 45.55 -115.36 0.51 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.559 -179.714 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 28.9 m -64.49 133.26 52.07 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.556 -179.89 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 86.9 mt-10 -124.19 -175.61 3.29 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.519 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 108' ' ' GLU . . . . . 0.55 ' O ' ' N ' ' A' ' 110' ' ' LEU . 73.8 mm-40 -106.58 122.45 46.34 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.553 179.373 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 109' ' ' ILE . . . . . 0.418 ' O ' ' OG ' ' A' ' 112' ' ' SER . 43.8 pt -45.49 -12.87 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.595 179.869 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.55 ' N ' ' O ' ' A' ' 108' ' ' GLU . 25.6 mt -67.11 -44.94 78.68 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.509 179.843 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 62.4 tttm -65.34 -33.86 76.96 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.566 -179.605 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 112' ' ' SER . . . . . 0.418 ' OG ' ' O ' ' A' ' 109' ' ' ILE . 97.0 p -63.57 -46.83 84.09 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.551 -179.813 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 31.7 t30 -65.57 -42.45 91.79 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.588 179.608 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 114' ' ' SER . . . . . 0.444 ' C ' ' H ' ' A' ' 116' ' ' THR . 22.8 t -164.51 132.57 3.38 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.552 179.994 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 86.6 mt-30 -77.94 27.65 0.18 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.54 179.984 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 116' ' ' THR . . . . . 0.444 ' H ' ' C ' ' A' ' 114' ' ' SER . 7.8 m -61.22 -41.3 96.62 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.557 179.914 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 117' ' ' ASP . . . . . 0.522 ' C ' HD12 ' A' ' 118' ' ' LEU . 95.0 m-20 -59.93 -44.96 94.02 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.592 179.656 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.522 HD12 ' C ' ' A' ' 117' ' ' ASP . 10.8 mp -106.38 29.46 6.82 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.626 -179.708 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 72.0 tt0 -46.32 131.26 10.65 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.565 179.949 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 52.9 m80 -112.4 139.07 48.28 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.538 -179.84 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 121' ' ' HIS . . . . . 0.443 ' O ' ' NE2' ' A' ' 124' ' ' HIS . 96.4 m-70 -107.7 141.08 39.78 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.572 179.284 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 75.1 m80 -65.08 -37.04 86.22 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.543 179.701 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 62.6 t60 -119.88 122.48 41.37 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.524 -179.904 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 124' ' ' HIS . . . . . 0.443 ' NE2' ' O ' ' A' ' 121' ' ' HIS . 96.1 m-70 -107.96 134.13 51.3 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.534 179.723 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 89.1 m-70 . . . . . 0 C--O 1.219 -0.512 0 CA-C-O 117.999 -1.0 . . . . 0.0 110.571 179.981 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 201' ' ' MYR . . . . . 0.601 H112 ' CE1' ' A' ' 8' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.704 0 N-CA-C 110.941 -0.864 . . . . 0.0 110.941 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 52.3 tt0 -63.14 -29.38 70.75 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.871 0.367 . . . . 0.0 110.444 -179.827 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 95.2 mt-10 -55.97 -22.98 29.52 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.651 179.811 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 43.2 tp -44.23 -35.3 2.2 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.511 -179.525 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 78.2 p -55.03 -35.14 64.13 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.641 -0.423 . . . . 0.0 109.92 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 68.2 tp60 -64.11 -35.57 81.17 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.181 179.561 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' HIS . . . . . 0.579 ' ND1' ' H81' ' A' ' 201' ' ' MYR . 83.2 t60 -60.28 -44.62 95.18 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.257 179.988 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -58.78 -46.53 87.3 Favored 'General case' 0 C--O 1.241 0.613 0 C-N-CA 120.522 -0.471 . . . . 0.0 110.183 -179.923 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.443 ' O ' ' CB ' ' A' ' 14' ' ' GLN . 87.2 mtt-85 -67.21 -36.53 81.92 Favored 'General case' 0 C--O 1.21 -1.008 0 N-CA-C 109.322 -0.622 . . . . 0.0 109.322 179.607 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.472 ' CD2' H122 ' A' ' 201' ' ' MYR . 20.3 t80 -57.87 -27.9 63.67 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 120.878 -0.329 . . . . 0.0 110.313 -179.433 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 6.7 t -73.8 -51.16 25.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 C-N-CA 120.241 -0.584 . . . . 0.0 111.109 179.69 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -81.49 -23.72 37.17 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.084 0.469 . . . . 0.0 111.635 -179.329 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' GLN . . . . . 0.443 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 66.5 tp60 -77.49 -53.57 7.47 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.978 -179.117 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.572 HD13 ' O ' ' A' ' 15' ' ' LEU . 0.2 OUTLIER -63.47 -45.4 90.98 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-O 120.896 0.379 . . . . 0.0 110.062 -179.907 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.552 ' HB3' HG11 ' A' ' 26' ' ' VAL . 98.3 mttt -59.99 -36.22 76.7 Favored 'General case' 0 C--O 1.232 0.145 0 C-N-CA 120.617 -0.433 . . . . 0.0 109.953 179.568 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 73.9 mt-30 -72.94 -40.33 65.48 Favored 'General case' 0 C--O 1.238 0.453 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.632 178.738 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -57.33 -26.57 61.14 Favored 'General case' 0 CA--C 1.518 -0.256 0 CA-C-N 115.918 -0.583 . . . . 0.0 109.97 179.935 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 4.2 mt -84.71 -40.96 16.71 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.846 -0.342 . . . . 0.0 110.452 178.949 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 28.8 mtmt -45.45 -44.2 12.04 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.124 -178.885 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.447 ' H ' HG22 ' A' ' 21' ' ' THR . 0.1 OUTLIER -58.5 -34.33 70.82 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 120.422 -0.511 . . . . 0.0 110.425 -179.5 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 84.2 mmt-85 -66.56 -7.09 17.72 Favored 'General case' 0 C--N 1.332 -0.195 0 C-N-CA 120.656 -0.418 . . . . 0.0 110.295 -179.881 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 107.22 23.7 6.87 Favored Glycine 0 CA--C 1.526 0.778 0 N-CA-C 111.021 -0.832 . . . . 0.0 111.021 -179.721 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.66 HG12 ' N ' ' A' ' 25' ' ' LYS . 38.6 t -102.89 169.32 1.96 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 N-CA-C 110.337 -0.246 . . . . 0.0 110.337 -179.991 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.66 ' N ' HG12 ' A' ' 24' ' ' VAL . 99.0 mttt -134.65 131.82 38.22 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.985 -0.376 . . . . 0.0 109.985 179.268 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.552 HG11 ' HB3' ' A' ' 16' ' ' LYS . 28.4 m -122.88 129.23 75.26 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.285 0 N-CA-C 109.989 -0.374 . . . . 0.0 109.989 179.887 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 23.7 ttmt -109.53 159.99 16.61 Favored 'General case' 0 N--CA 1.463 0.18 0 N-CA-C 110.065 -0.346 . . . . 0.0 110.065 179.585 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -50.61 -31.77 16.93 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.001 0.429 . . . . 0.0 109.867 179.341 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -55.34 -23.31 23.29 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.225 179.414 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.423 ' O ' ' CB ' ' A' ' 34' ' ' PHE . 86.0 m-20 -61.2 -48.15 82.84 Favored 'General case' 0 C--O 1.219 -0.512 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.56 -179.525 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.495 ' O ' ' CB ' ' A' ' 35' ' ' PHE . 5.3 mp -66.07 -41.45 90.74 Favored 'General case' 0 C--O 1.216 -0.708 0 C-N-CA 120.571 -0.452 . . . . 0.0 110.385 179.469 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 37.8 mt -58.97 -46.3 88.45 Favored 'General case' 0 C--N 1.313 -0.99 0 C-N-CA 119.468 -0.893 . . . . 0.0 111.176 -178.013 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.441 ' O ' ' CB ' ' A' ' 37' ' ' PHE . 87.9 tttt -85.49 -48.17 9.22 Favored 'General case' 0 C--N 1.319 -0.754 0 C-N-CA 120.553 -0.459 . . . . 0.0 112.091 -178.692 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 34' ' ' PHE . . . . . 0.825 ' O ' HG22 ' A' ' 38' ' ' VAL . 44.0 t80 -63.54 -48.07 79.04 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.376 -178.993 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.495 ' CB ' ' O ' ' A' ' 31' ' ' LEU . 18.4 t80 -61.85 -48.41 80.68 Favored 'General case' 0 C--N 1.33 -0.242 0 C-N-CA 120.475 -0.49 . . . . 0.0 110.363 -179.146 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 65.8 t0 -72.96 -34.8 66.72 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 120.474 -0.49 . . . . 0.0 111.462 -179.803 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.712 ' CZ ' HG22 ' A' ' 59' ' ' VAL . 4.3 t80 -60.99 -48.5 81.55 Favored 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 120.984 -0.286 . . . . 0.0 111.635 -178.296 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.825 HG22 ' O ' ' A' ' 34' ' ' PHE . 15.4 m -74.6 -36.93 42.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 C-N-CA 120.408 -0.517 . . . . 0.0 110.688 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -55.7 -29.79 60.02 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.867 -179.813 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 68.0 t0 -47.03 -61.49 1.85 Allowed 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 120.646 -0.421 . . . . 0.0 110.745 -179.744 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 13.9 p -114.8 2.01 14.27 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.345 -0.388 . . . . 0.0 111.049 179.822 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' CYS . . . . . 0.539 ' N ' ' O ' ' A' ' 38' ' ' VAL . 1.9 m 38.07 58.59 4.9 Favored Pre-proline 0 CA--C 1.534 0.364 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.831 -178.706 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' PRO . . . . . 0.49 ' C ' ' H ' ' A' ' 45' ' ' PHE . 26.9 Cg_exo -63.39 -36.97 52.32 Favored 'Trans proline' 0 N--CA 1.5 1.885 0 C-N-CA 122.617 2.211 . . . . 0.0 112.857 -179.069 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 44' ' ' TRP . . . . . 0.829 ' HE1' ' H ' ' A' ' 52' ' ' ASP . 0.0 OUTLIER -66.45 6.19 0.48 Allowed 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.62 -179.281 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.493 ' C ' ' H ' ' A' ' 47' ' ' GLN . 19.8 m-85 44.25 56.48 13.51 Favored Pre-proline 0 C--N 1.33 -0.24 0 N-CA-C 109.887 -0.412 . . . . 0.0 109.887 -179.832 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.494 ' O ' ' H42' ' A' ' 201' ' ' MYR . 10.2 Cg_endo -51.27 -6.34 0.12 Allowed 'Trans proline' 0 N--CA 1.493 1.445 0 C-N-CA 122.773 2.316 . . . . 0.0 111.917 179.929 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.493 ' H ' ' C ' ' A' ' 45' ' ' PHE . 95.9 mm-40 -62.72 -52.04 64.82 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.128 -179.913 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.482 ' N ' ' CD ' ' A' ' 48' ' ' GLU . 0.0 OUTLIER -88.0 -31.82 19.14 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-O 121.04 0.448 . . . . 0.0 110.169 178.973 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 85.7 66.18 1.42 Allowed Glycine 0 CA--C 1.523 0.554 0 N-CA-C 110.616 -0.994 . . . . 0.0 110.616 -178.731 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 14.8 t -125.98 170.24 11.91 Favored 'General case' 0 CA--C 1.517 -0.305 0 CA-C-O 120.679 0.276 . . . . 0.0 110.772 -179.502 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.445 HD11 ' OH ' ' A' ' 11' ' ' TYR . 1.3 mt -102.36 138.88 25.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.198 179.814 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 52' ' ' ASP . . . . . 0.829 ' H ' ' HE1' ' A' ' 44' ' ' TRP . 84.2 m-20 -114.28 122.15 45.84 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.726 179.644 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.504 ' CG1' HD12 ' A' ' 90' ' ' ILE . 29.9 mm -94.63 -55.86 5.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.506 179.735 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -78.01 -50.48 12.02 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-O 121.032 0.444 . . . . 0.0 111.707 -179.06 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 93.1 mtt-85 -59.47 -32.01 69.85 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.082 -0.508 . . . . 0.0 109.863 -179.64 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' TRP . . . . . 0.573 ' CE3' ' CH2' ' A' ' 44' ' ' TRP . 23.2 t-105 -60.7 -40.81 93.64 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.449 179.098 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 92.5 mtm-85 -63.28 -33.63 75.93 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 120.291 -0.564 . . . . 0.0 109.831 179.92 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 74.0 ttt180 -60.41 -52.47 65.1 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 120.315 -0.554 . . . . 0.0 110.853 -179.571 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.712 HG22 ' CZ ' ' A' ' 37' ' ' PHE . 4.3 p -69.0 -42.8 82.26 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.571 0 CA-C-O 120.71 0.29 . . . . 0.0 110.567 179.48 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 60' ' ' GLY . . . . . 0.435 ' O ' ' CB ' ' A' ' 64' ' ' GLN . . . -65.27 -47.58 78.72 Favored Glycine 0 CA--C 1.525 0.688 0 CA-C-N 116.297 -0.41 . . . . 0.0 112.337 -178.945 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 96.9 m-20 -60.98 -40.76 94.65 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.784 0.292 . . . . 0.0 111.296 -178.552 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 70.7 m -61.72 -59.92 4.45 Favored 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 120.708 -0.397 . . . . 0.0 111.467 -179.299 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 15.4 m-85 -65.72 -42.71 90.75 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.342 -179.805 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' GLN . . . . . 0.473 ' HG2' HD21 ' A' ' 68' ' ' ASN . 58.2 tt0 -61.17 -41.31 96.57 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.388 -179.458 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 24.8 t0 -55.46 -56.78 16.19 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.872 0.368 . . . . 0.0 110.906 -179.757 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 50.5 m-85 -64.57 -43.31 94.3 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 120.57 -0.452 . . . . 0.0 110.421 179.664 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 64.7 t80 -52.65 -42.33 64.58 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.596 -179.351 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' ASN . . . . . 0.473 HD21 ' HG2' ' A' ' 64' ' ' GLN . 19.3 m-20 -62.77 -42.51 99.72 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.421 -179.298 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 25.0 p -71.67 -16.46 62.25 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.495 -179.992 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -87.35 12.83 11.04 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.769 -179.632 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 152.06 -79.17 0.2 Allowed Glycine 0 CA--C 1.53 0.98 0 C-N-CA 120.384 -0.912 . . . . 0.0 112.322 179.039 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_exo -40.59 100.84 0.03 OUTLIER 'Trans proline' 0 C--N 1.307 -1.642 0 C-N-CA 122.712 2.275 . . . . 0.0 112.06 -178.514 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 80.2 mm-40 -73.47 -42.76 61.51 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.655 -0.702 . . . . 0.0 109.928 179.19 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.668 ' CD ' ' H ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -94.95 -13.39 25.38 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.091 179.779 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.485 ' O ' ' O ' ' A' ' 74' ' ' LYS . 36.4 t 56.22 123.77 0.01 OUTLIER Pre-proline 0 CA--C 1.544 0.715 0 O-C-N 123.143 0.277 . . . . 0.0 111.416 -179.938 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_exo -53.24 128.04 27.56 Favored 'Trans proline' 0 N--CA 1.495 1.616 0 C-N-CA 121.166 1.244 . . . . 0.0 112.251 179.232 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.453 ' O ' ' N ' ' A' ' 80' ' ' PHE . 59.8 t -82.84 -18.42 10.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 115.38 -0.827 . . . . 0.0 110.65 179.211 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 62.7 p -42.98 -24.23 0.06 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.924 0.392 . . . . 0.0 110.433 -179.621 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' ALA . . . . . 0.436 ' N ' ' O ' ' A' ' 77' ' ' VAL . . . -64.88 -37.88 89.09 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.784 179.642 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 80' ' ' PHE . . . . . 0.453 ' N ' ' O ' ' A' ' 77' ' ' VAL . 3.7 m-85 -58.94 -33.14 70.25 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.418 -179.744 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 39.0 t -60.3 -42.94 96.59 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.115 179.708 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 -59.69 -49.91 75.92 Favored 'General case' 0 CA--C 1.517 -0.311 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.586 179.722 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' TRP . . . . . 0.471 ' C ' ' CD1' ' A' ' 83' ' ' TRP . 8.3 t-105 -54.51 -40.38 68.51 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.733 -179.826 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 87.6 m-20 -61.98 -44.84 95.9 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 120.461 -0.496 . . . . 0.0 111.153 -179.404 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 29.9 tp -73.29 -55.08 6.9 Favored 'General case' 0 C--O 1.222 -0.377 0 C-N-CA 120.31 -0.556 . . . . 0.0 110.565 179.569 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -55.58 -25.77 18.54 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 C-N-CA 120.591 -0.444 . . . . 0.0 110.406 179.921 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 67.4 tttt -67.4 -50.68 58.49 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.656 179.648 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 88' ' ' GLU . . . . . 0.413 ' OE1' ' O ' ' A' ' 88' ' ' GLU . 1.1 pp20? -79.76 -20.02 47.3 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.745 -0.661 . . . . 0.0 111.113 -179.077 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.531 ' O ' HD13 ' A' ' 89' ' ' LEU . 0.2 OUTLIER -62.05 -46.3 89.76 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 120.66 -0.416 . . . . 0.0 110.227 -179.446 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.504 HD12 ' CG1' ' A' ' 53' ' ' ILE . 3.8 mt -64.69 -43.05 96.61 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.215 0 C-N-CA 120.184 -0.606 . . . . 0.0 109.85 -179.662 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -54.92 -42.83 72.7 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.974 -178.758 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 58.9 mmtt -48.32 131.13 16.71 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 120.668 -0.413 . . . . 0.0 110.4 -179.991 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -63.57 -37.43 87.29 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.603 179.854 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 70.5 tt0 -69.92 54.98 0.13 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.347 -179.625 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 35.5 m -70.44 155.51 7.58 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-O 120.946 0.403 . . . . 0.0 110.057 -179.948 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 96' ' ' ASN . . . . . . . . . . . . . 1.3 m-20 -59.28 160.42 12.63 Favored Pre-proline 0 C--N 1.325 -0.476 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.873 -179.289 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -60.02 -10.83 13.46 Favored 'Trans proline' 0 N--CA 1.494 1.503 0 C-N-CA 123.101 2.534 . . . . 0.0 111.941 179.391 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 98' ' ' GLN . . . . . 0.479 ' O ' ' HB2' ' A' ' 102' ' ' ALA . 0.2 OUTLIER -44.36 -26.98 0.38 Allowed 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.869 -179.412 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 85.9 t -65.1 -50.65 73.25 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 C-N-CA 120.434 -0.507 . . . . 0.0 110.578 -179.628 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 96.7 mtp -80.79 -39.11 27.3 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.819 179.645 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -64.93 -31.79 73.19 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.087 -179.527 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 102' ' ' ALA . . . . . 0.479 ' HB2' ' O ' ' A' ' 98' ' ' GLN . . . -62.95 -14.62 49.47 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.736 0.303 . . . . 0.0 110.464 -179.853 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 75.8 t -60.97 -21.83 25.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.448 179.72 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -57.71 -38.28 74.99 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.483 -179.892 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 58.3 tt0 -91.29 96.35 10.5 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.405 179.775 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 3.6 t -147.26 158.19 43.87 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.635 179.973 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 89.9 mt-10 -89.0 149.17 23.38 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.459 -179.822 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 108' ' ' GLU . . . . . 0.522 ' C ' ' H ' ' A' ' 110' ' ' LEU . 97.0 mt-10 -73.84 139.16 44.89 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 120.378 -0.529 . . . . 0.0 109.655 179.092 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 26.7 pt -54.86 -5.21 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.127 179.452 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.622 ' O ' HD12 ' A' ' 110' ' ' LEU . 3.4 pp -170.35 120.05 0.59 Allowed 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 116.251 -0.431 . . . . 0.0 109.99 179.789 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 111' ' ' LYS . . . . . 0.448 ' HG3' ' H ' ' A' ' 114' ' ' SER . 25.5 pttm -139.4 151.12 46.03 Favored 'General case' 0 C--O 1.231 0.124 0 CA-C-O 120.67 0.271 . . . . 0.0 110.377 -179.512 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 88.1 p -60.42 -22.28 63.21 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.667 -179.358 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 39.7 t30 -64.63 -40.81 96.11 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.682 179.73 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 114' ' ' SER . . . . . 0.448 ' H ' ' HG3' ' A' ' 111' ' ' LYS . 23.3 t -117.64 -68.0 0.95 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.917 179.991 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 9.3 mt-30 41.31 86.48 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.034 0.445 . . . . 0.0 110.744 -179.73 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 72.0 p -74.28 -22.86 59.11 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.009 -0.542 . . . . 0.0 110.353 179.869 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 97.7 m-20 -83.44 -66.8 0.85 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.6 179.855 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 43.5 mt -63.44 -41.66 98.67 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.855 -179.89 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 94.0 mt-10 52.79 -170.78 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.701 -179.695 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 77.1 m-70 -66.52 -39.38 88.59 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.742 179.96 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 99.2 m-70 -112.71 149.05 33.46 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.601 -179.908 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 96.2 m-70 -63.93 -39.8 94.99 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.577 -179.771 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 75.6 m80 -113.41 149.06 34.67 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.549 -179.89 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 124' ' ' HIS . . . . . . . . . . . . . 85.2 m-70 -62.63 -43.64 98.3 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.782 -179.948 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 97.6 m-70 . . . . . 0 C--O 1.22 -0.489 0 CA-C-O 118.029 -0.986 . . . . 0.0 110.522 -179.896 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 201' ' ' MYR . . . . . 0.579 ' H81' ' ND1' ' A' ' 8' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.704 0 N-CA-C 110.958 -0.857 . . . . 0.0 110.958 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 77.5 mt-30 -58.27 -31.31 67.33 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.898 0.38 . . . . 0.0 110.624 -179.921 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.431 ' OE1' ' OE1' ' A' ' 7' ' ' GLN . 78.0 mm-40 -51.91 -23.48 5.0 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.284 -179.945 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 37.2 tp -42.84 -27.2 0.17 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.439 -179.406 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 37.6 t -59.68 -41.64 91.14 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.15 179.661 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' GLN . . . . . 0.431 ' OE1' ' OE1' ' A' ' 4' ' ' GLU . 89.1 mt-30 -61.96 -30.19 70.75 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.569 179.827 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 84.5 t60 -63.46 -44.83 93.33 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.822 0.344 . . . . 0.0 110.359 179.932 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 80.5 tt0 -59.66 -50.13 75.04 Favored 'General case' 0 C--O 1.243 0.721 0 CA-C-O 121.361 0.6 . . . . 0.0 110.352 179.7 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.43 ' O ' ' CB ' ' A' ' 14' ' ' GLN . 86.2 mtt180 -62.44 -33.18 74.3 Favored 'General case' 0 C--O 1.211 -0.956 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 179.55 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.532 ' CE1' H143 ' A' ' 201' ' ' MYR . 31.7 t80 -58.89 -36.4 74.59 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 110.175 -0.305 . . . . 0.0 110.175 -179.588 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.406 HG11 ' CD2' ' A' ' 31' ' ' LEU . 3.6 t -64.36 -49.66 79.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 C-N-CA 119.987 -0.685 . . . . 0.0 111.488 179.997 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -81.08 -30.74 34.62 Favored 'General case' 0 C--N 1.324 -0.523 0 C-N-CA 120.582 -0.447 . . . . 0.0 111.826 -179.357 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' GLN . . . . . 0.43 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 60.5 tp60 -74.23 -52.17 13.18 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.916 -0.583 . . . . 0.0 110.896 -178.982 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.568 HD13 ' O ' ' A' ' 15' ' ' LEU . 0.2 OUTLIER -62.91 -44.21 96.7 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 120.407 -0.517 . . . . 0.0 109.809 -179.557 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.662 ' HB3' HG21 ' A' ' 26' ' ' VAL . 66.0 mttm -59.53 -34.4 72.6 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.848 0.356 . . . . 0.0 110.198 179.091 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 35.8 mm-40 -66.58 -42.01 87.65 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.489 0.661 . . . . 0.0 110.022 179.038 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.624 ' O ' HG22 ' A' ' 21' ' ' THR . . . -61.39 -28.66 69.4 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.912 -0.585 . . . . 0.0 109.732 179.277 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.9 mt -74.19 -33.85 63.56 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.933 0.397 . . . . 0.0 110.652 178.651 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 67.8 mttm -54.56 -37.33 65.34 Favored 'General case' 0 C--N 1.323 -0.548 0 C-N-CA 120.188 -0.605 . . . . 0.0 109.883 -179.775 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.624 HG22 ' O ' ' A' ' 18' ' ' ALA . 1.2 t -60.57 -28.1 68.2 Favored 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 120.397 -0.521 . . . . 0.0 110.863 179.37 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 7.7 mmm180 -80.2 12.79 2.65 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-O 120.98 0.419 . . . . 0.0 110.584 -179.567 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 81.04 14.0 80.1 Favored Glycine 0 CA--C 1.522 0.514 0 N-CA-C 110.491 -1.044 . . . . 0.0 110.491 -179.8 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.581 HG12 ' N ' ' A' ' 25' ' ' LYS . 37.9 t -86.83 165.34 2.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 C-N-CA 120.981 -0.287 . . . . 0.0 110.446 -179.706 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.581 ' N ' HG12 ' A' ' 24' ' ' VAL . 99.1 mttt -139.12 129.61 25.76 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 120.916 -0.314 . . . . 0.0 110.235 179.429 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.662 HG21 ' HB3' ' A' ' 16' ' ' LYS . 13.7 m -126.74 130.89 71.57 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.239 0 N-CA-C 109.943 -0.391 . . . . 0.0 109.943 179.584 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.55 ' N ' ' OD2' ' A' ' 30' ' ' ASP . 10.9 ttmt -109.16 161.78 14.89 Favored 'General case' 0 C--O 1.221 -0.401 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 179.674 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.411 ' H ' ' HG2' ' A' ' 27' ' ' LYS . 98.4 m-85 -41.89 -33.28 0.51 Allowed 'General case' 0 C--O 1.236 0.392 0 CA-C-O 121.101 0.477 . . . . 0.0 110.796 179.646 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.401 ' HA ' HD12 ' A' ' 32' ' ' LEU . . . -55.7 -22.45 23.52 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.525 179.702 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.55 ' OD2' ' N ' ' A' ' 27' ' ' LYS . 3.2 m-20 -58.55 -49.48 77.27 Favored 'General case' 0 CA--C 1.516 -0.364 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.281 -179.396 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.5 ' O ' ' CB ' ' A' ' 35' ' ' PHE . 4.9 mp -67.21 -41.27 86.05 Favored 'General case' 0 C--O 1.215 -0.75 0 CA-C-O 120.985 0.421 . . . . 0.0 110.242 179.273 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.448 ' O ' ' OD1' ' A' ' 36' ' ' ASP . 40.8 mt -59.04 -44.97 91.84 Favored 'General case' 0 C--N 1.315 -0.927 0 C-N-CA 119.692 -0.803 . . . . 0.0 111.246 -178.238 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.527 ' O ' ' CD1' ' A' ' 37' ' ' PHE . 88.6 tttt -84.53 -37.79 20.82 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.939 -178.658 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 34' ' ' PHE . . . . . 0.581 ' O ' HG22 ' A' ' 38' ' ' VAL . 62.4 t80 -78.07 -51.03 10.93 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.393 -178.681 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.5 ' CB ' ' O ' ' A' ' 31' ' ' LEU . 12.9 t80 -60.07 -46.55 89.19 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.389 -179.327 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' ASP . . . . . 0.468 ' OD1' ' O ' ' A' ' 33' ' ' LYS . 3.7 p-10 -70.28 -31.37 68.7 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 120.216 -0.594 . . . . 0.0 111.198 -179.438 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.527 ' CD1' ' O ' ' A' ' 33' ' ' LYS . 1.4 m-85 -60.68 -55.62 31.07 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-O 120.73 0.3 . . . . 0.0 111.673 -179.037 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.581 HG22 ' O ' ' A' ' 34' ' ' PHE . 5.3 m -69.7 -37.65 74.38 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 C-N-CA 120.556 -0.458 . . . . 0.0 110.717 -179.565 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 65.5 tttm -56.92 -27.61 61.07 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.57 -179.822 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 93.4 m-20 -50.6 -62.98 1.27 Allowed 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 120.685 -0.406 . . . . 0.0 110.63 -179.546 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.492 ' O ' ' SG ' ' A' ' 42' ' ' CYS . 24.9 p -115.05 8.99 15.87 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.293 -179.943 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' CYS . . . . . 0.521 ' N ' ' O ' ' A' ' 38' ' ' VAL . 7.4 p 38.42 59.14 5.24 Favored Pre-proline 0 N--CA 1.465 0.279 0 CA-C-O 120.883 0.373 . . . . 0.0 110.679 -179.529 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 43' ' ' PRO . . . . . 0.49 ' C ' ' H ' ' A' ' 45' ' ' PHE . 57.5 Cg_endo -74.21 -28.1 10.99 Favored 'Trans proline' 0 C--N 1.31 -1.499 0 C-N-CA 122.79 2.327 . . . . 0.0 112.445 -179.619 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 44' ' ' TRP . . . . . 0.527 ' NE1' H132 ' A' ' 201' ' ' MYR . 0.6 OUTLIER -62.28 1.37 0.33 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.603 -179.469 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.544 ' O ' ' N ' ' A' ' 47' ' ' GLN . 60.8 m-85 50.44 55.61 16.81 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.44 -179.277 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.425 ' CD ' ' N ' ' A' ' 45' ' ' PHE . 70.1 Cg_exo -42.14 -14.82 0.05 OUTLIER 'Trans proline' 0 C--N 1.307 -1.627 0 C-N-CA 122.849 2.366 . . . . 0.0 112.218 179.644 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.773 ' O ' ' H31' ' A' ' 201' ' ' MYR . 87.1 mt-30 -65.98 -53.07 43.64 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.248 -179.27 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.727 ' O ' ' H51' ' A' ' 201' ' ' MYR . 65.8 tt0 -88.87 -30.21 19.07 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.373 178.599 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 49' ' ' GLY . . . . . 0.41 ' O ' ' H71' ' A' ' 201' ' ' MYR . . . 73.78 50.64 10.74 Favored Glycine 0 CA--C 1.526 0.764 0 N-CA-C 110.383 -1.087 . . . . 0.0 110.383 -179.239 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 50' ' ' THR . . . . . 0.465 ' O ' ' CD1' ' A' ' 44' ' ' TRP . 15.0 t -107.68 160.71 15.49 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.842 0.354 . . . . 0.0 110.744 -179.468 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.434 ' HB ' HD11 ' A' ' 90' ' ' ILE . 1.5 mt -89.71 137.35 21.59 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-O 121.143 0.497 . . . . 0.0 110.593 179.452 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 57.9 m-20 -108.18 120.77 43.29 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.435 -0.802 . . . . 0.0 111.328 179.227 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.475 ' CG1' HD12 ' A' ' 90' ' ' ILE . 30.2 mm -95.03 -57.01 4.68 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.255 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.17 179.166 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -77.09 -49.03 16.21 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-O 121.076 0.465 . . . . 0.0 111.215 -179.659 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 84.5 mtt85 -60.31 -32.47 71.25 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.01 -179.628 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 13.8 t-105 -61.87 -40.3 94.91 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.735 179.48 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 80.2 mtp85 -62.82 -38.55 91.16 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.531 -179.555 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 83.7 mtt85 -60.84 -52.65 64.16 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 120.593 -0.443 . . . . 0.0 111.385 -179.546 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.409 HG13 ' N ' ' A' ' 60' ' ' GLY . 3.2 p -66.55 -42.12 89.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.6 179.739 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 60' ' ' GLY . . . . . 0.409 ' N ' HG13 ' A' ' 59' ' ' VAL . . . -61.7 -45.37 96.4 Favored Glycine 0 CA--C 1.522 0.521 0 N-CA-C 111.229 -0.748 . . . . 0.0 111.229 -179.399 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 71.3 m-20 -64.67 -35.15 80.1 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 121.118 -0.233 . . . . 0.0 110.669 -179.444 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 72.4 m -64.21 -59.73 4.06 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.809 0.338 . . . . 0.0 111.144 -179.492 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 50.7 m-85 -65.4 -39.7 92.52 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.284 -0.417 . . . . 0.0 110.86 179.642 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' GLN . . . . . 0.402 ' CB ' ' O ' ' A' ' 60' ' ' GLY . 58.5 tt0 -63.91 -36.02 82.57 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.749 -179.65 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 31.4 t0 -60.75 -52.77 63.7 Favored 'General case' 0 C--N 1.323 -0.549 0 C-N-CA 120.709 -0.396 . . . . 0.0 110.497 179.957 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 69.8 m-85 -70.5 -42.73 70.94 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.911 179.69 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 65.0 t80 -57.99 -43.39 86.54 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.226 -179.457 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' ASN . . . . . 0.455 ' C ' ' OD1' ' A' ' 68' ' ' ASN . 21.2 t-20 -60.58 -44.32 96.35 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.28 -179.917 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 82.2 p -74.48 -18.36 60.63 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 120.555 -0.458 . . . . 0.0 110.111 -179.934 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 26.7 m-85 -109.04 16.5 22.53 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.261 179.736 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -167.7 -105.61 0.18 Allowed Glycine 0 CA--C 1.533 1.156 0 C-N-CA 120.579 -0.82 . . . . 0.0 111.126 -179.99 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' PRO . . . . . 0.585 ' HG2' HG22 ' A' ' 75' ' ' VAL . 67.7 Cg_endo -74.13 147.61 38.27 Favored 'Trans proline' 0 N--CA 1.494 1.558 0 C-N-CA 121.893 1.729 . . . . 0.0 113.093 -179.592 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 98.1 mt-10 -85.64 -47.49 9.77 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.286 179.541 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.704 ' CD ' ' H ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -95.84 -17.34 21.21 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.512 -178.821 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.585 HG22 ' HG2' ' A' ' 72' ' ' PRO . 26.7 t 59.2 131.87 0.02 OUTLIER Pre-proline 0 C--N 1.324 -0.505 0 CA-C-N 115.589 -0.732 . . . . 0.0 111.214 -179.186 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 49.4 Cg_exo -52.43 127.88 25.72 Favored 'Trans proline' 0 N--CA 1.494 1.536 0 C-N-CA 121.629 1.552 . . . . 0.0 111.358 179.045 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.458 ' O ' HG12 ' A' ' 77' ' ' VAL . 46.2 t -82.62 -8.5 11.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.898 179.988 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 73.7 p -48.22 -20.51 0.38 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.361 -179.707 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -60.45 -24.62 65.37 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.499 179.5 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 47.8 t80 -60.81 -39.25 88.26 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.436 -179.987 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 77.4 p -58.46 -40.52 82.88 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.529 -179.958 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 82' ' ' TYR . . . . . 0.43 ' OH ' HG11 ' A' ' 26' ' ' VAL . 23.5 m-85 -60.62 -52.3 65.75 Favored 'General case' 0 C--O 1.221 -0.412 0 C-N-CA 120.674 -0.41 . . . . 0.0 110.812 179.736 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 83' ' ' TRP . . . . . 0.405 ' O ' ' CB ' ' A' ' 87' ' ' LYS . 77.2 t90 -54.14 -39.67 66.69 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.431 -0.349 . . . . 0.0 110.638 -179.807 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 67.7 m-20 -63.28 -47.12 83.68 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.768 -0.373 . . . . 0.0 111.197 -179.813 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 32.7 tp -70.67 -54.39 12.07 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 120.21 -0.596 . . . . 0.0 110.705 179.399 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -56.53 -26.62 23.41 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.162 -179.81 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.405 ' CB ' ' O ' ' A' ' 83' ' ' TRP . 53.8 tttt -66.61 -49.18 67.14 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.841 -179.473 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.2 pp20? -79.6 -20.44 46.88 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.54 -179.788 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.516 ' O ' HD13 ' A' ' 89' ' ' LEU . 0.2 OUTLIER -62.36 -45.82 91.42 Favored 'General case' 0 N--CA 1.446 -0.64 0 C-N-CA 120.077 -0.649 . . . . 0.0 110.574 -179.224 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.475 HD12 ' CG1' ' A' ' 53' ' ' ILE . 3.5 mt -64.91 -43.57 96.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 C-N-CA 120.332 -0.547 . . . . 0.0 109.78 -179.936 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 91.1 m-20 -44.06 -36.86 2.72 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.844 -178.455 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -50.49 129.28 21.85 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 120.475 -0.49 . . . . 0.0 110.427 179.803 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -62.34 -40.72 97.29 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.652 -179.853 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 94' ' ' GLU . . . . . 0.468 ' O ' ' C ' ' A' ' 95' ' ' VAL . 97.7 mt-10 -71.33 -3.96 23.48 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.823 -179.607 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.468 ' C ' ' O ' ' A' ' 94' ' ' GLU . 2.4 m 29.58 -109.88 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.36 0 O-C-N 123.711 0.632 . . . . 0.0 110.403 -179.791 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 96' ' ' ASN . . . . . 0.595 ' OD1' ' NE2' ' A' ' 98' ' ' GLN . 0.0 OUTLIER -154.17 169.93 9.24 Favored Pre-proline 0 C--N 1.325 -0.461 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.482 178.962 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -48.56 -13.14 0.23 Allowed 'Trans proline' 0 N--CA 1.494 1.542 0 C-N-CA 122.705 2.27 . . . . 0.0 112.296 179.118 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 98' ' ' GLN . . . . . 0.595 ' NE2' ' OD1' ' A' ' 96' ' ' ASN . 0.1 OUTLIER -53.17 -20.85 4.31 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.704 -179.908 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 90.4 t -61.17 -49.44 84.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.812 -178.92 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 78.3 mtm -72.59 -42.37 64.63 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.953 0.406 . . . . 0.0 111.099 179.6 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 101' ' ' ALA . . . . . 0.613 ' HB1' ' H32' ' A' ' 201' ' ' MYR . . . -60.97 -26.06 67.29 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.627 -179.248 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 102' ' ' ALA . . . . . 0.439 ' HB2' ' OE2' ' A' ' 48' ' ' GLU . . . -57.13 -15.55 5.76 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.481 179.817 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 72.0 t -64.76 -21.33 29.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.304 179.647 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -57.04 -40.75 77.35 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.715 -179.857 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 31.9 mt-30 -100.57 70.39 1.45 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.335 179.772 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 87.1 m -61.25 -45.06 96.07 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.135 -179.627 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 90.3 mt-10 49.85 -161.01 0.06 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.17 -179.845 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 108' ' ' GLU . . . . . 0.555 ' OE1' ' N ' ' A' ' 108' ' ' GLU . 56.3 mp0 -112.21 118.82 36.38 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 179.613 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 41.5 pt -48.82 -14.13 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.339 -179.853 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.47 ' N ' ' C ' ' A' ' 108' ' ' GLU . 30.9 mt -64.91 -41.23 95.75 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.395 179.467 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -68.36 -35.82 78.29 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.399 179.818 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 44.7 t -60.81 -47.63 85.49 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.668 -179.508 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 92.3 m-20 -65.57 -45.0 84.99 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.548 179.769 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 40.3 t -158.2 139.02 12.99 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.344 179.809 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 87.9 mt-30 -85.42 -4.63 59.22 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.384 179.843 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 15.0 m -62.5 -46.68 87.34 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.706 -179.631 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -63.33 -36.98 85.5 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.962 0.41 . . . . 0.0 110.47 179.977 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 38.3 tp -142.84 90.87 2.24 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.549 179.785 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 93.0 mt-10 -66.32 -40.15 89.73 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.761 0.315 . . . . 0.0 110.625 179.79 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 97.2 m-70 -135.88 143.74 45.19 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.561 -179.698 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 98.9 m-70 -69.42 138.98 54.0 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.607 -179.909 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 73.3 t60 -60.74 -40.78 93.65 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.58 -179.872 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 67.8 m80 -99.32 120.59 39.82 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.501 -179.847 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 124' ' ' HIS . . . . . . . . . . . . . 64.5 t-80 -61.49 -46.13 91.31 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.524 -179.933 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 84.1 t60 . . . . . 0 C--O 1.219 -0.507 0 CA-C-O 117.988 -1.006 . . . . 0.0 110.61 -179.964 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 201' ' ' MYR . . . . . 0.773 ' H31' ' O ' ' A' ' 47' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.725 0 N-CA-C 111.096 -0.802 . . . . 0.0 111.096 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 99.4 mm-40 -62.86 -30.18 71.31 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.899 0.381 . . . . 0.0 110.483 -179.871 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.427 ' O ' ' N ' ' A' ' 7' ' ' GLN . 80.0 mm-40 -56.01 -22.15 25.38 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.542 179.593 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 36.6 tp -41.38 -28.94 0.13 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.031 0.443 . . . . 0.0 110.266 -179.403 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 54.1 m -58.25 -41.27 83.86 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.963 0.411 . . . . 0.0 110.173 179.675 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' GLN . . . . . 0.427 ' N ' ' O ' ' A' ' 4' ' ' GLU . 88.1 mt-30 -64.26 -31.83 73.18 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.835 179.97 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' HIS . . . . . 0.479 ' HA ' ' H91' ' A' ' 201' ' ' MYR . 86.4 t60 -60.18 -45.67 92.31 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-O 120.913 0.387 . . . . 0.0 110.285 179.95 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 99.3 mt-10 -60.48 -43.96 96.42 Favored 'General case' 0 C--O 1.244 0.772 0 CA-C-O 121.243 0.544 . . . . 0.0 110.126 179.769 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.436 ' O ' ' CB ' ' A' ' 14' ' ' GLN . 92.2 mtt-85 -63.18 -34.09 76.88 Favored 'General case' 0 C--O 1.211 -0.969 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 179.578 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.777 ' CE2' H122 ' A' ' 201' ' ' MYR . 37.4 t80 -59.11 -38.68 80.15 Favored 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 120.765 -0.374 . . . . 0.0 110.369 -179.636 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 2.2 t -60.55 -51.81 68.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 C-N-CA 119.624 -0.83 . . . . 0.0 110.983 -179.675 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 82.8 tt0 -79.56 -38.31 34.43 Favored 'General case' 0 C--N 1.322 -0.609 0 C-N-CA 120.14 -0.624 . . . . 0.0 112.053 -178.968 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' GLN . . . . . 0.436 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 69.0 tp60 -64.32 -50.5 67.57 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.847 -179.0 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.568 HD13 ' O ' ' A' ' 15' ' ' LEU . 0.2 OUTLIER -62.98 -46.39 87.94 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.487 -0.485 . . . . 0.0 110.073 -179.648 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 61.0 mttp -58.14 -31.6 67.36 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 120.746 -0.381 . . . . 0.0 110.203 179.482 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 75.5 mt-30 -75.73 -35.19 60.3 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.723 178.889 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -57.14 -35.99 70.16 Favored 'General case' 0 CA--C 1.519 -0.224 0 CA-C-N 115.727 -0.67 . . . . 0.0 110.01 -179.992 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.436 ' O ' ' N ' ' A' ' 22' ' ' ARG . 3.0 mt -84.97 -32.92 22.76 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.131 0.491 . . . . 0.0 110.587 179.172 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -46.02 -42.04 12.76 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.472 -179.121 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.499 ' C ' ' H ' ' A' ' 23' ' ' GLY . 0.1 OUTLIER -74.74 -23.5 58.57 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.693 -179.972 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.436 ' N ' ' O ' ' A' ' 19' ' ' LEU . 27.0 mmt180 -73.44 19.91 0.1 Allowed 'General case' 0 N--CA 1.463 0.224 0 CA-C-O 120.78 0.324 . . . . 0.0 110.4 179.987 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' GLY . . . . . 0.499 ' H ' ' C ' ' A' ' 21' ' ' THR . . . 87.75 16.84 59.25 Favored Glycine 0 CA--C 1.524 0.633 0 N-CA-C 110.941 -0.863 . . . . 0.0 110.941 -179.976 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.597 HG12 ' N ' ' A' ' 25' ' ' LYS . 21.7 t -106.4 167.97 3.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 120.635 0.255 . . . . 0.0 110.533 -179.873 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.597 ' N ' HG12 ' A' ' 24' ' ' VAL . 88.3 tttt -135.37 128.84 32.4 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 109.881 -0.414 . . . . 0.0 109.881 179.345 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.504 HG23 ' O ' ' A' ' 26' ' ' VAL . 26.5 m -125.48 118.46 52.49 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.16 0 N-CA-C 109.993 -0.373 . . . . 0.0 109.993 -179.925 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.513 ' HD3' ' H ' ' A' ' 29' ' ' ALA . 13.7 tmtt? -110.03 160.07 16.75 Favored 'General case' 0 C--O 1.222 -0.392 0 N-CA-C 109.716 -0.476 . . . . 0.0 109.716 179.614 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 88.7 m-85 -41.94 -28.99 0.19 Allowed 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.028 0.442 . . . . 0.0 110.968 179.841 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.513 ' H ' ' HD3' ' A' ' 27' ' ' LYS . . . -60.27 -24.62 65.07 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.828 -179.849 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.455 ' O ' ' CB ' ' A' ' 34' ' ' PHE . 13.0 m-20 -62.48 -44.73 95.68 Favored 'General case' 0 C--O 1.216 -0.658 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.564 -179.673 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.494 ' H ' HD12 ' A' ' 31' ' ' LEU . 5.7 mp -65.48 -40.89 93.66 Favored 'General case' 0 C--N 1.322 -0.619 0 C-N-CA 120.576 -0.449 . . . . 0.0 110.101 179.449 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 32.1 mt -59.84 -45.23 93.08 Favored 'General case' 0 C--N 1.317 -0.833 0 C-N-CA 119.433 -0.907 . . . . 0.0 111.122 -178.698 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.424 ' O ' ' CB ' ' A' ' 37' ' ' PHE . 48.7 tttp -85.57 -47.37 9.93 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 112.084 0.402 . . . . 0.0 112.084 -179.016 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 34' ' ' PHE . . . . . 0.844 ' O ' HG22 ' A' ' 38' ' ' VAL . 54.4 t80 -63.42 -50.41 69.91 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.976 -178.833 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.475 ' CB ' ' O ' ' A' ' 31' ' ' LEU . 9.3 t80 -62.69 -45.1 94.34 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.298 -179.673 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 56.7 t0 -73.1 -37.17 66.82 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 120.558 -0.457 . . . . 0.0 111.332 -179.508 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.562 ' CZ ' HG22 ' A' ' 59' ' ' VAL . 5.6 t80 -61.43 -47.87 83.79 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.332 -178.376 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.844 HG22 ' O ' ' A' ' 34' ' ' PHE . 19.6 m -72.26 -35.89 54.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 115.626 -0.716 . . . . 0.0 110.341 -179.869 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 65.1 tttm -58.57 -28.98 66.04 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.475 179.78 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 62.9 t0 -45.05 -59.65 2.49 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 120.58 -0.448 . . . . 0.0 110.606 -179.857 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 11.4 p -113.86 -5.28 13.24 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.744 0.307 . . . . 0.0 110.885 179.945 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' CYS . . . . . 0.548 ' N ' ' HD3' ' A' ' 43' ' ' PRO . 0.0 OUTLIER 48.65 54.36 15.91 Favored Pre-proline 0 CA--C 1.538 0.493 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.572 -178.738 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 43' ' ' PRO . . . . . 0.548 ' HD3' ' N ' ' A' ' 42' ' ' CYS . 27.0 Cg_exo -62.16 -38.97 51.95 Favored 'Trans proline' 0 N--CA 1.496 1.649 0 C-N-CA 122.051 1.834 . . . . 0.0 113.034 -179.075 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 44' ' ' TRP . . . . . 0.873 ' HE1' ' H ' ' A' ' 52' ' ' ASP . 0.0 OUTLIER -71.7 0.75 8.06 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.025 -178.911 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.566 ' O ' ' N ' ' A' ' 47' ' ' GLN . 33.9 m-85 53.37 48.51 5.13 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.664 -179.086 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.535 ' CD ' ' N ' ' A' ' 45' ' ' PHE . 44.7 Cg_exo -39.02 -17.83 0.04 OUTLIER 'Trans proline' 0 C--N 1.312 -1.394 0 C-N-CA 122.845 2.363 . . . . 0.0 112.348 179.11 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.566 ' N ' ' O ' ' A' ' 45' ' ' PHE . 33.6 mt-30 -58.25 -52.84 63.88 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.428 -179.642 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.562 ' O ' ' H51' ' A' ' 201' ' ' MYR . 47.1 tp10 -88.3 -34.22 17.74 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.821 -0.352 . . . . 0.0 110.236 178.975 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 49' ' ' GLY . . . . . 0.457 ' HA3' ' H71' ' A' ' 201' ' ' MYR . . . 87.29 71.7 1.29 Allowed Glycine 0 CA--C 1.526 0.723 0 N-CA-C 110.171 -1.172 . . . . 0.0 110.171 -178.514 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 12.4 t -129.76 171.78 12.32 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 110.4 -0.222 . . . . 0.0 110.4 -179.377 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.442 ' HA ' H142 ' A' ' 201' ' ' MYR . 1.1 mt -102.19 142.59 16.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 120.982 0.42 . . . . 0.0 110.491 179.29 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 52' ' ' ASP . . . . . 0.873 ' H ' ' HE1' ' A' ' 44' ' ' TRP . 73.6 m-20 -122.41 121.66 37.17 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.46 -0.791 . . . . 0.0 111.465 179.343 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.484 ' CG1' HD12 ' A' ' 90' ' ' ILE . 23.5 mm -95.58 -56.19 5.43 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.352 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.24 178.964 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -74.15 -50.65 18.41 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-O 120.94 0.4 . . . . 0.0 111.438 -179.531 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 91.4 mtt-85 -61.04 -35.62 77.4 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.533 -179.891 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' TRP . . . . . 0.637 ' CE3' ' CH2' ' A' ' 44' ' ' TRP . 24.8 t-105 -59.38 -36.25 75.42 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.191 0.52 . . . . 0.0 110.452 179.102 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 61.4 ttp180 -66.41 -37.95 86.37 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.162 179.852 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 87.5 mtt180 -60.48 -51.85 67.7 Favored 'General case' 0 N--CA 1.466 0.375 0 C-N-CA 120.956 -0.298 . . . . 0.0 111.75 -178.866 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.562 HG22 ' CZ ' ' A' ' 37' ' ' PHE . 2.9 p -62.46 -42.49 95.9 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.459 0 CA-C-O 120.95 0.405 . . . . 0.0 110.153 -179.952 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -68.95 -39.4 85.15 Favored Glycine 0 CA--C 1.527 0.836 0 N-CA-C 111.452 -0.659 . . . . 0.0 111.452 179.865 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 12.7 m-20 -64.97 -42.1 94.85 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.734 0.302 . . . . 0.0 111.075 -179.191 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 5.4 m -60.04 -53.29 59.56 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.619 -179.263 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 13.8 m-85 -67.61 -37.18 82.15 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.785 179.586 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 53.3 tt0 -62.45 -41.09 98.5 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.717 -179.715 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.462 ' O ' HG23 ' A' ' 69' ' ' THR . 46.2 t0 -60.74 -52.51 64.79 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.756 -179.9 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 66' ' ' TYR . . . . . 0.478 ' O ' ' OG1' ' A' ' 69' ' ' THR . 25.5 m-85 -66.17 -30.58 71.08 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.362 179.482 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 76.8 t80 -68.04 -41.77 81.57 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.541 -179.859 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' ASN . . . . . 0.427 ' O ' ' N ' ' A' ' 71' ' ' GLY . 99.0 m-20 -63.56 -40.24 96.48 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.129 -179.44 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.478 ' OG1' ' O ' ' A' ' 66' ' ' TYR . 74.5 p -49.8 -17.76 0.4 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.515 -179.73 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 70' ' ' PHE . . . . . 0.401 ' N ' ' C ' ' A' ' 68' ' ' ASN . 59.5 m-85 -93.31 15.72 14.94 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.82 -179.953 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 71' ' ' GLY . . . . . 0.427 ' N ' ' O ' ' A' ' 68' ' ' ASN . . . 40.58 58.02 2.64 Favored Glycine 0 CA--C 1.53 0.999 0 N-CA-C 110.905 -0.878 . . . . 0.0 110.905 -179.295 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 72' ' ' PRO . . . . . 0.409 ' HD3' ' N ' ' A' ' 71' ' ' GLY . 56.5 Cg_endo -76.48 132.54 13.6 Favored 'Trans proline' 0 N--CA 1.495 1.606 0 C-N-CA 122.89 2.393 . . . . 0.0 112.13 179.715 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 83.5 tt0 -90.88 -19.94 22.8 Favored 'General case' 0 CA--C 1.507 -0.701 0 CA-C-O 121.408 0.623 . . . . 0.0 110.673 179.813 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.505 ' O ' ' C ' ' A' ' 75' ' ' VAL . 53.9 mmtt -73.01 -47.21 47.14 Favored 'General case' 0 C--N 1.31 -1.134 0 CA-C-N 115.237 -0.892 . . . . 0.0 112.056 -178.134 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.582 ' O ' HG12 ' A' ' 75' ' ' VAL . 53.5 t 25.48 80.56 0.21 Allowed Pre-proline 0 CA--C 1.528 0.099 0 O-C-N 123.765 0.665 . . . . 0.0 111.476 179.874 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_exo -55.76 125.37 18.89 Favored 'Trans proline' 0 C--N 1.307 -1.654 0 C-N-CA 121.663 1.575 . . . . 0.0 111.703 -178.842 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 96.6 t -83.88 -21.09 8.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.788 179.811 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 40.2 p -43.41 -27.57 0.28 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.732 -179.079 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -51.95 -43.28 63.44 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.041 179.777 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' PHE . . . . . 0.678 ' CE2' ' ND2' ' A' ' 84' ' ' ASN . 60.2 t80 -63.05 -42.39 99.71 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.839 179.388 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 39.3 m -58.22 -44.63 88.28 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.477 -0.329 . . . . 0.0 110.871 -179.103 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 14.4 m-85 -60.67 -48.5 81.5 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 120.79 -0.364 . . . . 0.0 110.702 179.751 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' TRP . . . . . 0.407 ' O ' ' CB ' ' A' ' 87' ' ' LYS . 68.5 t90 -56.09 -39.81 72.68 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.647 179.936 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 84' ' ' ASN . . . . . 0.678 ' ND2' ' CE2' ' A' ' 80' ' ' PHE . 49.5 m-20 -61.96 -45.2 94.69 Favored 'General case' 0 C--N 1.326 -0.429 0 C-N-CA 120.658 -0.417 . . . . 0.0 110.966 -179.496 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 50.8 tp -72.47 -56.88 4.7 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 120.466 -0.494 . . . . 0.0 110.449 179.717 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -54.11 -27.25 16.2 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 C-N-CA 120.671 -0.412 . . . . 0.0 110.123 -179.834 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.407 ' CB ' ' O ' ' A' ' 83' ' ' TRP . 65.0 tttt -65.61 -50.89 63.4 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.218 -179.734 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 88' ' ' GLU . . . . . 0.466 ' OE1' ' O ' ' A' ' 88' ' ' GLU . 1.0 OUTLIER -79.66 -19.94 47.88 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.72 -179.371 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.514 ' O ' HD13 ' A' ' 89' ' ' LEU . 0.2 OUTLIER -61.51 -46.42 90.04 Favored 'General case' 0 N--CA 1.444 -0.736 0 C-N-CA 120.128 -0.629 . . . . 0.0 110.043 -179.148 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.484 HD12 ' CG1' ' A' ' 53' ' ' ILE . 3.5 mt -64.05 -42.62 96.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 C-N-CA 120.229 -0.588 . . . . 0.0 109.867 -179.908 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 71.3 m-20 -53.24 -44.81 68.41 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.676 -178.028 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 92' ' ' LYS . . . . . 0.492 ' C ' ' H ' ' A' ' 94' ' ' GLU . 97.5 mttt -71.39 142.76 50.32 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.797 0.332 . . . . 0.0 110.762 179.354 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -71.99 14.95 0.18 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.507 179.841 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 94' ' ' GLU . . . . . 0.492 ' H ' ' C ' ' A' ' 92' ' ' LYS . 40.4 tp10 -61.99 -35.21 77.85 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.296 -179.895 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 34.9 m -70.89 137.58 23.54 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.45 179.924 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 96' ' ' ASN . . . . . 0.525 ' O ' ' N ' ' A' ' 98' ' ' GLN . 0.9 OUTLIER -82.76 166.2 37.33 Favored Pre-proline 0 C--N 1.325 -0.471 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.743 -179.813 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 67.7 Cg_exo -44.94 -11.36 0.04 OUTLIER 'Trans proline' 0 N--CA 1.492 1.384 0 C-N-CA 122.434 2.089 . . . . 0.0 112.111 178.963 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 98' ' ' GLN . . . . . 0.702 ' CD ' ' H72' ' A' ' 201' ' ' MYR . 0.5 OUTLIER -46.37 -28.19 1.27 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.717 -179.597 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 75.7 t -64.62 -48.94 82.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-O 120.855 0.36 . . . . 0.0 110.921 -179.954 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 94.8 mtp -69.39 -39.64 77.85 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.925 -179.83 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -61.52 -28.89 69.64 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.722 -179.319 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -59.52 -16.68 26.31 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.96 0.409 . . . . 0.0 110.225 179.777 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.583 ' O ' HG12 ' A' ' 103' ' ' VAL . 88.2 t -71.13 -2.95 3.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.562 179.439 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -59.66 -34.04 72.32 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.771 -179.932 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 105' ' ' GLN . . . . . 0.543 HE22 ' HD1' ' A' ' 45' ' ' PHE . 27.5 mt-30 -62.28 -43.18 99.41 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.819 -179.65 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 106' ' ' THR . . . . . 0.44 ' O ' ' O ' ' A' ' 103' ' ' VAL . 87.9 m -109.79 125.35 52.62 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.399 -179.965 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 107' ' ' GLU . . . . . 0.554 ' CD ' ' H ' ' A' ' 107' ' ' GLU . 30.3 mp0 -68.33 161.58 27.09 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.53 -179.406 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 108' ' ' GLU . . . . . 0.557 ' C ' ' H ' ' A' ' 110' ' ' LEU . 94.7 mt-10 -92.25 140.37 29.68 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.201 -0.454 . . . . 0.0 109.923 179.705 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 33.0 pt -60.74 3.75 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.379 179.848 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.557 ' H ' ' C ' ' A' ' 108' ' ' GLU . 85.3 mt -109.54 32.33 5.1 Favored 'General case' 0 N--CA 1.461 0.082 0 CA-C-O 121.023 0.439 . . . . 0.0 110.37 -179.899 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 111' ' ' LYS . . . . . 0.43 ' CG ' HE22 ' A' ' 115' ' ' GLN . 43.3 pttt -82.2 -115.41 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.484 179.962 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 112' ' ' SER . . . . . 0.499 ' OG ' ' N ' ' A' ' 113' ' ' ASN . 29.1 p -129.59 -132.88 0.21 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.259 179.584 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 113' ' ' ASN . . . . . 0.499 ' N ' ' OG ' ' A' ' 112' ' ' SER . 99.2 m-20 56.41 34.59 24.49 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.597 -179.802 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER 76.26 94.12 0.07 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.141 0.496 . . . . 0.0 110.623 179.962 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 115' ' ' GLN . . . . . 0.43 HE22 ' CG ' ' A' ' 111' ' ' LYS . 82.7 mt-30 -144.12 164.52 30.42 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.819 -179.967 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 8.2 m -60.8 -45.34 94.77 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.916 -0.583 . . . . 0.0 110.463 -179.494 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 117' ' ' ASP . . . . . 0.484 ' OD2' HD22 ' A' ' 110' ' ' LEU . 93.0 m-20 -73.79 171.15 13.87 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.542 179.91 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 50.6 mt -55.74 134.3 51.4 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.267 -179.346 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 94.2 mt-10 -66.5 -40.81 89.46 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.729 0.3 . . . . 0.0 110.949 -179.808 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 94.2 m-70 -115.95 146.77 41.81 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.508 -179.98 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 79.0 m80 -104.05 135.76 44.95 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.342 179.859 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 49.8 m-70 -114.78 150.47 35.36 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.636 -179.797 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 84.1 t60 -58.6 -41.83 86.73 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.457 -179.623 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 124' ' ' HIS . . . . . . . . . . . . . 76.9 t60 -119.71 123.23 43.28 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.52 179.852 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 84.0 t60 . . . . . 0 C--O 1.221 -0.444 0 CA-C-O 118.016 -0.992 . . . . 0.0 110.558 179.985 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 201' ' ' MYR . . . . . 0.777 H122 ' CE2' ' A' ' 11' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.732 0 N-CA-C 110.991 -0.844 . . . . 0.0 110.991 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 85.7 mt-30 -60.81 -27.06 67.76 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.859 0.361 . . . . 0.0 110.571 -179.937 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.674 ' OE1' ' H52' ' A' ' 201' ' ' MYR . 97.1 mt-10 -60.6 -23.6 64.83 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.611 179.823 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 37.6 tp -43.53 -32.74 0.97 Allowed 'General case' 0 C--O 1.234 0.271 0 CA-C-O 121.115 0.483 . . . . 0.0 110.362 -179.458 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 78.0 p -57.98 -37.76 74.84 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 120.662 -0.415 . . . . 0.0 110.111 179.952 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 68.5 tp60 -65.43 -32.19 73.69 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.406 179.605 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 75.3 t60 -59.73 -45.35 92.44 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.809 0.338 . . . . 0.0 110.292 -179.941 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -59.79 -46.71 88.36 Favored 'General case' 0 C--O 1.244 0.77 0 CA-C-O 121.177 0.513 . . . . 0.0 110.233 179.713 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.421 ' O ' ' CB ' ' A' ' 14' ' ' GLN . 63.6 mtp85 -64.27 -33.47 75.88 Favored 'General case' 0 C--O 1.209 -1.066 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 179.707 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.555 ' CE1' H143 ' A' ' 201' ' ' MYR . 29.8 t80 -58.78 -36.74 74.9 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.774 0.321 . . . . 0.0 110.322 -179.547 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 4.2 t -64.15 -50.28 77.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 C-N-CA 120.179 -0.608 . . . . 0.0 111.288 -179.939 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 93.7 mt-10 -80.24 -31.77 38.48 Favored 'General case' 0 C--N 1.325 -0.49 0 C-N-CA 120.485 -0.486 . . . . 0.0 111.767 -179.285 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' GLN . . . . . 0.421 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 65.1 tp60 -72.58 -53.22 12.54 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.025 -178.936 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.595 HD13 ' O ' ' A' ' 15' ' ' LEU . 0.2 OUTLIER -62.33 -45.51 92.88 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.842 -0.429 . . . . 0.0 109.842 -179.673 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.444 ' HB3' HG11 ' A' ' 26' ' ' VAL . 66.0 mttm -56.28 -34.42 66.42 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 120.49 -0.484 . . . . 0.0 109.977 179.489 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 69.7 mm-40 -72.05 -41.42 67.46 Favored 'General case' 0 C--O 1.241 0.608 0 CA-C-O 121.175 0.512 . . . . 0.0 110.521 178.551 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.544 ' O ' HG22 ' A' ' 21' ' ' THR . . . -53.64 -45.88 70.32 Favored 'General case' 0 C--O 1.223 -0.342 0 N-CA-C 109.693 -0.484 . . . . 0.0 109.693 179.902 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.449 ' O ' ' N ' ' A' ' 22' ' ' ARG . 4.5 mt -65.58 -37.11 85.72 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 120.984 0.421 . . . . 0.0 110.421 178.838 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 78.5 tttt -45.4 -37.22 4.85 Favored 'General case' 0 C--N 1.321 -0.646 0 C-N-CA 120.418 -0.513 . . . . 0.0 109.83 -179.798 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.544 HG22 ' O ' ' A' ' 18' ' ' ALA . 0.9 OUTLIER -63.14 -34.08 76.86 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.11 179.43 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.449 ' N ' ' O ' ' A' ' 19' ' ' LEU . 12.8 mmt180 -70.37 17.59 0.06 Allowed 'General case' 0 C--O 1.233 0.215 0 CA-C-O 120.801 0.334 . . . . 0.0 110.393 -179.721 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' GLY . . . . . 0.529 ' H ' ' C ' ' A' ' 21' ' ' THR . . . 83.13 13.11 77.94 Favored Glycine 0 CA--C 1.523 0.562 0 N-CA-C 110.356 -1.098 . . . . 0.0 110.356 -179.878 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.546 HG12 ' N ' ' A' ' 25' ' ' LYS . 12.7 t -89.2 167.49 1.68 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 N-CA-C 110.333 -0.247 . . . . 0.0 110.333 -179.907 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.546 ' N ' HG12 ' A' ' 24' ' ' VAL . 58.5 mttp -134.87 127.46 30.75 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.223 179.335 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.444 HG11 ' HB3' ' A' ' 16' ' ' LYS . 3.0 m -121.63 126.31 74.58 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.247 0 C-N-CA 121.018 -0.273 . . . . 0.0 110.393 -179.921 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 20.2 ttmt -110.88 159.38 17.75 Favored 'General case' 0 CA--C 1.528 0.114 0 N-CA-C 110.167 -0.308 . . . . 0.0 110.167 179.496 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 76.5 m-85 -49.67 -32.34 13.01 Favored 'General case' 0 C--O 1.237 0.44 0 CA-C-O 121.159 0.504 . . . . 0.0 110.224 179.414 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -55.21 -23.42 22.02 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.151 179.664 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.437 ' O ' ' CB ' ' A' ' 34' ' ' PHE . 87.5 m-20 -61.83 -46.77 88.03 Favored 'General case' 0 C--O 1.216 -0.66 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.758 -179.38 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.509 ' H ' HD12 ' A' ' 31' ' ' LEU . 5.4 mp -65.65 -40.76 92.83 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 121.106 0.479 . . . . 0.0 109.924 179.736 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 35.6 mt -59.2 -45.36 91.29 Favored 'General case' 0 C--N 1.314 -0.962 0 C-N-CA 119.798 -0.761 . . . . 0.0 110.962 -178.473 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.589 ' NZ ' ' CZ ' ' A' ' 37' ' ' PHE . 63.9 tttm -86.05 -50.25 7.18 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 112.064 0.394 . . . . 0.0 112.064 -179.089 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' PHE . . . . . 0.437 ' CB ' ' O ' ' A' ' 30' ' ' ASP . 51.4 t80 -60.21 -50.21 74.57 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.707 -0.678 . . . . 0.0 110.758 -178.591 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.486 ' CB ' ' O ' ' A' ' 31' ' ' LEU . 7.5 t80 -62.29 -46.84 86.96 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.354 -179.659 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 96.7 m-20 -63.03 -36.43 83.55 Favored 'General case' 0 C--N 1.344 0.329 0 CA-C-O 120.908 0.385 . . . . 0.0 111.209 -179.533 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.589 ' CZ ' ' NZ ' ' A' ' 33' ' ' LYS . 1.9 m-85 -57.33 -46.34 83.37 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.825 -179.479 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.561 ' O ' ' N ' ' A' ' 42' ' ' CYS . 23.8 m -81.78 -24.84 9.7 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 C-N-CA 120.299 -0.56 . . . . 0.0 110.395 179.694 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 45.8 tttp -58.03 -31.57 67.12 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 120.78 -0.368 . . . . 0.0 110.4 -179.208 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 65.2 t0 -52.94 -61.14 2.48 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 120.587 -0.445 . . . . 0.0 111.232 -179.548 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.409 ' C ' ' SG ' ' A' ' 42' ' ' CYS . 31.5 p -114.43 -32.03 6.05 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-O 121.141 0.496 . . . . 0.0 111.261 -179.531 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 42' ' ' CYS . . . . . 0.561 ' N ' ' O ' ' A' ' 38' ' ' VAL . 2.4 m 70.57 58.59 0.48 Allowed Pre-proline 0 C--N 1.324 -0.518 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.386 -178.698 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 43' ' ' PRO . . . . . 0.55 ' C ' ' H ' ' A' ' 45' ' ' PHE . 19.9 Cg_exo -68.08 -25.13 38.04 Favored 'Trans proline' 0 N--CA 1.495 1.591 0 C-N-CA 122.443 2.096 . . . . 0.0 112.319 179.885 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 44' ' ' TRP . . . . . 0.55 ' CD1' H132 ' A' ' 201' ' ' MYR . 0.0 OUTLIER -58.1 0.39 0.07 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.059 -179.34 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.55 ' H ' ' C ' ' A' ' 43' ' ' PRO . 0.1 OUTLIER 63.86 82.11 0.22 Allowed Pre-proline 0 C--N 1.328 -0.369 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.25 -179.987 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_endo -71.89 -9.79 25.27 Favored 'Trans proline' 0 N--CA 1.489 1.219 0 C-N-CA 122.041 1.828 . . . . 0.0 112.24 -179.55 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.605 ' O ' ' H31' ' A' ' 201' ' ' MYR . 88.1 mt-30 -81.02 -54.72 5.31 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 120.525 -0.47 . . . . 0.0 110.516 -179.81 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.738 ' O ' ' H51' ' A' ' 201' ' ' MYR . 63.2 tt0 -88.82 -26.72 21.52 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.48 178.984 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 49' ' ' GLY . . . . . 0.569 ' O ' ' H71' ' A' ' 201' ' ' MYR . . . 68.56 61.01 5.0 Favored Glycine 0 CA--C 1.52 0.404 0 N-CA-C 110.086 -1.206 . . . . 0.0 110.086 -179.363 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 13.5 t -118.34 154.19 32.76 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.7 0.286 . . . . 0.0 110.995 -179.274 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.4 mt -80.63 137.06 22.07 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-O 121.259 0.552 . . . . 0.0 110.841 179.494 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' ASP . . . . . 0.427 ' OD2' ' O ' ' A' ' 43' ' ' PRO . 79.9 m-20 -108.85 121.48 45.18 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.106 -0.952 . . . . 0.0 111.249 179.504 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.486 ' CG1' HD12 ' A' ' 90' ' ' ILE . 27.6 mm -94.81 -56.02 5.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.111 179.145 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -78.66 -50.09 12.05 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-O 121.032 0.444 . . . . 0.0 111.243 -179.609 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 78.1 mtp180 -58.88 -31.94 69.04 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.016 179.756 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 19.1 t-105 -62.41 -39.18 92.44 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.061 0.458 . . . . 0.0 110.616 178.987 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -62.44 -36.27 81.89 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.135 -179.717 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 95.5 mtt-85 -62.14 -55.32 29.94 Favored 'General case' 0 C--N 1.331 -0.224 0 C-N-CA 120.508 -0.477 . . . . 0.0 111.54 -179.655 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.488 HG13 ' N ' ' A' ' 60' ' ' GLY . 5.0 p -65.6 -43.33 94.06 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.441 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.447 179.803 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 60' ' ' GLY . . . . . 0.488 ' N ' HG13 ' A' ' 59' ' ' VAL . . . -63.67 -41.53 98.99 Favored Glycine 0 C--O 1.22 -0.729 0 N-CA-C 111.33 -0.708 . . . . 0.0 111.33 -179.455 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 76.1 m-20 -61.64 -39.93 93.08 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.82 0.31 . . . . 0.0 110.749 -179.096 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 85.3 m -60.09 -62.98 1.47 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.996 0.427 . . . . 0.0 111.002 -179.694 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 70.7 m-85 -63.35 -42.2 98.9 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.864 -179.917 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' GLN . . . . . 0.487 ' HG2' HD21 ' A' ' 68' ' ' ASN . 56.5 tt0 -57.31 -40.49 78.0 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.814 0.34 . . . . 0.0 110.776 -179.736 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -58.87 -53.75 54.87 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.986 -179.79 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 71.1 m-85 -67.47 -36.49 81.25 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.681 179.851 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 67.7 t80 -60.69 -43.62 97.52 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.61 -179.469 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' ASN . . . . . 0.487 HD21 ' HG2' ' A' ' 64' ' ' GLN . 32.8 m-20 -63.79 -41.8 97.85 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.792 -179.203 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 40.5 p -71.64 -17.59 62.25 Favored 'General case' 0 CA--C 1.514 -0.441 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.227 -179.996 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -69.11 -18.59 63.99 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.955 179.881 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 165.24 -62.73 0.23 Allowed Glycine 0 CA--C 1.53 1.019 0 C-N-CA 120.887 -0.673 . . . . 0.0 111.453 -179.237 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -41.39 100.8 0.03 OUTLIER 'Trans proline' 0 C--N 1.313 -1.311 0 C-N-CA 122.691 2.261 . . . . 0.0 112.363 -179.616 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -73.81 -41.69 61.99 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.523 179.282 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.652 ' CD ' ' H ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -95.11 -13.9 24.69 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.243 -179.878 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.447 ' O ' ' O ' ' A' ' 74' ' ' LYS . 28.9 t 58.27 130.14 0.02 OUTLIER Pre-proline 0 CA--C 1.538 0.504 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.192 -178.985 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 48.6 Cg_exo -52.51 126.47 20.92 Favored 'Trans proline' 0 N--CA 1.496 1.636 0 C-N-CA 121.405 1.403 . . . . 0.0 112.283 179.102 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.46 ' O ' ' N ' ' A' ' 80' ' ' PHE . 56.6 t -83.9 -22.57 8.17 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.333 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.848 179.254 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 28.4 p -42.08 -24.65 0.05 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.371 -179.378 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' ALA . . . . . 0.446 ' N ' ' O ' ' A' ' 77' ' ' VAL . . . -65.76 -38.46 89.14 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.862 179.691 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 80' ' ' PHE . . . . . 0.46 ' N ' ' O ' ' A' ' 77' ' ' VAL . 3.8 m-85 -57.85 -34.8 70.11 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.435 -179.6 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 35.6 t -60.77 -42.88 98.38 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.269 179.947 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 21.8 m-85 -60.38 -50.15 74.74 Favored 'General case' 0 C--O 1.223 -0.32 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.038 179.905 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' TRP . . . . . . . . . . . . . 55.1 t90 -54.43 -39.14 67.08 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.573 -179.555 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 89.6 m-20 -62.31 -47.07 85.89 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 120.649 -0.42 . . . . 0.0 111.02 -179.584 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 41.0 tp -71.79 -54.35 10.45 Favored 'General case' 0 C--O 1.219 -0.545 0 C-N-CA 120.328 -0.549 . . . . 0.0 110.574 179.86 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -56.84 -25.93 23.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.372 179.643 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 63.9 tttt -65.1 -50.62 65.4 Favored 'General case' 0 C--N 1.321 -0.653 0 C-N-CA 120.177 -0.609 . . . . 0.0 110.16 179.892 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 88' ' ' GLU . . . . . 0.437 ' OE1' ' O ' ' A' ' 88' ' ' GLU . 0.9 OUTLIER -80.78 -20.07 43.42 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.008 -179.992 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 14.2 tp -61.03 -44.33 97.57 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.629 -178.95 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.486 HD12 ' CG1' ' A' ' 53' ' ' ILE . 3.3 mt -63.99 -43.58 97.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 C-N-CA 120.12 -0.632 . . . . 0.0 109.711 -179.634 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 91' ' ' ASP . . . . . 0.429 ' O ' ' OD1' ' A' ' 91' ' ' ASP . 64.9 t0 -47.45 -34.98 7.93 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.843 -179.02 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 92' ' ' LYS . . . . . 0.429 ' O ' ' CG2' ' A' ' 95' ' ' VAL . 72.1 tttt -58.84 143.84 46.23 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.924 -179.965 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 64.5 tttm -74.26 -42.56 59.42 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.087 179.846 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 69.1 tt0 -94.24 54.96 1.95 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.02 0.438 . . . . 0.0 110.47 -178.899 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.429 ' CG2' ' O ' ' A' ' 92' ' ' LYS . 5.0 t -61.19 -74.3 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.717 -179.736 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 96' ' ' ASN . . . . . 0.498 ' N ' ' OD1' ' A' ' 96' ' ' ASN . 0.0 OUTLIER -154.04 162.84 25.83 Favored Pre-proline 0 C--N 1.328 -0.352 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.617 179.972 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 97' ' ' PRO . . . . . 0.456 ' C ' ' N ' ' A' ' 99' ' ' VAL . 14.1 Cg_endo -56.12 -11.01 5.09 Favored 'Trans proline' 0 N--CA 1.496 1.65 0 C-N-CA 122.999 2.466 . . . . 0.0 112.161 179.072 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 98' ' ' GLN . . . . . 0.454 ' OE1' ' OD1' ' A' ' 96' ' ' ASN . 5.5 pt20 -45.04 -19.59 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.614 -179.769 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 99' ' ' VAL . . . . . 0.456 ' N ' ' C ' ' A' ' 97' ' ' PRO . 82.8 t -63.68 -51.42 70.25 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 C-N-CA 120.618 -0.433 . . . . 0.0 110.871 -179.885 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 100' ' ' MET . . . . . 0.447 ' O ' HG23 ' A' ' 103' ' ' VAL . 97.3 mmm -71.59 -40.08 70.1 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.916 179.905 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 101' ' ' ALA . . . . . 0.706 ' HB1' ' H32' ' A' ' 201' ' ' MYR . . . -62.99 -21.46 66.15 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.529 -179.759 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 102' ' ' ALA . . . . . 0.448 ' HB2' ' CD ' ' A' ' 48' ' ' GLU . . . -60.62 -15.95 33.53 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.477 179.894 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.448 ' O ' ' O ' ' A' ' 106' ' ' THR . 84.2 t -64.16 -18.84 23.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 120.984 0.421 . . . . 0.0 110.155 179.586 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -63.43 -38.37 90.88 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.827 -179.953 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 55.3 tt0 -64.28 -42.08 96.59 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.919 -179.499 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 106' ' ' THR . . . . . 0.448 ' O ' ' O ' ' A' ' 103' ' ' VAL . 87.7 m -119.15 124.54 47.06 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.451 179.867 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 93.7 mt-10 -112.54 146.88 37.73 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.432 -179.895 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 108' ' ' GLU . . . . . 0.559 ' C ' ' H ' ' A' ' 110' ' ' LEU . 99.1 mt-10 -64.61 130.6 44.23 Favored 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 120.699 -0.4 . . . . 0.0 110.216 179.572 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 37.9 pt -58.0 -0.31 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.192 179.313 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.559 ' H ' ' C ' ' A' ' 108' ' ' GLU . 97.8 mt -96.23 -2.72 45.57 Favored 'General case' 0 C--O 1.233 0.185 0 C-N-CA 120.723 -0.391 . . . . 0.0 110.518 -179.725 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -111.15 128.89 56.04 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.314 179.916 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 112' ' ' SER . . . . . 0.458 ' OG ' ' N ' ' A' ' 113' ' ' ASN . 86.8 p -136.87 -120.37 0.15 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.883 -0.598 . . . . 0.0 110.33 179.942 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 113' ' ' ASN . . . . . 0.458 ' N ' ' OG ' ' A' ' 112' ' ' SER . 54.1 m-20 -63.13 -40.68 98.28 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.437 -179.889 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 45.0 t -140.53 143.66 35.51 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.466 179.85 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 27.2 mt-30 -70.68 90.52 0.77 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.535 -179.966 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 40.1 p -66.83 -34.77 78.53 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.567 179.995 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 64.9 t0 -60.83 -48.17 83.02 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.643 -179.877 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 30.4 tp -125.6 133.61 52.2 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.345 -179.961 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -104.52 130.14 52.49 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.751 0.31 . . . . 0.0 110.339 179.612 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 40.4 m80 -57.08 -41.44 78.85 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.482 -179.803 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 80.3 m80 -113.25 129.65 56.46 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.637 179.791 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 79.9 t60 -86.08 122.63 30.38 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.259 -179.988 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 99.3 m-70 -98.18 118.21 34.31 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.323 -179.982 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 124' ' ' HIS . . . . . . . . . . . . . 77.3 t60 -63.35 -43.66 97.05 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.532 -179.809 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 62.0 t-80 . . . . . 0 C--O 1.22 -0.468 0 CA-C-O 117.946 -1.026 . . . . 0.0 110.585 -179.981 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 201' ' ' MYR . . . . . 0.738 ' H51' ' O ' ' A' ' 48' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 2' ' ' GLY . . . . . 0.425 ' C ' ' N ' ' A' ' 4' ' ' GLU . . . . . . . . 0 CA--C 1.526 0.737 0 N-CA-C 111.009 -0.836 . . . . 0.0 111.009 . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 86.9 mt-30 -46.42 -19.78 0.09 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.877 0.37 . . . . 0.0 110.736 -179.965 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.504 ' HG2' ' H61' ' A' ' 201' ' ' MYR . 82.6 tt0 -54.37 -24.13 18.33 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.471 179.975 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 41.7 tp -42.26 -28.22 0.18 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.386 -179.736 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 59.7 p -59.95 -40.01 87.51 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.665 -179.88 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 90.0 mm-40 -61.72 -36.04 79.81 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.158 179.569 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 84.4 t60 -61.13 -41.25 96.38 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.361 179.657 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 79.1 tt0 -58.38 -47.36 84.1 Favored 'General case' 0 C--O 1.24 0.597 0 CA-C-O 121.327 0.584 . . . . 0.0 110.122 179.878 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.406 ' O ' ' CB ' ' A' ' 14' ' ' GLN . 61.9 mmt-85 -63.54 -34.76 78.51 Favored 'General case' 0 C--O 1.213 -0.854 0 N-CA-C 109.186 -0.672 . . . . 0.0 109.186 179.562 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.793 ' CZ ' H121 ' A' ' 201' ' ' MYR . 35.9 t80 -58.29 -37.43 75.0 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 120.222 -0.591 . . . . 0.0 110.334 -179.642 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 16.9 t -63.33 -48.5 87.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 C-N-CA 120.24 -0.584 . . . . 0.0 111.898 179.885 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -83.39 -26.92 30.0 Favored 'General case' 0 C--N 1.322 -0.617 0 C-N-CA 120.383 -0.527 . . . . 0.0 111.777 -179.125 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' GLN . . . . . 0.406 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 68.2 tp60 -77.82 -51.79 9.93 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.823 -179.181 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.6 HD13 ' O ' ' A' ' 15' ' ' LEU . 0.3 OUTLIER -62.98 -45.98 89.87 Favored 'General case' 0 CA--C 1.535 0.38 0 N-CA-C 109.839 -0.43 . . . . 0.0 109.839 179.886 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.581 ' HB3' HG11 ' A' ' 26' ' ' VAL . 96.8 mttt -58.68 -37.64 76.49 Favored 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 120.464 -0.494 . . . . 0.0 110.265 179.514 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 75.4 mt-30 -70.24 -37.35 74.95 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.619 178.644 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -56.35 -33.07 65.3 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.114 -0.494 . . . . 0.0 109.935 179.842 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.8 mt -85.63 -32.16 22.18 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.043 0.449 . . . . 0.0 110.65 178.969 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 66.0 tttm -48.84 -43.02 38.26 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.497 -178.794 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.479 ' C ' ' H ' ' A' ' 23' ' ' GLY . 0.1 OUTLIER -70.32 -25.0 63.1 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.611 179.752 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 29.1 mmt180 -74.14 19.04 0.13 Allowed 'General case' 0 N--CA 1.463 0.178 0 CA-C-O 120.812 0.339 . . . . 0.0 110.393 -179.753 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' GLY . . . . . 0.479 ' H ' ' C ' ' A' ' 21' ' ' THR . . . 87.66 17.18 58.81 Favored Glycine 0 N--CA 1.468 0.824 0 N-CA-C 111.138 -0.785 . . . . 0.0 111.138 179.957 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.642 HG12 ' N ' ' A' ' 25' ' ' LYS . 24.7 t -105.61 169.37 2.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 120.57 0.224 . . . . 0.0 110.527 179.953 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.642 ' N ' HG12 ' A' ' 24' ' ' VAL . 67.4 mttm -133.23 136.17 45.44 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.366 179.58 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.581 HG11 ' HB3' ' A' ' 16' ' ' LYS . 19.3 m -132.64 111.45 17.31 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.36 0 C-N-CA 121.148 -0.221 . . . . 0.0 110.666 -179.97 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.4 ' O ' ' N ' ' A' ' 30' ' ' ASP . 23.8 pttt -108.74 166.25 10.94 Favored 'General case' 0 CA--C 1.522 -0.122 0 N-CA-C 110.4 -0.222 . . . . 0.0 110.4 179.601 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 90.1 m-85 -46.92 -36.78 8.01 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-O 121.103 0.478 . . . . 0.0 110.019 179.719 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.44 ' HA ' HD12 ' A' ' 32' ' ' LEU . . . -56.73 -23.76 44.8 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.889 -0.596 . . . . 0.0 109.909 179.159 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.4 ' N ' ' O ' ' A' ' 27' ' ' LYS . 50.4 t0 -61.96 -49.78 74.73 Favored 'General case' 0 C--O 1.223 -0.291 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.974 -179.694 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.511 ' H ' HD12 ' A' ' 31' ' ' LEU . 5.8 mp -63.12 -41.13 99.27 Favored 'General case' 0 C--O 1.218 -0.561 0 CA-C-O 120.867 0.365 . . . . 0.0 110.336 179.965 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.44 HD12 ' HA ' ' A' ' 29' ' ' ALA . 51.2 mt -53.34 -46.07 69.36 Favored 'General case' 0 C--N 1.31 -1.109 0 C-N-CA 119.297 -0.961 . . . . 0.0 111.008 -178.985 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.495 ' O ' ' CD1' ' A' ' 37' ' ' PHE . 87.0 tttt -82.22 -53.16 6.29 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 112.151 0.426 . . . . 0.0 112.151 -179.003 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 34' ' ' PHE . . . . . 0.711 ' O ' HG22 ' A' ' 38' ' ' VAL . 10.2 m-85 -63.09 -50.44 70.53 Favored 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 120.405 -0.518 . . . . 0.0 111.52 -178.866 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.49 ' CB ' ' O ' ' A' ' 31' ' ' LEU . 22.4 t80 -58.21 -47.76 82.46 Favored 'General case' 0 C--N 1.323 -0.56 0 C-N-CA 120.752 -0.379 . . . . 0.0 110.577 -178.584 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 85.2 m-20 -71.33 -21.5 62.04 Favored 'General case' 0 C--N 1.339 0.122 0 C-N-CA 120.11 -0.636 . . . . 0.0 111.052 -179.43 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.635 ' O ' HG23 ' A' ' 41' ' ' THR . 2.7 m-85 -76.36 -63.43 1.33 Allowed 'General case' 0 C--O 1.224 -0.238 0 C-N-CA 120.508 -0.477 . . . . 0.0 111.92 -178.666 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.711 HG22 ' O ' ' A' ' 34' ' ' PHE . 0.3 OUTLIER -63.41 -38.54 82.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-O 120.927 0.394 . . . . 0.0 110.805 -179.24 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 89.0 tttt -63.03 -45.18 93.51 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.36 -179.56 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.428 ' OD1' ' N ' ' A' ' 40' ' ' ASP . 4.4 m-20 -85.06 -33.58 22.44 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 120.951 -0.299 . . . . 0.0 111.46 -179.664 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.635 HG23 ' O ' ' A' ' 37' ' ' PHE . 34.8 p -86.96 -25.83 24.14 Favored 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 120.746 -0.382 . . . . 0.0 111.255 -178.969 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 42' ' ' CYS . . . . . 0.525 ' N ' ' O ' ' A' ' 38' ' ' VAL . 1.7 m 23.15 67.46 0.36 Allowed Pre-proline 0 N--CA 1.466 0.362 0 O-C-N 123.954 0.784 . . . . 0.0 110.539 -178.378 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 16.8 Cg_exo -64.0 -43.38 15.79 Favored 'Trans proline' 0 C--N 1.306 -1.689 0 C-N-CA 121.814 1.676 . . . . 0.0 115.056 -175.914 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' TRP . . . . . 0.555 ' HE1' ' C ' ' A' ' 50' ' ' THR . 5.7 p90 -125.97 17.05 7.93 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.685 0.755 . . . . 0.0 110.128 179.89 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.64 ' CD2' ' NE2' ' A' ' 105' ' ' GLN . 4.3 t80 74.96 56.91 0.26 Allowed Pre-proline 0 C--N 1.32 -0.711 0 CA-C-N 114.786 -1.097 . . . . 0.0 111.16 -179.233 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.564 ' HD3' ' N ' ' A' ' 45' ' ' PHE . 11.3 Cg_exo -68.66 -19.83 41.29 Favored 'Trans proline' 0 N--CA 1.495 1.614 0 C-N-CA 123.018 2.479 . . . . 0.0 112.491 179.83 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 58.2 tt0 -54.24 -40.49 67.78 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.903 -179.002 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 31.6 tp10 -68.45 -32.25 72.13 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.825 -0.435 . . . . 0.0 109.825 179.637 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' GLY . . . . . 0.73 ' O ' H111 ' A' ' 201' ' ' MYR . . . 116.62 -17.93 13.45 Favored Glycine 0 CA--C 1.521 0.431 0 N-CA-C 110.448 -1.061 . . . . 0.0 110.448 -179.27 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 50' ' ' THR . . . . . 0.555 ' C ' ' HE1' ' A' ' 44' ' ' TRP . 6.2 t -56.38 159.49 3.6 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 109.284 -0.635 . . . . 0.0 109.284 179.411 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.478 ' HA ' ' NE1' ' A' ' 44' ' ' TRP . 0.7 OUTLIER -128.28 132.29 68.39 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.488 0 CA-C-O 120.743 0.306 . . . . 0.0 110.49 -179.977 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 48.3 t0 -123.18 117.69 25.94 Favored 'General case' 0 C--N 1.312 -1.039 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.9 177.88 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 25.3 mm -72.95 -43.4 59.3 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.882 -179.561 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -62.74 -55.62 24.99 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 121.241 0.543 . . . . 0.0 111.168 -178.374 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 91.2 mtt180 -64.48 -34.92 79.35 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.305 179.201 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' TRP . . . . . 0.43 ' HE1' ' HB2' ' A' ' 83' ' ' TRP . 33.6 t-105 -55.85 -37.29 68.54 Favored 'General case' 0 C--N 1.332 -0.18 0 N-CA-C 109.698 -0.482 . . . . 0.0 109.698 179.394 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.62 ' NH2' ' CH2' ' A' ' 83' ' ' TRP . 63.7 ttm-85 -67.12 -36.97 83.05 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.003 179.126 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 44.3 ttm180 -59.65 -46.22 89.68 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 120.766 -0.373 . . . . 0.0 111.427 -179.509 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 3.1 p -69.08 -36.56 74.08 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 CA-C-O 120.774 0.321 . . . . 0.0 110.436 179.266 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -67.15 -50.53 45.04 Favored Glycine 0 CA--C 1.526 0.754 0 N-CA-C 111.296 -0.722 . . . . 0.0 111.296 179.827 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -63.83 -40.65 97.11 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.624 0.25 . . . . 0.0 111.207 -179.744 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 3.1 m -58.68 -51.56 69.43 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.993 0.425 . . . . 0.0 110.694 -179.464 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' PHE . . . . . 0.494 ' CE2' ' CE2' ' A' ' 37' ' ' PHE . 14.1 m-85 -68.3 -33.79 74.97 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.362 179.386 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 72.2 tp60 -60.1 -45.25 93.58 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.639 -179.755 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 16.3 t0 -60.63 -51.85 67.64 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.025 0.441 . . . . 0.0 110.603 179.971 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 49.3 m-85 -63.71 -33.19 75.08 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.103 179.65 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 76.4 t80 -61.74 -40.43 95.06 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.105 179.703 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 98.5 m-20 -62.64 -38.11 88.97 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.065 -179.705 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 43.5 p -47.23 -32.58 4.64 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 120.458 -0.497 . . . . 0.0 110.472 -179.084 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 60.2 m-85 -67.35 -38.35 84.7 Favored 'General case' 0 C--N 1.32 -0.69 0 C-N-CA 120.211 -0.596 . . . . 0.0 111.209 179.774 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' GLY . . . . . 0.51 ' H ' ' HD3' ' A' ' 72' ' ' PRO . . . 100.68 58.24 0.85 Allowed Glycine 0 CA--C 1.528 0.866 0 N-CA-C 110.715 -0.954 . . . . 0.0 110.715 -179.37 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 72' ' ' PRO . . . . . 0.51 ' HD3' ' H ' ' A' ' 71' ' ' GLY . 66.4 Cg_endo -76.36 116.64 4.38 Favored 'Trans proline' 0 C--N 1.31 -1.454 0 C-N-CA 122.781 2.321 . . . . 0.0 111.59 -179.941 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 79.4 tt0 -85.18 -21.23 29.26 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.248 -179.8 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.743 ' CD ' ' H ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -98.44 -29.14 13.29 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.867 -0.606 . . . . 0.0 112.392 -179.765 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.511 ' O ' HG12 ' A' ' 75' ' ' VAL . 24.4 t 39.3 92.68 0.05 OUTLIER Pre-proline 0 C--N 1.331 -0.231 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.736 -178.827 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -58.07 125.52 18.81 Favored 'Trans proline' 0 C--N 1.316 -1.169 0 C-N-CA 121.113 1.209 . . . . 0.0 111.049 179.792 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.443 ' O ' ' N ' ' A' ' 80' ' ' PHE . 96.0 t -84.23 -16.24 10.82 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.618 179.452 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 36.4 p -40.68 -27.07 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.637 -178.688 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' ALA . . . . . 0.426 ' N ' ' O ' ' A' ' 77' ' ' VAL . . . -59.92 -42.47 94.0 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.031 0.443 . . . . 0.0 110.313 179.648 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 80' ' ' PHE . . . . . 0.579 ' CZ ' ' ND2' ' A' ' 84' ' ' ASN . 55.4 t80 -61.34 -41.54 97.21 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.54 179.682 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 17.9 m -58.05 -43.53 86.91 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.905 -179.215 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 6.4 m-85 -58.65 -53.63 56.16 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.916 0.389 . . . . 0.0 111.298 -179.504 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 83' ' ' TRP . . . . . 0.62 ' CH2' ' NH2' ' A' ' 57' ' ' ARG . 15.2 t90 -59.58 -38.43 81.15 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.103 179.966 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 84' ' ' ASN . . . . . 0.579 ' ND2' ' CZ ' ' A' ' 80' ' ' PHE . 3.7 m-80 -61.55 -44.46 97.0 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 120.67 -0.412 . . . . 0.0 110.796 -179.611 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.406 HD23 HD11 ' A' ' 15' ' ' LEU . 53.9 tp -71.47 -53.72 13.0 Favored 'General case' 0 C--O 1.218 -0.575 0 C-N-CA 120.343 -0.543 . . . . 0.0 110.119 179.511 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -58.9 -24.85 27.67 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 C-N-CA 120.8 -0.36 . . . . 0.0 110.883 179.763 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 70.0 tttt -67.97 -49.68 60.26 Favored 'General case' 0 C--N 1.313 -1.0 0 C-N-CA 120.351 -0.54 . . . . 0.0 110.144 179.647 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.2 pp20? -79.97 -20.57 45.23 Favored 'General case' 0 C--N 1.32 -0.682 0 C-N-CA 120.321 -0.552 . . . . 0.0 110.366 -179.883 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 14.0 tp -62.19 -44.87 95.63 Favored 'General case' 0 N--CA 1.445 -0.705 0 C-N-CA 120.338 -0.545 . . . . 0.0 109.879 179.918 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -64.16 -43.42 97.38 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.228 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.936 179.57 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 99.4 m-20 -43.74 -37.51 2.72 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.025 -178.545 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 92' ' ' LYS . . . . . 0.609 ' HB2' HG22 ' A' ' 95' ' ' VAL . 97.5 mttt -47.36 144.09 3.09 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 120.72 -0.392 . . . . 0.0 110.499 179.629 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 89.0 tttt -71.91 -49.16 40.21 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.874 0.369 . . . . 0.0 111.207 -179.662 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -108.31 54.21 0.67 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.583 -179.286 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.609 HG22 ' HB2' ' A' ' 92' ' ' LYS . 11.5 t -45.21 -73.88 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.242 -179.159 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 96' ' ' ASN . . . . . 0.548 ' ND2' HG12 ' A' ' 95' ' ' VAL . 0.0 OUTLIER -153.42 160.5 30.87 Favored Pre-proline 0 C--N 1.325 -0.496 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.598 -179.965 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -59.31 -13.35 19.79 Favored 'Trans proline' 0 C--N 1.306 -1.659 0 C-N-CA 122.672 2.248 . . . . 0.0 111.87 179.063 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 98' ' ' GLN . . . . . 0.436 ' OE1' ' O ' ' A' ' 49' ' ' GLY . 9.5 pt20 -57.06 -19.88 21.61 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.89 -179.962 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 52.0 t -61.77 -49.63 83.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.62 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 97.9 mmm -73.07 -40.85 64.69 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.817 179.769 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -61.87 -24.36 66.87 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.485 -179.794 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -59.1 -17.29 25.05 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.197 179.709 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.587 ' O ' HG12 ' A' ' 103' ' ' VAL . 97.8 t -66.74 -2.65 1.59 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.396 179.124 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -60.05 -39.52 86.26 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.678 -179.748 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 105' ' ' GLN . . . . . 0.64 ' NE2' ' CD2' ' A' ' 45' ' ' PHE . 86.6 mt-30 -73.69 105.63 5.09 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.819 0.342 . . . . 0.0 110.655 179.568 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 65.0 p -68.24 -35.09 77.39 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.584 179.916 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 85.4 mt-10 -137.13 179.4 6.41 Favored 'General case' 0 CA--C 1.52 -0.206 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.29 179.974 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 108' ' ' GLU . . . . . 0.48 ' C ' ' N ' ' A' ' 110' ' ' LEU . 95.4 mt-10 -105.62 128.55 53.7 Favored 'General case' 0 CA--C 1.513 -0.463 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.003 179.198 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 44.8 pt -50.16 -12.18 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-N 115.938 -0.574 . . . . 0.0 109.962 179.805 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.48 ' N ' ' C ' ' A' ' 108' ' ' GLU . 31.2 mt -65.51 -40.45 93.04 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.609 179.606 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 111' ' ' LYS . . . . . 0.417 ' O ' ' O ' ' A' ' 114' ' ' SER . 86.8 tttt -68.09 -19.35 64.84 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.991 179.828 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 6.3 t -57.25 -44.2 83.64 Favored 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 120.615 -0.434 . . . . 0.0 110.611 -179.263 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 60.3 m-20 -64.06 -41.51 97.34 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.88 179.939 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 114' ' ' SER . . . . . 0.417 ' O ' ' O ' ' A' ' 111' ' ' LYS . 29.6 p -157.6 167.46 30.07 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.491 -179.695 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 86.8 mt-30 -40.96 -28.99 0.09 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.846 0.355 . . . . 0.0 110.887 -179.773 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 2.8 t -166.9 176.49 6.98 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.528 -179.759 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 63.4 t0 -59.22 -45.19 91.77 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.305 -179.912 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 80.5 mt -118.81 111.96 19.1 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.171 179.755 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 95.1 mt-10 -54.0 126.43 22.52 Favored 'General case' 0 C--O 1.23 0.07 0 CA-C-O 120.872 0.367 . . . . 0.0 110.306 179.951 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 89.8 m-70 -59.21 -47.41 85.43 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.508 -179.698 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 50.0 t-80 -127.13 124.12 38.38 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.155 179.694 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 122' ' ' HIS . . . . . 0.422 ' ND1' ' O ' ' A' ' 124' ' ' HIS . 19.4 t-80 -91.93 124.76 36.29 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.348 179.97 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 5.4 m80 -58.45 -40.8 83.6 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.362 -179.818 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 124' ' ' HIS . . . . . 0.422 ' O ' ' ND1' ' A' ' 122' ' ' HIS . 97.8 m-70 -111.18 127.76 55.69 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.634 179.845 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 99.6 m-70 . . . . . 0 C--O 1.22 -0.466 0 CA-C-O 118.02 -0.991 . . . . 0.0 110.513 179.989 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 201' ' ' MYR . . . . . 0.793 H121 ' CZ ' ' A' ' 11' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 2' ' ' GLY . . . . . 0.406 ' C ' ' N ' ' A' ' 4' ' ' GLU . . . . . . . . 0 CA--C 1.526 0.765 0 N-CA-C 110.992 -0.843 . . . . 0.0 110.992 . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 85.0 mt-30 -44.15 -23.29 0.09 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.977 0.417 . . . . 0.0 110.507 -179.853 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.483 ' OE1' ' H52' ' A' ' 201' ' ' MYR . 95.0 mt-10 -53.05 -20.95 4.0 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.77 179.799 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 27.3 tp -40.85 -35.67 0.54 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.413 -178.716 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 78.1 p -54.61 -40.68 69.13 Favored 'General case' 0 C--N 1.325 -0.481 0 C-N-CA 120.432 -0.507 . . . . 0.0 110.011 179.532 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' GLN . . . . . 0.465 ' N ' ' O ' ' A' ' 4' ' ' GLU . 76.7 mt-30 -64.66 -32.31 73.92 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.612 179.735 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 63.3 t-80 -57.37 -45.32 84.56 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 121.12 0.486 . . . . 0.0 109.851 -179.925 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -61.31 -41.69 97.41 Favored 'General case' 0 C--O 1.24 0.588 0 CA-C-O 121.265 0.555 . . . . 0.0 109.625 179.498 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.463 ' O ' ' N ' ' A' ' 14' ' ' GLN . 93.8 mtt-85 -65.13 -38.8 91.78 Favored 'General case' 0 C--O 1.212 -0.904 0 C-N-CA 119.983 -0.687 . . . . 0.0 109.253 179.632 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.762 ' CE1' H143 ' A' ' 201' ' ' MYR . 0.0 OUTLIER -52.59 -40.06 62.25 Favored 'General case' 0 C--N 1.32 -0.692 0 C-N-CA 120.194 -0.603 . . . . 0.0 110.451 -179.848 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 5.6 t -62.32 -53.83 42.3 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 C-N-CA 120.154 -0.618 . . . . 0.0 111.366 -179.808 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 91.4 mt-10 -79.22 -48.13 14.73 Favored 'General case' 0 N--CA 1.466 0.356 0 C-N-CA 120.104 -0.639 . . . . 0.0 111.907 -179.258 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' GLN . . . . . 0.463 ' N ' ' O ' ' A' ' 10' ' ' ARG . 70.5 tp60 -49.34 -55.74 11.86 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.056 -179.461 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.57 HD13 ' O ' ' A' ' 15' ' ' LEU . 0.2 OUTLIER -62.02 -47.66 83.75 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.85 -0.426 . . . . 0.0 109.85 -179.629 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 92.4 mttt -55.46 -32.06 62.47 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 120.728 -0.389 . . . . 0.0 110.206 179.217 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 83.8 mt-30 -77.98 -36.58 48.78 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.512 178.967 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -56.7 -32.08 65.11 Favored 'General case' 0 C--O 1.226 -0.165 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.019 -179.907 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.463 ' O ' ' N ' ' A' ' 22' ' ' ARG . 3.5 mt -85.49 -37.42 19.72 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.248 0.547 . . . . 0.0 109.939 178.826 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 64.6 tttm -42.88 -45.62 5.01 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.447 -178.944 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.553 ' C ' ' H ' ' A' ' 23' ' ' GLY . 0.5 OUTLIER -68.39 -30.67 69.64 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.708 179.895 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.463 ' N ' ' O ' ' A' ' 19' ' ' LEU . 86.8 mmt-85 -69.81 24.06 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.634 -179.778 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' GLY . . . . . 0.553 ' H ' ' C ' ' A' ' 21' ' ' THR . . . 82.4 17.09 69.68 Favored Glycine 0 N--CA 1.468 0.83 0 N-CA-C 110.994 -0.842 . . . . 0.0 110.994 179.606 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.647 HG12 ' N ' ' A' ' 25' ' ' LYS . 26.2 t -105.5 169.03 2.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-O 120.742 0.306 . . . . 0.0 110.599 -179.93 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.647 ' N ' HG12 ' A' ' 24' ' ' VAL . 98.7 mttt -137.98 133.56 33.8 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.162 179.167 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 3.7 m -124.19 129.6 74.02 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.349 0 CA-C-O 120.558 0.218 . . . . 0.0 110.666 -179.977 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.444 ' HG2' ' H ' ' A' ' 28' ' ' TYR . 19.0 ttmt -111.35 162.12 15.36 Favored 'General case' 0 CA--C 1.529 0.136 0 N-CA-C 110.253 -0.277 . . . . 0.0 110.253 179.628 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.444 ' H ' ' HG2' ' A' ' 27' ' ' LYS . 97.7 m-85 -51.22 -30.44 17.36 Favored 'General case' 0 C--O 1.238 0.482 0 CA-C-O 121.257 0.551 . . . . 0.0 110.017 179.228 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.4 ' HA ' HD12 ' A' ' 32' ' ' LEU . . . -57.24 -23.25 46.79 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.21 179.434 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.415 ' O ' ' CB ' ' A' ' 34' ' ' PHE . 87.8 m-20 -61.0 -47.43 86.47 Favored 'General case' 0 C--O 1.22 -0.496 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.47 -179.44 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.516 ' H ' HD12 ' A' ' 31' ' ' LEU . 5.6 mp -65.68 -40.35 92.28 Favored 'General case' 0 C--O 1.216 -0.681 0 C-N-CA 120.769 -0.372 . . . . 0.0 110.277 179.373 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.4 HD12 ' HA ' ' A' ' 29' ' ' ALA . 41.5 mt -58.21 -45.39 87.74 Favored 'General case' 0 C--N 1.313 -0.99 0 C-N-CA 119.429 -0.908 . . . . 0.0 111.164 -178.381 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.589 ' NZ ' ' CZ ' ' A' ' 37' ' ' PHE . 64.8 tttm -86.0 -48.49 8.62 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 121.072 0.463 . . . . 0.0 111.802 -179.222 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 34' ' ' PHE . . . . . 0.415 ' CB ' ' O ' ' A' ' 30' ' ' ASP . 60.2 t80 -61.1 -49.01 79.03 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.844 -179.0 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.486 ' CB ' ' O ' ' A' ' 31' ' ' LEU . 13.8 t80 -63.17 -46.62 86.27 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.576 -179.639 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 99.1 m-20 -64.48 -34.39 78.09 Favored 'General case' 0 C--N 1.341 0.227 0 CA-C-O 120.862 0.363 . . . . 0.0 110.965 -179.668 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.589 ' CZ ' ' NZ ' ' A' ' 33' ' ' LYS . 1.6 m-85 -59.35 -48.02 83.23 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.114 -179.597 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.575 ' O ' ' N ' ' A' ' 42' ' ' CYS . 14.8 m -74.81 -36.35 39.39 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.68 179.878 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -55.54 -27.7 50.5 Favored 'General case' 0 C--N 1.322 -0.606 0 C-N-CA 120.733 -0.387 . . . . 0.0 110.15 -179.792 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 85.0 m-20 -54.1 -62.27 1.76 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.797 -179.719 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.44 ' C ' ' SG ' ' A' ' 42' ' ' CYS . 7.8 p -114.33 -27.37 7.62 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 120.864 0.364 . . . . 0.0 111.392 -179.801 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 42' ' ' CYS . . . . . 0.575 ' N ' ' O ' ' A' ' 38' ' ' VAL . 2.3 m 71.46 55.57 0.4 Allowed Pre-proline 0 C--N 1.326 -0.436 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.468 -179.151 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 43' ' ' PRO . . . . . 0.512 ' C ' ' H ' ' A' ' 45' ' ' PHE . 73.0 Cg_endo -77.18 -37.32 1.08 Allowed 'Trans proline' 0 N--CA 1.494 1.512 0 C-N-CA 122.753 2.302 . . . . 0.0 113.054 -179.536 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 44' ' ' TRP . . . . . 0.748 ' NE1' H141 ' A' ' 201' ' ' MYR . 0.0 OUTLIER -62.83 4.68 0.16 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.787 -179.974 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.539 ' N ' ' HD3' ' A' ' 46' ' ' PRO . 0.2 OUTLIER 55.17 53.54 9.19 Favored Pre-proline 0 CA--C 1.539 0.533 0 CA-C-O 121.49 0.662 . . . . 0.0 110.233 -178.85 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.539 ' HD3' ' N ' ' A' ' 45' ' ' PHE . 48.0 Cg_exo -52.46 -28.93 37.73 Favored 'Trans proline' 0 N--CA 1.493 1.453 0 C-N-CA 122.09 1.86 . . . . 0.0 111.84 179.327 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -70.45 -42.87 70.91 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.132 -179.44 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.592 ' O ' ' H51' ' A' ' 201' ' ' MYR . 14.1 tt0 -84.71 -15.22 45.97 Favored 'General case' 0 N--CA 1.465 0.305 0 C-N-CA 120.687 -0.405 . . . . 0.0 109.978 -179.69 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 49' ' ' GLY . . . . . 0.634 ' O ' ' H71' ' A' ' 201' ' ' MYR . . . 63.26 56.86 17.74 Favored Glycine 0 C--O 1.229 -0.181 0 N-CA-C 110.142 -1.183 . . . . 0.0 110.142 -179.947 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 50' ' ' THR . . . . . 0.743 ' O ' H132 ' A' ' 201' ' ' MYR . 6.5 t -121.11 165.88 14.72 Favored 'General case' 0 C--N 1.327 -0.397 0 O-C-N 123.586 0.227 . . . . 0.0 110.785 -179.295 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.817 HG13 HE22 ' A' ' 98' ' ' GLN . 1.1 mt -101.24 137.95 27.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 N-CA-C 109.688 -0.486 . . . . 0.0 109.688 179.522 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 52' ' ' ASP . . . . . 0.652 ' H ' ' HE1' ' A' ' 44' ' ' TRP . 20.0 m-20 -115.05 120.43 39.83 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.279 179.836 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.476 ' CG1' HD12 ' A' ' 90' ' ' ILE . 23.2 mm -94.69 -56.39 5.25 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.904 179.147 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 99.8 mttt -78.44 -48.33 15.66 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.226 -179.733 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 83.0 mtp180 -60.19 -32.92 71.54 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.091 -179.844 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' TRP . . . . . 0.525 ' CE3' ' CZ3' ' A' ' 44' ' ' TRP . 17.2 t-105 -62.16 -39.24 91.98 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-O 120.998 0.428 . . . . 0.0 110.536 179.437 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 63.5 ttm-85 -62.43 -38.11 88.47 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.325 179.849 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 61.6 ttt85 -59.69 -56.65 19.14 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 120.63 -0.428 . . . . 0.0 110.909 -179.36 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.478 HG13 ' N ' ' A' ' 60' ' ' GLY . 6.6 p -66.7 -42.79 90.09 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.552 0 CA-C-O 120.803 0.335 . . . . 0.0 111.049 -179.865 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 60' ' ' GLY . . . . . 0.478 ' N ' HG13 ' A' ' 59' ' ' VAL . . . -63.34 -46.74 92.11 Favored Glycine 0 C--O 1.222 -0.636 0 N-CA-C 111.681 -0.568 . . . . 0.0 111.681 -179.259 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 66.7 t0 -61.0 -36.89 80.66 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.574 0.226 . . . . 0.0 110.948 -179.444 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 71.3 m -61.03 -64.83 0.82 Allowed 'General case' 0 C--N 1.325 -0.468 0 C-N-CA 120.712 -0.395 . . . . 0.0 111.304 -179.674 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 73.3 m-85 -64.77 -43.58 92.79 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.334 -0.393 . . . . 0.0 111.441 -179.666 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' GLN . . . . . 0.427 ' CB ' ' O ' ' A' ' 60' ' ' GLY . 53.0 tt0 -59.45 -40.7 87.7 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.768 -179.394 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.482 ' O ' HG23 ' A' ' 69' ' ' THR . 18.9 t0 -58.09 -55.4 35.47 Favored 'General case' 0 C--N 1.323 -0.548 0 C-N-CA 120.65 -0.42 . . . . 0.0 110.853 -179.885 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 61.9 m-85 -66.27 -38.89 88.85 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 120.617 -0.433 . . . . 0.0 110.868 179.89 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.442 ' O ' ' N ' ' A' ' 71' ' ' GLY . 59.9 t80 -58.99 -42.34 89.8 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.533 -179.496 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 68' ' ' ASN . . . . . 0.411 HD21 ' HG2' ' A' ' 64' ' ' GLN . 23.5 m-20 -62.99 -42.74 99.93 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.225 -179.015 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.482 HG23 ' O ' ' A' ' 65' ' ' ASP . 10.1 p -77.33 -18.92 57.06 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 120.609 -0.436 . . . . 0.0 109.958 -179.575 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 40.5 m-85 -113.41 16.47 18.89 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.797 179.715 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' GLY . . . . . 0.442 ' N ' ' O ' ' A' ' 67' ' ' TYR . . . -154.16 -109.76 0.36 Allowed Glycine 0 CA--C 1.535 1.329 0 C-N-CA 120.594 -0.813 . . . . 0.0 111.133 -179.875 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -74.34 144.82 33.34 Favored 'Trans proline' 0 N--CA 1.492 1.386 0 C-N-CA 121.906 1.738 . . . . 0.0 113.296 -179.432 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 84.7 tt0 -85.43 -43.92 13.2 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.718 -0.673 . . . . 0.0 110.659 179.773 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.655 ' CD ' ' H ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -87.21 -18.13 31.03 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.984 -179.83 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.411 ' H ' ' HD3' ' A' ' 74' ' ' LYS . 99.6 t 57.22 114.46 0.02 OUTLIER Pre-proline 0 N--CA 1.448 -0.571 0 CA-C-N 115.846 -0.616 . . . . 0.0 111.5 -179.465 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_exo -53.23 128.8 30.59 Favored 'Trans proline' 0 N--CA 1.491 1.337 0 C-N-CA 121.312 1.342 . . . . 0.0 111.58 179.847 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.428 ' O ' HG12 ' A' ' 77' ' ' VAL . 42.5 t -82.53 -7.81 10.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.59 179.483 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 75.4 p -48.21 -23.57 0.91 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.957 0.408 . . . . 0.0 110.172 -179.916 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.72 -36.57 84.73 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.797 179.461 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 -58.33 -34.59 70.78 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.119 179.934 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 49.5 m -59.32 -40.59 86.76 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.352 179.573 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 11.8 m-85 -60.97 -49.58 76.85 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 120.793 -0.363 . . . . 0.0 111.022 179.826 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 83' ' ' TRP . . . . . 0.491 ' N ' ' CD1' ' A' ' 83' ' ' TRP . 21.9 m0 -58.6 -35.34 72.28 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.508 -179.756 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 77.5 m-20 -63.49 -46.52 85.74 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 120.618 -0.433 . . . . 0.0 110.758 179.727 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 35.1 tp -71.24 -53.32 14.77 Favored 'General case' 0 C--O 1.219 -0.501 0 C-N-CA 120.486 -0.486 . . . . 0.0 110.274 179.344 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -56.85 -27.51 26.43 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-O 120.863 0.363 . . . . 0.0 110.466 -179.988 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 34.8 tttm -65.8 -49.68 67.41 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.72 -179.599 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 88' ' ' GLU . . . . . 0.536 ' OE1' ' NZ ' ' A' ' 92' ' ' LYS . 1.1 pp20? -80.08 -20.1 45.91 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.794 -179.64 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.524 ' O ' HD13 ' A' ' 89' ' ' LEU . 0.2 OUTLIER -62.48 -45.06 94.77 Favored 'General case' 0 N--CA 1.444 -0.753 0 C-N-CA 120.263 -0.575 . . . . 0.0 110.427 -179.104 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.476 HD12 ' CG1' ' A' ' 53' ' ' ILE . 3.4 mt -64.79 -43.19 96.46 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.153 0 C-N-CA 120.504 -0.478 . . . . 0.0 109.955 -179.831 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 88.7 m-20 -44.31 -42.05 6.45 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.604 -178.487 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 92' ' ' LYS . . . . . 0.742 ' O ' HG23 ' A' ' 95' ' ' VAL . 51.2 mttp -57.14 124.96 20.58 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.025 0.441 . . . . 0.0 110.773 179.923 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -71.43 -38.28 71.37 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.436 179.187 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 93.0 mt-10 -81.72 50.25 1.48 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.915 -179.395 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.742 HG23 ' O ' ' A' ' 92' ' ' LYS . 13.1 t -80.61 162.35 3.67 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.057 179.719 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 96' ' ' ASN . . . . . 0.602 ' O ' ' N ' ' A' ' 98' ' ' GLN . 0.0 OUTLIER -40.87 166.35 0.06 OUTLIER Pre-proline 0 C--N 1.328 -0.362 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.324 179.95 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 77.3 Cg_exo -40.19 -14.05 0.03 OUTLIER 'Trans proline' 0 C--N 1.313 -1.335 0 C-N-CA 122.864 2.376 . . . . 0.0 112.695 179.327 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 98' ' ' GLN . . . . . 0.817 HE22 HG13 ' A' ' 51' ' ' ILE . 0.6 OUTLIER -46.6 -31.52 2.88 Favored 'General case' 0 C--N 1.321 -0.632 0 C-N-CA 120.742 -0.383 . . . . 0.0 110.056 179.281 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 93.9 t -61.53 -49.89 82.57 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 C-N-CA 120.382 -0.527 . . . . 0.0 110.63 -178.942 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 63.6 ttp -82.22 -43.7 17.3 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.966 179.6 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -61.06 -26.02 67.34 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.722 -179.599 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 102' ' ' ALA . . . . . 0.581 ' HB2' ' O ' ' A' ' 98' ' ' GLN . . . -63.47 -16.09 59.63 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.91 0.385 . . . . 0.0 110.399 179.981 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 54.4 t -63.12 -42.61 97.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.493 179.706 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 104' ' ' ALA . . . . . 0.45 ' O ' ' N ' ' A' ' 106' ' ' THR . . . -46.14 -29.66 1.62 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.551 -179.712 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 92.5 mm-40 40.4 -95.3 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.716 179.835 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 106' ' ' THR . . . . . 0.45 ' N ' ' O ' ' A' ' 104' ' ' ALA . 30.7 p -131.34 160.02 36.22 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.325 -179.982 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -99.43 147.0 25.72 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.538 -179.846 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 108' ' ' GLU . . . . . 0.427 ' C ' ' N ' ' A' ' 110' ' ' LEU . 79.6 mm-40 -79.57 129.69 34.7 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.15 -0.477 . . . . 0.0 109.978 179.499 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 109' ' ' ILE . . . . . 0.442 ' O ' ' OG ' ' A' ' 112' ' ' SER . 39.1 pt -54.29 -12.1 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 115.922 -0.581 . . . . 0.0 109.846 -179.887 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.427 ' N ' ' C ' ' A' ' 108' ' ' GLU . 79.1 mt -73.47 -39.08 65.19 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.429 179.278 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -65.64 -33.73 76.56 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.424 -179.884 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 112' ' ' SER . . . . . 0.442 ' OG ' ' O ' ' A' ' 109' ' ' ILE . 94.0 p -59.74 -44.5 93.76 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.968 -179.304 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 40.6 t30 -64.77 -41.74 95.64 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.192 179.944 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 17.1 p -167.81 157.24 9.92 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.514 179.498 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 34.0 mt-30 -99.75 10.34 41.49 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.835 0.35 . . . . 0.0 110.495 179.764 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 43.7 p -65.02 -36.75 85.39 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.471 -179.901 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 91.0 m-20 -62.8 -42.97 99.94 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.528 179.962 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 97.8 mt -129.21 62.26 1.52 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.317 179.763 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 79.6 tt0 -71.71 145.12 49.03 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.313 179.99 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 93.3 m-70 -58.54 -43.91 89.42 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.625 -179.836 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 93.9 m-70 -106.84 104.67 14.41 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.675 179.878 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 72.4 m80 -73.01 -40.67 64.99 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.74 179.88 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 48.2 t-80 -77.05 143.32 39.38 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.601 -179.877 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 124' ' ' HIS . . . . . . . . . . . . . 97.0 m-70 -111.01 136.82 49.44 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.433 -179.762 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 81.6 t60 . . . . . 0 C--O 1.22 -0.483 0 CA-C-O 118.054 -0.974 . . . . 0.0 110.626 179.895 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 201' ' ' MYR . . . . . 0.762 H143 ' CE1' ' A' ' 11' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.743 0 N-CA-C 111.2 -0.76 . . . . 0.0 111.2 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 97.2 mm-40 -60.01 -21.58 61.49 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.911 0.386 . . . . 0.0 110.315 -179.87 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 82.8 tt0 -56.23 -22.62 30.68 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.468 179.705 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 34.2 tp -41.63 -28.54 0.14 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.373 -179.681 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 78.2 p -57.73 -36.97 72.76 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 120.662 -0.415 . . . . 0.0 110.112 -179.762 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 88.0 mt-30 -64.28 -33.04 74.92 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.573 179.431 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 58.5 t-80 -61.85 -45.62 92.99 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.596 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 98.1 mt-10 -59.84 -44.84 93.88 Favored 'General case' 0 C--O 1.243 0.718 0 CA-C-O 121.243 0.544 . . . . 0.0 110.111 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 77.9 mmt-85 -62.27 -33.47 74.69 Favored 'General case' 0 C--O 1.214 -0.813 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 179.235 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.615 ' CE1' HD23 ' A' ' 15' ' ' LEU . 40.7 t80 -59.96 -37.29 79.14 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 120.548 -0.461 . . . . 0.0 110.353 -179.762 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 3.4 t -61.62 -48.28 89.45 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 C-N-CA 119.75 -0.78 . . . . 0.0 110.888 179.885 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 98.4 mt-10 -82.02 -46.85 13.38 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 120.038 -0.665 . . . . 0.0 111.66 -179.554 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 71.2 tp60 -58.3 -51.38 70.04 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.89 -0.595 . . . . 0.0 111.201 -179.131 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.647 HD13 ' O ' ' A' ' 15' ' ' LEU . 0.4 OUTLIER -63.48 -46.12 87.65 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-O 120.991 0.424 . . . . 0.0 109.933 179.875 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.544 ' HB3' HG11 ' A' ' 26' ' ' VAL . 91.8 mttt -58.32 -35.54 72.02 Favored 'General case' 0 C--N 1.329 -0.284 0 O-C-N 121.962 -0.461 . . . . 0.0 110.478 179.359 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 93.2 mt-30 -71.91 -36.25 69.94 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.369 178.967 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.16 -38.68 80.31 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.087 179.87 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.5 mt -79.88 -28.01 39.96 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.965 0.412 . . . . 0.0 110.581 179.293 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 65.1 tttm -55.29 -39.81 70.31 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.243 -179.337 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . 0.434 HG23 HH11 ' A' ' 22' ' ' ARG . 1.5 t -74.13 -18.18 60.83 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.877 -179.821 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.434 HH11 HG23 ' A' ' 21' ' ' THR . 62.8 mmt-85 -77.22 -0.19 24.28 Favored 'General case' 0 C--N 1.331 -0.2 0 C-N-CA 120.672 -0.411 . . . . 0.0 110.202 179.544 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 106.67 13.57 21.84 Favored Glycine 0 N--CA 1.466 0.7 0 N-CA-C 110.884 -0.886 . . . . 0.0 110.884 -179.554 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.589 HG12 ' N ' ' A' ' 25' ' ' LYS . 17.9 t -100.86 168.74 1.83 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 N-CA-C 110.441 -0.207 . . . . 0.0 110.441 -179.838 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.589 ' N ' HG12 ' A' ' 24' ' ' VAL . 68.6 mttm -125.54 137.9 53.95 Favored 'General case' 0 C--O 1.233 0.209 0 N-CA-C 110.175 -0.306 . . . . 0.0 110.175 179.591 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.544 HG11 ' HB3' ' A' ' 16' ' ' LYS . 3.2 m -135.63 107.12 6.9 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.374 0 CA-C-O 120.761 0.315 . . . . 0.0 110.801 -179.651 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 27.8 pttt -108.55 165.83 11.23 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-O 120.75 0.309 . . . . 0.0 110.527 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.605 ' CE2' HD11 ' A' ' 32' ' ' LEU . 81.6 t80 -47.97 -38.52 17.02 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-O 121.04 0.447 . . . . 0.0 109.884 179.442 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.444 ' HA ' HD12 ' A' ' 32' ' ' LEU . . . -56.98 -23.08 43.26 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.021 -0.536 . . . . 0.0 109.984 179.041 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 58.2 t0 -62.26 -44.36 96.72 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.559 -179.594 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.518 ' O ' ' CB ' ' A' ' 35' ' ' PHE . 5.6 mp -67.47 -41.29 84.87 Favored 'General case' 0 C--O 1.213 -0.828 0 CA-C-O 121.164 0.507 . . . . 0.0 109.694 179.184 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.605 HD11 ' CE2' ' A' ' 28' ' ' TYR . 49.4 mt -56.97 -44.57 82.77 Favored 'General case' 0 C--N 1.313 -0.987 0 C-N-CA 119.715 -0.794 . . . . 0.0 111.26 -178.605 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -84.31 -50.86 7.45 Favored 'General case' 0 C--N 1.32 -0.702 0 C-N-CA 120.666 -0.413 . . . . 0.0 111.617 -179.013 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . 0.794 ' O ' HG22 ' A' ' 38' ' ' VAL . 59.7 t80 -63.48 -48.27 78.35 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.47 -178.916 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.518 ' CB ' ' O ' ' A' ' 31' ' ' LEU . 17.4 t80 -61.97 -44.47 96.68 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 110.009 -0.367 . . . . 0.0 110.009 -179.442 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 92.4 m-20 -70.39 -37.96 74.6 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 120.717 -0.393 . . . . 0.0 111.683 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.472 ' CE2' ' CE2' ' A' ' 63' ' ' PHE . 2.7 m-85 -62.34 -50.46 71.52 Favored 'General case' 0 N--CA 1.464 0.253 0 N-CA-C 112.116 0.413 . . . . 0.0 112.116 -178.629 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.794 HG22 ' O ' ' A' ' 34' ' ' PHE . 13.9 m -68.17 -42.58 84.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 C-N-CA 120.541 -0.463 . . . . 0.0 110.493 -179.599 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 43.3 mmtt -64.24 -28.5 69.77 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.069 179.872 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 67.3 t0 -54.2 -49.24 69.84 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 120.725 -0.39 . . . . 0.0 110.542 -179.309 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.465 ' O ' ' SG ' ' A' ' 42' ' ' CYS . 12.1 p -113.38 -2.77 13.89 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.026 179.766 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . 0.533 ' N ' ' O ' ' A' ' 38' ' ' VAL . 29.8 p 37.72 57.6 4.48 Favored Pre-proline 0 N--CA 1.465 0.3 0 CA-C-N 116.484 -0.325 . . . . 0.0 110.553 -179.223 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 69.7 Cg_endo -76.54 -33.23 3.26 Favored 'Trans proline' 0 C--N 1.31 -1.461 0 C-N-CA 122.538 2.159 . . . . 0.0 112.806 -179.062 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . 0.639 ' HE1' ' H ' ' A' ' 52' ' ' ASP . 0.0 OUTLIER -75.94 2.36 12.78 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.711 -179.775 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.489 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 16.7 m-85 50.14 51.41 10.64 Favored Pre-proline 0 C--N 1.327 -0.397 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.02 -179.786 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.489 ' CD ' ' N ' ' A' ' 45' ' ' PHE . 10.1 Cg_endo -51.14 -7.24 0.14 Allowed 'Trans proline' 0 C--N 1.308 -1.587 0 C-N-CA 122.805 2.337 . . . . 0.0 111.973 -179.783 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.47 ' H ' ' C ' ' A' ' 45' ' ' PHE . 99.5 mm-40 -62.21 -52.8 62.31 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.627 -179.576 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 55.1 tt0 -88.3 -12.86 42.31 Favored 'General case' 0 N--CA 1.466 0.326 0 C-N-CA 120.569 -0.452 . . . . 0.0 110.387 179.713 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 71.73 69.05 1.46 Allowed Glycine 0 CA--C 1.524 0.651 0 N-CA-C 110.486 -1.045 . . . . 0.0 110.486 -179.504 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 3.0 t -136.39 161.31 36.16 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.712 0.291 . . . . 0.0 110.945 -179.249 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.1 mt -99.92 139.75 20.75 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.248 0 CA-C-O 120.98 0.419 . . . . 0.0 110.29 179.428 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . 0.639 ' H ' ' HE1' ' A' ' 44' ' ' TRP . 4.9 t70 -125.44 120.83 32.08 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.588 -0.733 . . . . 0.0 109.648 179.405 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 20.1 mm -88.04 -44.74 15.87 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.834 -179.26 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 65.4 tttm -66.92 -51.45 55.15 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-O 121.077 0.465 . . . . 0.0 111.618 -179.718 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 79.3 mmt-85 -62.09 -32.52 73.08 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.807 -0.442 . . . . 0.0 109.807 -179.665 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' TRP . . . . . 0.594 ' CE3' ' CH2' ' A' ' 44' ' ' TRP . 29.9 t-105 -57.59 -39.72 77.42 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 120.564 -0.454 . . . . 0.0 110.097 -179.897 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -65.22 -37.81 88.44 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.981 -0.554 . . . . 0.0 109.944 179.544 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 68.6 ttt180 -61.24 -53.35 58.02 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 120.67 -0.412 . . . . 0.0 111.144 -179.723 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.432 HG13 ' N ' ' A' ' 60' ' ' GLY . 3.5 p -64.46 -43.87 96.97 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.507 0 CA-C-O 120.721 0.296 . . . . 0.0 110.274 179.695 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . 0.432 ' N ' HG13 ' A' ' 59' ' ' VAL . . . -62.65 -40.4 99.12 Favored Glycine 0 CA--C 1.524 0.645 0 N-CA-C 111.047 -0.821 . . . . 0.0 111.047 179.741 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . 0.43 ' O ' ' OD1' ' A' ' 61' ' ' ASP . 67.9 t0 -64.17 -37.8 88.76 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.742 0.306 . . . . 0.0 110.929 -179.688 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 67.5 m -60.55 -53.08 61.77 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.911 -179.367 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . 0.472 ' CE2' ' CE2' ' A' ' 37' ' ' PHE . 44.3 m-85 -68.97 -37.03 78.55 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.725 179.457 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 69.5 tp60 -59.71 -43.34 94.16 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.867 0.365 . . . . 0.0 110.358 -179.805 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 18.4 t0 -60.56 -50.77 72.21 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.568 179.707 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' TYR . . . . . 0.465 ' O ' ' OG1' ' A' ' 69' ' ' THR . 70.9 t80 -66.36 -26.16 67.14 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.113 179.749 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 59.2 t80 -73.36 -42.08 62.65 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.612 179.882 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . 0.473 ' O ' ' N ' ' A' ' 71' ' ' GLY . 94.0 m-20 -63.35 -37.1 85.97 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.025 -179.14 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.465 ' OG1' ' O ' ' A' ' 66' ' ' TYR . 40.5 p -48.35 -17.08 0.12 Allowed 'General case' 0 N--CA 1.464 0.256 0 C-N-CA 120.786 -0.366 . . . . 0.0 110.664 -179.593 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . 0.418 ' N ' ' C ' ' A' ' 68' ' ' ASN . 90.3 m-85 -95.59 15.47 19.77 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 120.806 -0.358 . . . . 0.0 111.047 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . 0.473 ' N ' ' O ' ' A' ' 68' ' ' ASN . . . 38.0 59.18 1.46 Allowed Glycine 0 N--CA 1.471 1.018 0 N-CA-C 110.976 -0.85 . . . . 0.0 110.976 -179.451 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . 0.5 ' O ' HG23 ' A' ' 75' ' ' VAL . 69.4 Cg_endo -80.62 125.42 5.57 Favored 'Trans proline' 0 C--N 1.309 -1.5 0 C-N-CA 122.431 2.087 . . . . 0.0 112.223 -179.962 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 77.5 mm-40 -85.73 -39.2 17.43 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.885 179.771 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.724 ' CD ' ' H ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -62.58 -41.29 98.84 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.424 -0.807 . . . . 0.0 111.646 -179.752 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.516 ' O ' HG12 ' A' ' 75' ' ' VAL . 29.0 t 31.77 93.05 0.05 OUTLIER Pre-proline 0 N--CA 1.463 0.212 0 O-C-N 123.296 0.373 . . . . 0.0 111.194 179.633 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 34.6 Cg_exo -55.63 125.62 19.73 Favored 'Trans proline' 0 C--N 1.311 -1.441 0 C-N-CA 121.442 1.428 . . . . 0.0 111.645 -179.073 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.448 ' O ' ' N ' ' A' ' 80' ' ' PHE . 60.5 t -82.8 -19.61 10.09 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.452 179.576 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . 0.416 ' H ' HG23 ' A' ' 78' ' ' THR . 10.3 p -41.56 -28.26 0.12 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.328 -179.187 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . 0.407 ' N ' ' C ' ' A' ' 77' ' ' VAL . . . -59.78 -41.48 91.22 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.371 179.724 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . 0.448 ' N ' ' O ' ' A' ' 77' ' ' VAL . 3.2 m-85 -63.21 -40.27 97.01 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.672 179.701 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 43.5 m -59.1 -42.12 89.75 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.866 -179.77 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 5.6 m-85 -60.05 -51.23 70.55 Favored 'General case' 0 C--N 1.331 -0.22 0 C-N-CA 120.813 -0.355 . . . . 0.0 110.74 -179.736 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' TRP . . . . . . . . . . . . . 32.9 t90 -58.48 -38.52 77.78 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.536 179.565 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 92.8 m-20 -61.51 -44.18 97.52 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 120.652 -0.419 . . . . 0.0 110.529 -179.475 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.405 HD11 HD23 ' A' ' 89' ' ' LEU . 23.7 tp -72.98 -56.06 5.68 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 120.328 -0.549 . . . . 0.0 110.242 179.403 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -54.88 -25.56 15.85 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 CA-C-O 120.9 0.381 . . . . 0.0 110.364 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 64.4 tttt -67.19 -50.64 60.21 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.576 179.83 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . 0.442 ' OE1' ' O ' ' A' ' 88' ' ' GLU . 1.0 OUTLIER -80.42 -19.89 45.15 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.917 -179.473 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.532 ' O ' HD13 ' A' ' 89' ' ' LEU . 0.2 OUTLIER -62.31 -44.82 95.63 Favored 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 120.549 -0.461 . . . . 0.0 110.327 -179.346 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 3.4 mt -64.28 -43.27 97.18 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 C-N-CA 120.007 -0.677 . . . . 0.0 109.991 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -47.94 -40.24 21.57 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.405 -0.362 . . . . 0.0 110.445 -179.09 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 43.1 mttm -60.02 136.29 57.97 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.991 0.424 . . . . 0.0 110.841 179.821 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -90.27 -8.96 49.63 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.192 -179.811 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 42.2 tp10 -66.45 -31.62 72.49 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.894 -0.593 . . . . 0.0 110.442 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.408 HG23 ' H ' ' A' ' 95' ' ' VAL . 21.2 t -41.7 135.48 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.298 -0.41 . . . . 0.0 109.902 -179.66 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' ASN . . . . . 0.491 ' O ' ' N ' ' A' ' 98' ' ' GLN . 0.9 OUTLIER -40.48 157.22 0.17 Allowed Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.07 -178.833 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 40.9 Cg_exo -45.62 -13.0 0.07 OUTLIER 'Trans proline' 0 N--CA 1.492 1.414 0 C-N-CA 122.432 2.088 . . . . 0.0 112.209 179.23 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . 0.491 ' N ' ' O ' ' A' ' 96' ' ' ASN . 1.9 pt20 . . . . . 0 C--N 1.322 -0.601 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.742 -179.436 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 98.7 m . . . . . 0 C--O 1.231 0.095 0 CA-C-O 120.805 0.336 . . . . 0.0 110.577 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 67.3 mm-40 -66.27 -163.38 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.139 -179.908 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' GLU . . . . . 0.483 ' C ' ' N ' ' A' ' 110' ' ' LEU . 97.4 mt-10 -106.73 129.12 54.66 Favored 'General case' 0 CA--C 1.516 -0.346 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.009 179.073 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 38.9 pt -50.42 -11.84 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-N 116.075 -0.511 . . . . 0.0 109.928 179.645 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.483 ' N ' ' C ' ' A' ' 108' ' ' GLU . 26.3 mt -64.41 -40.59 96.07 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.577 179.649 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -94.6 87.18 5.01 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.956 -179.895 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 50.2 m -63.24 -41.63 99.11 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.679 179.441 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 96.3 m-20 -137.18 -166.26 1.89 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.644 -179.565 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 77.8 p -64.02 -17.27 63.17 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.441 -179.832 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 84.4 mt-30 -56.13 -165.98 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.375 -179.915 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 77.0 p -83.34 -171.73 3.74 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.53 179.872 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 117' ' ' ASP . . . . . 0.424 ' N ' ' OD1' ' A' ' 117' ' ' ASP . 33.9 p-10 . . . . . 0 C--N 1.328 -0.327 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.763 -179.894 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.67 0 N-CA-C 110.972 -0.851 . . . . 0.0 110.972 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 99.4 mt-30 -64.97 -38.74 91.95 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.856 0.36 . . . . 0.0 110.601 179.857 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . 0.532 ' OE2' ' ND2' ' A' ' 96' ' ' ASN . 83.7 tt0 -52.88 -22.88 6.03 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.523 179.995 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 40.0 tp -42.12 -31.42 0.37 Allowed 'General case' 0 C--O 1.237 0.426 0 CA-C-O 121.016 0.436 . . . . 0.0 110.349 -179.625 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 70.4 m -56.34 -36.74 69.1 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.112 -0.495 . . . . 0.0 109.954 179.743 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . 0.456 ' HA ' ' HE ' ' A' ' 10' ' ' ARG . 57.6 tt0 -63.38 -34.82 78.56 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.586 179.537 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 73.6 t60 -60.29 -46.08 91.1 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.813 0.34 . . . . 0.0 110.277 -179.672 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 77.1 tt0 -61.17 -48.77 80.01 Favored 'General case' 0 C--O 1.244 0.804 0 CA-C-O 121.391 0.615 . . . . 0.0 110.288 179.552 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.456 ' HE ' ' HA ' ' A' ' 7' ' ' GLN . 85.9 mtm180 -62.47 -32.6 73.52 Favored 'General case' 0 C--O 1.213 -0.844 0 N-CA-C 108.624 -0.88 . . . . 0.0 108.624 179.462 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.433 ' CE1' HD23 ' A' ' 15' ' ' LEU . 26.4 t80 -58.68 -37.17 75.46 Favored 'General case' 0 C--N 1.324 -0.51 0 C-N-CA 120.41 -0.516 . . . . 0.0 110.186 -179.839 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 2.3 t -61.26 -50.69 79.41 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 C-N-CA 119.601 -0.84 . . . . 0.0 110.658 179.904 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 78.1 tt0 -81.66 -46.92 13.66 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 119.989 -0.684 . . . . 0.0 112.108 -179.215 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 66.4 tp60 -57.61 -52.47 65.28 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.428 -179.018 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.603 HD13 ' O ' ' A' ' 15' ' ' LEU . 0.3 OUTLIER -63.31 -45.64 90.42 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 109.619 -0.512 . . . . 0.0 109.619 -179.693 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.535 ' HB3' HG11 ' A' ' 26' ' ' VAL . 87.7 mttt -57.25 -35.2 69.43 Favored 'General case' 0 C--N 1.332 -0.182 0 C-N-CA 120.511 -0.475 . . . . 0.0 110.365 179.36 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 81.6 mm-40 -71.07 -41.89 70.11 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.071 0.462 . . . . 0.0 110.616 178.988 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.567 ' O ' HG22 ' A' ' 21' ' ' THR . . . -54.21 -45.64 72.26 Favored 'General case' 0 C--O 1.223 -0.294 0 CA-C-N 116.02 -0.536 . . . . 0.0 109.641 179.931 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.444 ' O ' ' N ' ' A' ' 22' ' ' ARG . 4.7 mt -68.03 -35.23 77.92 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.888 0.375 . . . . 0.0 110.851 178.849 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 56.1 tttm -47.37 -37.57 11.45 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 -179.424 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . 0.567 HG22 ' O ' ' A' ' 18' ' ' ALA . 0.7 OUTLIER -64.56 -31.55 72.82 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.947 -0.569 . . . . 0.0 111.149 179.019 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.444 ' N ' ' O ' ' A' ' 19' ' ' LEU . 30.9 mmt-85 -73.16 21.3 0.08 Allowed 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 120.921 0.391 . . . . 0.0 110.761 -179.615 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . 0.484 ' H ' ' C ' ' A' ' 21' ' ' THR . . . 81.58 13.24 80.51 Favored Glycine 0 N--CA 1.466 0.652 0 N-CA-C 110.487 -1.045 . . . . 0.0 110.487 179.972 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.464 HG12 ' N ' ' A' ' 25' ' ' LYS . 4.3 t -92.12 167.33 1.66 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 N-CA-C 110.082 -0.34 . . . . 0.0 110.082 179.959 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.464 ' N ' HG12 ' A' ' 24' ' ' VAL . 99.1 mttt -129.52 134.49 47.8 Favored 'General case' 0 N--CA 1.455 -0.219 0 N-CA-C 110.149 -0.315 . . . . 0.0 110.149 179.64 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.535 HG11 ' HB3' ' A' ' 16' ' ' LYS . 2.6 m -132.03 105.7 10.04 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.371 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.141 179.927 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.455 ' O ' ' OD1' ' A' ' 30' ' ' ASP . 11.6 ttmt -107.99 162.08 14.35 Favored 'General case' 0 C--O 1.224 -0.276 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 179.822 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.439 ' H ' ' HG2' ' A' ' 27' ' ' LYS . 93.6 m-85 -38.83 -33.33 0.11 Allowed 'General case' 0 C--O 1.235 0.334 0 CA-C-O 121.118 0.485 . . . . 0.0 110.823 179.837 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.532 ' HA ' HD12 ' A' ' 32' ' ' LEU . . . -52.62 -23.13 5.93 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.196 179.836 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.488 ' CG ' ' N ' ' A' ' 31' ' ' LEU . 21.6 p-10 -59.03 -54.19 49.87 Favored 'General case' 0 C--O 1.217 -0.646 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.763 -179.33 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.488 ' N ' ' CG ' ' A' ' 30' ' ' ASP . 0.5 OUTLIER -63.49 -40.07 96.12 Favored 'General case' 0 C--O 1.217 -0.619 0 C-N-CA 120.439 -0.504 . . . . 0.0 109.814 -179.724 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.532 HD12 ' HA ' ' A' ' 29' ' ' ALA . 45.7 mt -56.74 -50.21 72.93 Favored 'General case' 0 C--N 1.314 -0.959 0 C-N-CA 119.267 -0.973 . . . . 0.0 111.021 -178.76 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.415 ' O ' ' N ' ' A' ' 37' ' ' PHE . 88.1 tttt -85.54 -52.77 5.61 Favored 'General case' 0 C--N 1.32 -0.68 0 C-N-CA 120.317 -0.553 . . . . 0.0 112.031 -179.295 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . 0.462 ' CB ' ' O ' ' A' ' 30' ' ' ASP . 45.1 t80 -55.2 -47.8 74.76 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.027 -178.121 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.47 ' CB ' ' O ' ' A' ' 31' ' ' LEU . 14.7 t80 -61.2 -46.62 89.69 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 120.083 -0.647 . . . . 0.0 109.513 -179.794 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 98.1 m-20 -71.22 -23.65 62.05 Favored 'General case' 0 C--N 1.345 0.401 0 C-N-CA 120.511 -0.476 . . . . 0.0 111.404 179.949 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.415 ' N ' ' O ' ' A' ' 33' ' ' LYS . 7.5 t80 -61.28 -48.06 83.14 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.849 0.357 . . . . 0.0 110.403 -178.934 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.555 ' O ' ' N ' ' A' ' 42' ' ' CYS . 6.6 m -77.85 -30.68 16.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.387 179.343 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -55.96 -30.1 61.21 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.44 -0.504 . . . . 0.0 110.545 -179.41 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 65.0 t0 -55.37 -63.97 0.99 Allowed 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 120.699 -0.4 . . . . 0.0 111.805 -179.208 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.428 ' C ' ' SG ' ' A' ' 42' ' ' CYS . 17.0 p -116.27 -19.77 10.06 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-O 120.98 0.419 . . . . 0.0 111.481 -179.559 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . 0.555 ' N ' ' O ' ' A' ' 38' ' ' VAL . 1.7 m 65.84 58.48 1.14 Allowed Pre-proline 0 CA--C 1.537 0.443 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.625 -178.461 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . 0.51 ' HD3' ' N ' ' A' ' 42' ' ' CYS . 11.8 Cg_exo -70.23 -37.35 8.17 Favored 'Trans proline' 0 N--CA 1.498 1.783 0 C-N-CA 122.891 2.394 . . . . 0.0 112.889 -179.409 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . 0.762 ' HE1' ' H ' ' A' ' 52' ' ' ASP . 0.0 OUTLIER -75.91 15.29 0.55 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.455 -179.387 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.439 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 62.1 m-85 41.57 53.65 7.47 Favored Pre-proline 0 C--N 1.332 -0.188 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.027 -179.879 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.439 ' CD ' ' N ' ' A' ' 45' ' ' PHE . 9.8 Cg_endo -52.39 -9.62 0.61 Allowed 'Trans proline' 0 C--N 1.308 -1.569 0 C-N-CA 122.803 2.335 . . . . 0.0 112.077 -179.883 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 98.3 mm-40 -64.99 -52.81 54.11 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.255 179.729 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 46.7 tp10 -87.02 -51.26 6.12 Favored 'General case' 0 N--CA 1.466 0.357 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 178.983 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 108.25 77.89 1.05 Allowed Glycine 0 CA--C 1.526 0.719 0 N-CA-C 109.619 -1.392 . . . . 0.0 109.619 -178.714 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 13.0 t -134.49 170.87 15.12 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 110.179 -0.304 . . . . 0.0 110.179 -179.106 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.1 mt -101.95 137.63 29.08 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.283 0 CA-C-O 121.027 0.441 . . . . 0.0 109.952 178.977 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . 0.762 ' H ' ' HE1' ' A' ' 44' ' ' TRP . 11.7 m-20 -117.15 121.21 40.64 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.646 -0.706 . . . . 0.0 111.377 179.807 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.497 ' CG1' HD12 ' A' ' 90' ' ' ILE . 22.9 mm -94.86 -56.14 5.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.756 179.045 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 67.7 mttm -75.86 -48.37 21.73 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-O 121.105 0.479 . . . . 0.0 111.364 -179.856 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 74.6 mtp85 -60.27 -32.46 71.2 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.253 179.898 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' TRP . . . . . 0.454 ' CE3' ' CZ3' ' A' ' 44' ' ' TRP . 22.8 t-105 -59.8 -38.8 82.94 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.133 178.727 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 85.7 mtp180 -65.22 -36.18 83.35 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 120.51 -0.476 . . . . 0.0 110.406 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 94.5 mtt180 -59.82 -50.15 74.94 Favored 'General case' 0 N--CA 1.466 0.359 0 C-N-CA 120.25 -0.58 . . . . 0.0 111.579 -179.175 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 3.2 p -64.4 -43.74 97.05 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.508 0 CA-C-O 120.809 0.337 . . . . 0.0 110.141 179.717 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -64.0 -35.51 92.09 Favored Glycine 0 CA--C 1.524 0.65 0 N-CA-C 111.072 -0.811 . . . . 0.0 111.072 179.611 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 97.3 m-20 -63.6 -36.53 84.1 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.659 0.266 . . . . 0.0 110.802 -179.694 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 63.4 m -65.58 -56.21 13.5 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 120.845 -0.342 . . . . 0.0 110.945 -179.713 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 59.4 m-85 -65.51 -37.22 86.14 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.721 179.819 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 55.8 tt0 -63.1 -40.14 96.76 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.675 -179.719 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.592 ' O ' HG23 ' A' ' 69' ' ' THR . 37.7 t0 -59.75 -51.03 71.53 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.449 -179.959 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' TYR . . . . . 0.469 ' O ' ' OG1' ' A' ' 69' ' ' THR . 53.8 m-85 -69.08 -33.13 73.06 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.681 179.585 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 56.2 t80 -66.69 -44.09 82.7 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.983 0.42 . . . . 0.0 110.415 -179.641 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 94.1 m-20 -64.2 -39.09 93.26 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.425 -179.237 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.592 HG23 ' O ' ' A' ' 65' ' ' ASP . 44.8 p -48.24 -28.53 3.11 Favored 'General case' 0 CA--C 1.516 -0.342 0 C-N-CA 120.766 -0.374 . . . . 0.0 110.676 -179.125 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 67.5 m-85 -69.77 -35.82 75.24 Favored 'General case' 0 C--N 1.32 -0.686 0 C-N-CA 120.283 -0.567 . . . . 0.0 111.31 179.263 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . 0.51 ' N ' ' CD ' ' A' ' 72' ' ' PRO . . . 90.65 46.4 4.0 Favored Glycine 0 CA--C 1.533 1.185 0 N-CA-C 110.64 -0.984 . . . . 0.0 110.64 -178.457 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . 0.531 ' O ' HG23 ' A' ' 75' ' ' VAL . 66.8 Cg_endo -75.0 128.26 11.34 Favored 'Trans proline' 0 N--CA 1.49 1.285 0 C-N-CA 122.744 2.296 . . . . 0.0 111.861 -179.671 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 80.4 mm-40 -86.77 -38.63 16.71 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.342 0.591 . . . . 0.0 111.089 -179.92 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.716 ' CD ' ' H ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -59.12 -39.52 82.55 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 115.261 -0.882 . . . . 0.0 111.559 -179.436 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.531 HG23 ' O ' ' A' ' 72' ' ' PRO . 41.6 t 20.87 90.0 0.05 OUTLIER Pre-proline 0 N--CA 1.466 0.349 0 O-C-N 124.074 0.859 . . . . 0.0 111.287 -179.972 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_exo -55.53 125.44 19.13 Favored 'Trans proline' 0 C--N 1.313 -1.307 0 C-N-CA 121.131 1.221 . . . . 0.0 111.613 -178.725 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.475 ' O ' ' N ' ' A' ' 79' ' ' ALA . 89.4 t -83.8 -18.98 9.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 115.301 -0.863 . . . . 0.0 110.638 179.663 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 71.5 p -41.94 -22.55 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.707 -178.901 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . 0.475 ' N ' ' O ' ' A' ' 77' ' ' VAL . . . -61.94 -39.0 90.6 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.251 179.711 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 38.6 t80 -61.41 -40.39 94.22 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.464 179.956 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 82.8 p -58.36 -40.33 81.94 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.709 0.29 . . . . 0.0 110.727 -179.489 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 7.5 m-85 -60.46 -50.63 72.79 Favored 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 120.745 -0.382 . . . . 0.0 110.716 179.915 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' TRP . . . . . . . . . . . . . 55.6 t90 -58.34 -38.34 76.96 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.604 179.938 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 87.6 m-20 -61.29 -44.86 96.51 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 120.594 -0.442 . . . . 0.0 110.838 -179.364 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 29.1 tp -73.67 -57.15 4.19 Favored 'General case' 0 N--CA 1.449 -0.478 0 C-N-CA 120.262 -0.575 . . . . 0.0 110.194 179.552 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -52.59 -26.8 10.61 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 C-N-CA 120.531 -0.468 . . . . 0.0 110.454 179.667 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 63.7 tttt -66.81 -50.32 63.0 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.976 -0.557 . . . . 0.0 110.78 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . 0.413 ' OE1' ' O ' ' A' ' 88' ' ' GLU . 1.2 pp20? -80.02 -20.24 45.83 Favored 'General case' 0 C--N 1.319 -0.738 0 C-N-CA 120.302 -0.559 . . . . 0.0 110.899 -179.396 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.533 ' O ' HD13 ' A' ' 89' ' ' LEU . 0.2 OUTLIER -62.16 -46.94 86.73 Favored 'General case' 0 N--CA 1.447 -0.613 0 C-N-CA 120.72 -0.392 . . . . 0.0 110.324 -178.865 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.497 HD12 ' CG1' ' A' ' 53' ' ' ILE . 3.3 mt -63.79 -43.43 97.93 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.141 0 C-N-CA 120.121 -0.632 . . . . 0.0 109.695 -179.821 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 96.2 m-20 -48.92 -44.86 40.73 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.56 -178.817 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 95.0 mttt -64.35 147.9 51.56 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.933 0.397 . . . . 0.0 110.759 179.599 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 69.8 mmtt -81.63 8.0 10.89 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.261 -179.83 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 80.5 tt0 -61.11 -33.81 73.97 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.128 179.801 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.46 ' H ' HG22 ' A' ' 95' ' ' VAL . 2.9 m -67.89 137.39 24.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.284 -0.417 . . . . 0.0 110.184 179.872 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' ASN . . . . . 0.532 ' ND2' ' OE2' ' A' ' 4' ' ' GLU . 0.0 OUTLIER -81.07 176.23 4.04 Favored Pre-proline 0 C--N 1.328 -0.354 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.93 -179.369 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_exo -57.95 -13.32 14.76 Favored 'Trans proline' 0 N--CA 1.495 1.606 0 C-N-CA 122.551 2.168 . . . . 0.0 112.268 179.428 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . 0.47 ' OE1' ' ND2' ' A' ' 96' ' ' ASN . 6.0 pt20 . . . . . 0 C--N 1.322 -0.605 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.785 -179.577 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 89.7 m . . . . . 0 C--O 1.232 0.168 0 CA-C-O 120.807 0.337 . . . . 0.0 110.248 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 86.3 mt-10 -77.98 172.64 13.19 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.244 -179.557 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' GLU . . . . . 0.481 ' O ' ' N ' ' A' ' 110' ' ' LEU . 94.8 mt-10 -106.2 124.42 49.56 Favored 'General case' 0 CA--C 1.513 -0.451 0 N-CA-C 109.85 -0.426 . . . . 0.0 109.85 179.129 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 45.7 pt -48.66 -13.16 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.971 179.76 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.481 ' N ' ' O ' ' A' ' 108' ' ' GLU . 33.0 mt -65.25 -42.22 93.5 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.596 179.778 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -69.01 -38.64 79.34 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.929 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 60.2 m -58.86 -43.63 90.88 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.835 -179.369 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 24.4 t-20 -66.76 -43.4 84.17 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.473 179.848 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 99.7 p -165.73 156.37 13.34 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.42 179.686 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 87.3 mt-30 -100.96 11.81 38.89 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.767 0.318 . . . . 0.0 110.567 179.81 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 41.0 p -65.58 -35.87 82.11 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.803 -179.797 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 55.2 m-20 . . . . . 0 C--N 1.329 -0.291 0 CA-C-N 116.467 -0.333 . . . . 0.0 110.281 -179.714 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.653 0 N-CA-C 110.912 -0.875 . . . . 0.0 110.912 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 84.5 mt-30 -64.03 -38.73 92.14 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.791 0.329 . . . . 0.0 110.559 -179.998 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . 0.492 ' O ' ' N ' ' A' ' 7' ' ' GLN . 92.8 mt-10 -55.79 -21.29 18.55 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.567 -179.852 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 46.5 tp -40.63 -37.22 0.7 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.546 179.951 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 82.5 p -55.72 -38.0 69.18 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.578 179.366 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . 0.492 ' N ' ' O ' ' A' ' 4' ' ' GLU . 85.6 mt-30 -65.96 -30.58 71.18 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.523 179.798 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 59.3 t-80 -61.1 -43.69 98.49 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.557 179.695 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -62.11 -43.27 99.21 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.614 179.251 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.502 ' O ' ' CB ' ' A' ' 14' ' ' GLN . 89.1 mtt-85 -65.93 -33.89 76.87 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.54 178.889 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.467 ' O ' ' CB ' ' A' ' 15' ' ' LEU . 0.1 OUTLIER -57.69 -43.2 84.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.609 -179.488 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 2.2 t -60.43 -52.31 62.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.546 -178.649 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 80.9 tt0 -78.16 -46.54 20.31 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.545 -178.683 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . 0.502 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 65.1 tp60 -59.29 -46.73 87.75 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.594 -178.423 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.793 ' C ' HD13 ' A' ' 15' ' ' LEU . 3.4 tm? -62.37 -51.25 68.33 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.562 -179.159 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -61.19 -37.15 81.95 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.558 -179.522 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 76.0 mt-30 -66.51 -40.3 89.13 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.557 177.832 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.512 ' O ' HG23 ' A' ' 21' ' ' THR . . . -63.04 -19.28 64.23 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.591 178.676 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.484 ' CD1' ' CE2' ' A' ' 82' ' ' TYR . 9.1 mt -86.59 -35.66 19.32 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.597 178.229 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 96.6 mttt -55.03 -42.26 72.4 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.543 -179.702 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . 0.512 HG23 ' O ' ' A' ' 18' ' ' ALA . 0.5 OUTLIER -63.09 -29.2 70.62 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.597 -179.73 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 75.0 mmt-85 -71.91 -7.33 47.86 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.582 179.462 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 105.82 23.96 7.21 Favored Glycine 0 CA--C 1.524 0.641 0 N-CA-C 110.92 -0.872 . . . . 0.0 110.92 179.854 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.643 HG12 ' N ' ' A' ' 25' ' ' LYS . 34.7 t -103.4 168.61 2.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 120.809 0.337 . . . . 0.0 110.579 179.839 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.643 ' N ' HG12 ' A' ' 24' ' ' VAL . 49.1 tttp -130.46 110.56 11.55 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.541 178.807 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.423 ' CG1' ' OD2' ' A' ' 30' ' ' ASP . 2.1 t -128.3 90.56 1.52 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.603 -179.391 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 19.2 pttt -78.56 166.55 22.43 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.555 179.416 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 87.7 m-85 -47.84 -35.69 10.68 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.588 179.812 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -48.98 -22.16 0.81 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.577 179.057 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.465 ' O ' ' CB ' ' A' ' 34' ' ' PHE . 20.3 t0 -66.62 -41.5 88.25 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.511 -179.56 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.541 ' O ' ' CB ' ' A' ' 35' ' ' PHE . 4.0 mp -61.45 -40.82 95.89 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.556 179.217 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 32.5 mt -62.28 -48.01 81.78 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.557 -179.014 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 82.0 tttt -84.82 -53.97 4.99 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.608 -177.469 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . 0.465 ' CB ' ' O ' ' A' ' 30' ' ' ASP . 35.4 t80 -56.94 -52.03 66.83 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.597 -177.434 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.541 ' CB ' ' O ' ' A' ' 31' ' ' LEU . 5.5 t80 -61.55 -45.79 92.69 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.534 -177.85 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 91.1 m-20 -65.72 -32.81 74.56 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.585 -179.08 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -65.85 -49.81 66.81 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.533 -178.831 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.605 ' O ' ' N ' ' A' ' 42' ' ' CYS . 26.9 m -72.08 -36.28 56.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.532 -179.037 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -61.97 -29.2 70.09 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.541 -179.354 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 97.5 m-20 -57.99 -47.49 82.85 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.55 -179.148 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.474 ' O ' ' C ' ' A' ' 42' ' ' CYS . 82.7 p -113.9 0.1 14.32 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.59 -178.91 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . 0.605 ' N ' ' O ' ' A' ' 38' ' ' VAL . 26.0 p 33.78 61.02 1.86 Allowed Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.595 -179.494 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . 0.404 ' HD3' ' N ' ' A' ' 42' ' ' CYS . 58.0 Cg_endo -78.43 -36.61 0.89 Allowed 'Trans proline' 0 C--N 1.305 -1.721 0 C-N-CA 122.816 2.344 . . . . 0.0 112.133 -179.256 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . 0.791 ' HE1' ' H ' ' A' ' 52' ' ' ASP . 0.0 OUTLIER -71.73 -2.01 15.94 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.565 -179.755 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.576 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 69.0 m-85 58.1 47.5 2.22 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.58 -179.677 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.576 ' CD ' ' N ' ' A' ' 45' ' ' PHE . 46.9 Cg_exo -38.48 -19.0 0.04 OUTLIER 'Trans proline' 0 C--N 1.305 -1.725 0 C-N-CA 122.837 2.358 . . . . 0.0 112.112 178.248 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.564 ' N ' ' O ' ' A' ' 45' ' ' PHE . 86.5 mt-30 -65.85 -53.64 37.21 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.601 -178.468 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -86.09 -15.77 40.15 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.544 -179.861 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 64.76 84.24 0.08 OUTLIER Glycine 0 CA--C 1.525 0.661 0 N-CA-C 110.97 -0.852 . . . . 0.0 110.97 -179.746 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . 0.412 ' HA ' HE21 ' A' ' 98' ' ' GLN . 14.8 t -145.33 171.29 14.8 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.816 0.341 . . . . 0.0 110.537 -179.284 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.2 mt -104.85 134.3 46.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.57 179.277 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . 0.791 ' H ' ' HE1' ' A' ' 44' ' ' TRP . 1.7 m-20 -111.93 121.94 46.39 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.536 -179.764 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.439 ' CG1' HD12 ' A' ' 90' ' ' ILE . 33.4 mm -94.6 -56.17 5.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.591 179.578 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -74.99 -51.56 13.34 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.566 -179.391 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.432 ' HA ' ' HE ' ' A' ' 58' ' ' ARG . 84.5 mtt85 -59.26 -29.75 67.78 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.553 -179.042 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' TRP . . . . . 0.585 ' CE3' ' CH2' ' A' ' 44' ' ' TRP . 24.9 t-105 -63.44 -36.96 85.46 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.529 178.923 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 79.3 mtp85 -64.96 -35.37 80.96 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.565 179.217 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . 0.432 ' HE ' ' HA ' ' A' ' 55' ' ' ARG . 69.8 mtm180 -60.11 -52.59 64.67 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.621 -179.466 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 2.8 p -65.44 -33.35 63.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.612 -179.86 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -71.22 -38.97 62.94 Favored Glycine 0 CA--C 1.525 0.689 0 N-CA-C 110.944 -0.862 . . . . 0.0 110.944 179.932 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 56.0 t0 -63.36 -48.75 76.65 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.792 0.329 . . . . 0.0 110.554 -179.627 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 99.8 m -64.06 -46.59 83.68 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.553 -179.863 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 6.3 m-85 -63.79 -31.65 72.9 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.6 179.767 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 70.8 tp60 -61.57 -40.22 93.95 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.514 179.647 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 20.6 t0 -63.19 -52.03 63.97 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.561 179.583 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' TYR . . . . . 0.461 ' O ' ' OG1' ' A' ' 69' ' ' THR . 68.8 m-85 -66.81 -32.06 73.1 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.579 179.743 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 63.9 t80 -60.41 -43.37 96.76 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.525 179.388 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 99.0 m-20 -65.65 -38.68 90.03 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.526 -179.863 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.461 ' OG1' ' O ' ' A' ' 66' ' ' TYR . 62.0 p -64.91 -22.59 67.02 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.568 -179.571 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -72.21 -42.58 65.61 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.561 179.938 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . 0.531 ' H ' ' HD3' ' A' ' 72' ' ' PRO . . . 110.24 72.34 0.69 Allowed Glycine 0 CA--C 1.525 0.715 0 N-CA-C 110.925 -0.87 . . . . 0.0 110.925 179.139 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . 0.531 ' HD3' ' H ' ' A' ' 71' ' ' GLY . 16.4 Cg_exo -67.4 147.28 77.33 Favored 'Trans proline' 0 C--N 1.305 -1.728 0 C-N-CA 122.746 2.297 . . . . 0.0 112.124 178.108 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 99.1 mt-10 -76.92 -51.13 11.74 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.546 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.527 ' HD3' ' H ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -140.44 5.59 2.05 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.547 -179.609 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 55.5 t 56.46 91.69 0.07 OUTLIER Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.57 -179.808 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_exo -55.26 122.64 12.08 Favored 'Trans proline' 0 C--N 1.305 -1.732 0 C-N-CA 122.845 2.363 . . . . 0.0 112.146 -179.011 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.44 ' O ' HG12 ' A' ' 77' ' ' VAL . 98.0 t -86.25 -13.49 10.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.539 -179.536 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 81.0 p -44.01 -23.74 0.11 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.601 -179.587 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . 0.401 ' N ' ' O ' ' A' ' 77' ' ' VAL . . . -55.41 -40.61 71.65 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.61 179.794 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 41.1 t80 -63.02 -38.35 90.83 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.604 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 19.6 m -59.05 -41.86 88.93 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.6 -179.511 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' TYR . . . . . 0.484 ' CE2' ' CD1' ' A' ' 19' ' ' LEU . 13.0 m-85 -59.66 -51.65 68.89 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.533 -179.952 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' TRP . . . . . 0.431 ' O ' ' CB ' ' A' ' 87' ' ' LYS . 80.9 t90 -56.66 -40.25 75.16 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.522 -179.69 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 71.8 m-20 -59.92 -46.37 89.58 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.542 -179.883 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.407 ' O ' ' HG3' ' A' ' 88' ' ' GLU . 26.1 tp -71.8 -63.34 1.15 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.57 179.674 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -47.57 -26.77 1.06 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.584 179.11 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.431 ' CB ' ' O ' ' A' ' 83' ' ' TRP . 59.6 tttt -68.03 -49.97 58.22 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.564 -179.536 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . 0.488 ' OE1' ' O ' ' A' ' 88' ' ' GLU . 1.0 OUTLIER -79.74 -19.59 48.39 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.565 -179.924 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.586 ' O ' HD13 ' A' ' 89' ' ' LEU . 0.2 OUTLIER -60.92 -49.15 78.61 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.573 -179.509 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.439 HD12 ' CG1' ' A' ' 53' ' ' ILE . 3.1 mt -63.66 -42.6 96.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.53 179.726 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 65.0 t0 -57.16 -45.87 83.24 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.555 -178.931 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 78.8 mttt -57.12 136.79 56.39 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.568 -179.546 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 58.6 mttp -69.81 -4.34 19.64 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.582 179.857 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -73.4 47.65 0.23 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.573 -179.871 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 21.4 m -121.82 163.98 19.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.581 179.81 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' ASN . . . . . 0.742 ' H ' ' ND2' ' A' ' 96' ' ' ASN . 0.0 OUTLIER -97.31 176.75 1.92 Allowed Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.58 -179.896 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' PRO . . . . . 0.459 ' CD ' ' CB ' ' A' ' 96' ' ' ASN . 37.9 Cg_exo -59.55 -22.49 66.9 Favored 'Trans proline' 0 C--N 1.305 -1.744 0 C-N-CA 122.839 2.359 . . . . 0.0 112.109 179.688 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . 0.485 ' OE1' ' ND2' ' A' ' 96' ' ' ASN . 5.7 pt20 . . . . . 0 C--N 1.329 -0.317 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.579 -179.766 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 98.0 m . . . . . 0 C--O 1.231 0.08 0 CA-C-O 120.828 0.347 . . . . 0.0 110.573 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . 0.436 ' OE2' ' O ' ' A' ' 113' ' ' ASN . 90.2 mt-10 -74.95 -178.27 3.69 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.547 -179.813 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' GLU . . . . . 0.553 ' C ' ' H ' ' A' ' 110' ' ' LEU . 80.7 mm-40 -102.87 128.56 49.6 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.571 179.256 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 40.7 pt -56.37 -0.78 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.613 -179.803 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.553 ' H ' ' C ' ' A' ' 108' ' ' GLU . 94.9 mt -89.33 -2.33 58.4 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.592 179.969 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 84.6 tttt -141.8 154.44 45.21 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.555 -179.747 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 5.5 p -60.69 173.3 0.76 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.546 -179.791 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 113' ' ' ASN . . . . . 0.436 ' O ' ' OE2' ' A' ' 107' ' ' GLU . 70.6 m-20 -62.45 -38.5 90.01 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.566 -179.628 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 114' ' ' SER . . . . . 0.483 ' O ' ' O ' ' A' ' 115' ' ' GLN . 11.6 m -68.77 138.82 55.14 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.599 -179.705 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 115' ' ' GLN . . . . . 0.483 ' O ' ' O ' ' A' ' 114' ' ' SER . 82.7 mt-30 56.95 148.57 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.556 -179.624 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 116' ' ' THR . . . . . 0.481 ' O ' ' C ' ' A' ' 117' ' ' ASP . 21.5 p -84.17 170.59 13.63 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.581 179.472 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 117' ' ' ASP . . . . . 0.481 ' C ' ' O ' ' A' ' 116' ' ' THR . 58.6 t0 . . . . . 0 C--N 1.329 -0.306 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.588 179.894 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.632 0 N-CA-C 111.104 -0.798 . . . . 0.0 111.104 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 88.6 mt-30 -58.94 -31.39 68.65 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.874 0.368 . . . . 0.0 110.407 -179.723 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 69.7 mm-40 -65.32 -24.53 67.3 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.681 179.545 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 37.4 tp -43.06 -33.08 0.77 Allowed 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.245 0.545 . . . . 0.0 110.307 -179.553 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 68.1 m -53.67 -41.27 66.69 Favored 'General case' 0 C--N 1.324 -0.526 0 C-N-CA 120.486 -0.486 . . . . 0.0 110.123 179.912 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . 0.467 ' OE1' ' CG ' ' A' ' 97' ' ' PRO . 86.6 mt-30 -61.93 -34.16 75.58 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.827 179.703 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 73.9 t60 -57.1 -41.81 79.6 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.974 0.416 . . . . 0.0 109.952 -179.982 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 96.2 mt-10 -62.5 -43.38 98.95 Favored 'General case' 0 C--O 1.238 0.482 0 C-N-CA 120.357 -0.537 . . . . 0.0 110.026 179.566 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.446 ' O ' ' CB ' ' A' ' 14' ' ' GLN . 62.6 mtp180 -65.16 -33.18 75.39 Favored 'General case' 0 C--O 1.208 -1.096 0 CA-C-N 116.038 -0.528 . . . . 0.0 109.58 179.668 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -58.4 -44.6 89.04 Favored 'General case' 0 C--N 1.322 -0.588 0 C-N-CA 120.77 -0.372 . . . . 0.0 110.62 -179.54 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 13.4 t -61.62 -48.83 86.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 C-N-CA 120.433 -0.507 . . . . 0.0 111.892 -179.863 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.414 ' OE2' HD11 ' A' ' 31' ' ' LEU . 70.0 mm-40 -76.02 -41.79 49.89 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.291 0.567 . . . . 0.0 111.428 -179.649 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . 0.446 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 66.6 tp60 -62.07 -50.4 72.11 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.498 -179.189 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.57 HD13 ' O ' ' A' ' 15' ' ' LEU . 0.3 OUTLIER -63.97 -49.17 73.58 Favored 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 120.303 -0.559 . . . . 0.0 109.99 179.828 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 94.9 mttt -58.93 -34.44 71.74 Favored 'General case' 0 C--N 1.324 -0.525 0 C-N-CA 120.707 -0.397 . . . . 0.0 110.729 -179.683 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 91.1 mt-30 -78.58 -36.2 44.79 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.864 179.633 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -56.39 -34.63 66.89 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.932 -0.576 . . . . 0.0 109.929 -179.749 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.472 ' O ' ' N ' ' A' ' 22' ' ' ARG . 3.7 mt -85.16 -35.06 21.96 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.156 0.503 . . . . 0.0 110.461 179.231 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 65.1 tttm -45.95 -41.68 11.94 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.478 -178.642 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . 0.404 ' H ' HG22 ' A' ' 21' ' ' THR . 0.2 OUTLIER -75.71 -16.06 60.21 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.747 -179.942 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.472 ' N ' ' O ' ' A' ' 19' ' ' LEU . 86.2 mmt-85 -83.56 13.21 4.74 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 120.828 0.347 . . . . 0.0 110.28 -179.881 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 97.32 4.94 58.24 Favored Glycine 0 CA--C 1.522 0.512 0 N-CA-C 110.915 -0.874 . . . . 0.0 110.915 179.671 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.599 HG12 ' N ' ' A' ' 25' ' ' LYS . 15.7 t -93.5 169.33 1.38 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 C-N-CA 121.094 -0.242 . . . . 0.0 110.469 -179.798 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.599 ' N ' HG12 ' A' ' 24' ' ' VAL . 99.4 mttt -134.41 134.46 41.66 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.24 179.654 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 8.9 m -131.03 129.86 63.53 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.288 0 CA-C-N 116.601 -0.272 . . . . 0.0 110.268 179.812 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.4 ' HD2' ' HB3' ' A' ' 29' ' ' ALA . 16.0 pttp -110.13 163.59 13.45 Favored 'General case' 0 C--O 1.226 -0.134 0 CA-C-O 120.652 0.263 . . . . 0.0 110.585 179.771 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 98.0 m-85 -56.51 -34.75 67.3 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.021 0.439 . . . . 0.0 110.267 179.858 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.512 ' HA ' HD12 ' A' ' 32' ' ' LEU . . . -51.93 -23.32 4.8 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.236 179.708 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.487 ' O ' ' CB ' ' A' ' 34' ' ' PHE . 97.3 m-20 -62.2 -49.99 73.59 Favored 'General case' 0 C--O 1.219 -0.531 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.311 -179.547 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.433 ' O ' ' CB ' ' A' ' 35' ' ' PHE . 3.7 mp -63.32 -38.3 90.63 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 121.224 0.535 . . . . 0.0 109.837 179.565 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.512 HD12 ' HA ' ' A' ' 29' ' ' ALA . 42.9 mt -61.1 -51.32 69.63 Favored 'General case' 0 C--N 1.308 -1.199 0 C-N-CA 119.106 -1.038 . . . . 0.0 111.435 -179.068 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.408 ' O ' ' OD1' ' A' ' 36' ' ' ASP . 87.1 tttt -88.07 -54.18 4.35 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 112.864 0.691 . . . . 0.0 112.864 -178.287 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . 0.487 ' CB ' ' O ' ' A' ' 30' ' ' ASP . 9.7 t80 -53.48 -47.75 69.52 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.427 -178.093 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.433 ' CB ' ' O ' ' A' ' 31' ' ' LEU . 1.1 t80 -62.89 -48.88 77.07 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 120.348 -0.541 . . . . 0.0 110.341 179.978 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . 0.408 ' OD1' ' O ' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -62.94 -34.3 77.19 Favored 'General case' 0 C--O 1.234 0.282 0 C-N-CA 119.554 -0.858 . . . . 0.0 111.816 -179.052 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.439 ' O ' ' OG1' ' A' ' 41' ' ' THR . 3.2 t80 -62.15 -47.12 85.94 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.226 -178.734 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.505 ' O ' ' N ' ' A' ' 42' ' ' CYS . 29.8 m -71.17 -26.27 26.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.528 -179.47 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 24.4 mttt -61.22 -45.55 94.11 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 120.465 -0.494 . . . . 0.0 110.89 -179.584 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 89.3 m-20 -75.88 -50.55 14.74 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 120.549 -0.46 . . . . 0.0 111.41 -179.835 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.439 ' OG1' ' O ' ' A' ' 37' ' ' PHE . 1.6 p -70.27 -34.74 73.16 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.443 -179.501 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . 0.505 ' N ' ' O ' ' A' ' 38' ' ' VAL . 48.6 m 47.09 53.14 13.36 Favored Pre-proline 0 C--N 1.331 -0.219 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.416 -178.45 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . 0.464 ' HD3' ' N ' ' A' ' 42' ' ' CYS . 68.6 Cg_endo -79.22 -33.21 1.48 Allowed 'Trans proline' 0 N--CA 1.488 1.165 0 C-N-CA 122.507 2.138 . . . . 0.0 112.463 -179.608 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . 0.676 ' HE1' ' H ' ' A' ' 52' ' ' ASP . 0.0 OUTLIER -87.86 20.12 3.21 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.971 -179.27 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.428 ' C ' ' H ' ' A' ' 47' ' ' GLN . 59.4 m-85 48.21 59.61 16.58 Favored Pre-proline 0 C--N 1.33 -0.277 0 C-N-CA 120.455 -0.498 . . . . 0.0 109.972 179.917 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo -51.82 -7.76 0.25 Allowed 'Trans proline' 0 C--N 1.312 -1.371 0 C-N-CA 122.893 2.395 . . . . 0.0 112.333 179.867 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.428 ' H ' ' C ' ' A' ' 45' ' ' PHE . 87.8 mt-30 -71.32 -54.37 11.04 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.635 -179.849 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -88.76 -28.59 20.39 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.576 179.254 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 79.12 66.8 1.66 Allowed Glycine 0 CA--C 1.525 0.696 0 N-CA-C 110.661 -0.976 . . . . 0.0 110.661 -179.615 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . 0.542 ' OG1' ' NE2' ' A' ' 98' ' ' GLN . 15.3 t -127.93 169.13 14.32 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.827 0.346 . . . . 0.0 111.012 -179.361 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.2 mt -98.88 132.08 44.85 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.253 0 CA-C-N 116.094 -0.503 . . . . 0.0 109.901 179.418 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . 0.676 ' H ' ' HE1' ' A' ' 44' ' ' TRP . 5.6 t0 -116.54 119.08 34.46 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.008 179.012 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 17.8 mm -82.98 -25.41 8.13 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.035 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -85.81 -57.18 3.15 Favored 'General case' 0 C--O 1.239 0.523 0 CA-C-O 121.471 0.653 . . . . 0.0 111.442 -179.116 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 95.7 mtt-85 -60.72 -33.27 72.64 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.396 -179.342 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' TRP . . . . . 0.629 ' CE3' ' CH2' ' A' ' 44' ' ' TRP . 34.2 t-105 -57.85 -37.7 74.35 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.114 0.483 . . . . 0.0 110.265 179.96 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 85.0 mtp180 -64.58 -37.94 89.3 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.183 179.79 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 41.2 ttm180 -60.95 -51.62 68.51 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 120.447 -0.501 . . . . 0.0 111.049 -179.551 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 6.9 p -68.85 -38.43 78.69 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.425 0 CA-C-O 120.896 0.379 . . . . 0.0 110.218 179.404 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -64.5 -39.05 96.53 Favored Glycine 0 CA--C 1.525 0.68 0 N-CA-C 111.135 -0.786 . . . . 0.0 111.135 179.689 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . 0.422 ' O ' ' OD1' ' A' ' 61' ' ' ASP . 64.0 t0 -62.64 -38.29 89.69 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.876 0.369 . . . . 0.0 110.326 -179.962 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 75.8 m -61.95 -38.42 88.44 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.447 -179.893 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 5.5 m-85 -62.71 -37.75 87.73 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.358 179.89 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 57.6 tt0 -63.11 -42.1 99.5 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.963 -179.898 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 62.2 t0 -60.22 -52.0 67.17 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.055 0.455 . . . . 0.0 110.456 -179.925 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 55.0 m-85 -62.2 -39.52 93.02 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.414 179.811 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 9.8 t80 -62.1 -40.53 96.18 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.291 179.818 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 88.3 m-20 -57.33 -32.72 67.0 Favored 'General case' 0 CA--C 1.518 -0.269 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.046 -179.27 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 25.0 p -65.64 -20.47 66.31 Favored 'General case' 0 C--N 1.317 -0.816 0 C-N-CA 119.748 -0.781 . . . . 0.0 110.034 179.281 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 69.7 m-85 -107.34 -51.45 2.91 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 116.024 -0.534 . . . . 0.0 112.399 -179.738 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -142.46 78.11 0.28 Allowed Glycine 0 CA--C 1.539 1.54 0 N-CA-C 111.074 -0.811 . . . . 0.0 111.074 -179.292 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . 0.412 ' O ' HG23 ' A' ' 75' ' ' VAL . 56.8 Cg_endo -75.98 -16.14 18.26 Favored 'Trans proline' 0 C--N 1.298 -2.093 0 C-N-CA 122.831 2.354 . . . . 0.0 111.735 -179.672 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 77.4 mm-40 -89.47 -38.39 14.09 Favored 'General case' 0 CA--C 1.505 -0.774 0 CA-C-O 121.567 0.699 . . . . 0.0 110.585 179.798 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 51.5 mmtt -65.48 -46.09 81.1 Favored 'General case' 0 C--N 1.308 -1.213 0 CA-C-N 114.82 -1.082 . . . . 0.0 111.123 -178.199 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.555 ' O ' HG12 ' A' ' 75' ' ' VAL . 54.6 t 38.51 84.06 0.19 Allowed Pre-proline 0 N--CA 1.451 -0.406 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.115 179.492 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_exo -55.41 126.86 23.92 Favored 'Trans proline' 0 C--N 1.311 -1.436 0 C-N-CA 121.925 1.75 . . . . 0.0 111.373 -179.629 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 58.0 t -82.08 -17.17 11.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.513 -179.936 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 22.6 p -48.19 -26.46 1.93 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.176 -179.35 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.27 -41.24 98.3 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.179 0.514 . . . . 0.0 110.583 179.661 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 8.4 m-85 -62.69 -37.31 85.96 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.346 179.829 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 59.9 m -58.58 -40.62 83.68 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.309 179.745 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 5.1 m-85 -59.67 -50.83 72.34 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.722 -179.675 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' TRP . . . . . 0.539 ' N ' ' CD1' ' A' ' 83' ' ' TRP . 6.1 m0 -59.8 -38.26 81.41 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.595 -179.881 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 92.9 m-20 -62.09 -45.28 94.18 Favored 'General case' 0 C--N 1.325 -0.457 0 C-N-CA 120.581 -0.447 . . . . 0.0 110.79 -179.339 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 56.7 tp -71.91 -53.99 11.42 Favored 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 120.341 -0.544 . . . . 0.0 110.5 179.87 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -58.54 -25.16 27.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 C-N-CA 120.766 -0.374 . . . . 0.0 110.483 179.884 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.401 ' CB ' ' O ' ' A' ' 83' ' ' TRP . 67.1 tttt -65.39 -50.24 66.25 Favored 'General case' 0 C--N 1.321 -0.672 0 C-N-CA 120.348 -0.541 . . . . 0.0 110.306 -179.79 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . 0.415 ' OE1' ' O ' ' A' ' 88' ' ' GLU . 1.0 OUTLIER -80.54 -20.84 42.59 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.782 -179.912 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.412 HD12 ' HA ' ' A' ' 89' ' ' LEU . 12.4 tp -62.15 -45.16 94.64 Favored 'General case' 0 N--CA 1.448 -0.57 0 C-N-CA 120.316 -0.554 . . . . 0.0 110.438 -178.686 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.482 ' O ' ' N ' ' A' ' 92' ' ' LYS . 2.9 mt -65.02 -43.63 96.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 C-N-CA 120.334 -0.547 . . . . 0.0 109.955 179.943 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 98.0 m-20 -47.03 -14.06 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.791 -178.199 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . 0.482 ' N ' ' O ' ' A' ' 90' ' ' ILE . 86.4 tttt -68.58 133.9 49.2 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.371 179.92 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -64.46 -41.41 96.53 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.942 -179.939 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 99.1 mt-10 -105.79 55.17 0.68 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.053 -179.664 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.515 ' O ' ' ND2' ' A' ' 96' ' ' ASN . 6.9 t -45.27 -75.48 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.497 -179.476 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' ASN . . . . . 0.515 ' ND2' ' O ' ' A' ' 95' ' ' VAL . 0.9 OUTLIER -153.74 160.54 30.82 Favored Pre-proline 0 C--N 1.326 -0.431 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.738 179.979 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' PRO . . . . . 0.467 ' CG ' ' OE1' ' A' ' 7' ' ' GLN . 16.3 Cg_endo -56.83 -11.89 8.07 Favored 'Trans proline' 0 N--CA 1.495 1.602 0 C-N-CA 122.959 2.439 . . . . 0.0 112.059 178.751 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . 0.542 ' NE2' ' OG1' ' A' ' 50' ' ' THR . 4.6 pt20 . . . . . 0 C--N 1.322 -0.597 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.999 -179.758 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . 0.415 ' O ' ' O ' ' A' ' 107' ' ' GLU . 4.9 t . . . . . 0 C--O 1.231 0.08 0 CA-C-O 120.874 0.368 . . . . 0.0 110.634 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . 0.415 ' O ' ' O ' ' A' ' 106' ' ' THR . 75.4 mm-40 44.39 -169.37 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.343 179.856 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' GLU . . . . . 0.513 ' O ' ' N ' ' A' ' 110' ' ' LEU . 93.0 mt-10 -109.07 122.16 46.67 Favored 'General case' 0 CA--C 1.515 -0.393 0 N-CA-C 109.697 -0.483 . . . . 0.0 109.697 179.387 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 44.0 pt -47.69 -12.43 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.14 179.573 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.513 ' N ' ' O ' ' A' ' 108' ' ' GLU . 31.5 mt -66.25 -41.95 89.25 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.812 179.615 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -66.12 -36.0 81.98 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.479 -179.899 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 45.9 m -57.7 -45.44 85.68 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.684 -179.289 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 29.6 t30 -65.56 -43.33 90.2 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.637 179.676 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 20.8 m -166.06 150.94 8.28 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.559 179.663 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 87.4 mt-30 -91.09 18.8 6.35 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.487 179.715 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 15.3 p -60.16 -47.42 85.99 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.495 -179.809 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 94.8 m-20 . . . . . 0 C--N 1.33 -0.268 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.539 179.684 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.875 0 N-CA-C 111.142 -0.783 . . . . 0.0 111.142 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 87.1 mt-30 -59.3 -27.05 65.51 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.952 0.406 . . . . 0.0 110.389 -179.925 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 82.2 tt0 -53.9 -21.48 7.9 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.613 179.862 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 34.5 tp -40.19 -29.59 0.08 Allowed 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 120.959 0.409 . . . . 0.0 110.418 -179.321 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 78.3 p -55.38 -38.6 69.07 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 120.586 -0.446 . . . . 0.0 110.078 179.947 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 99.7 mm-40 -62.28 -37.23 84.71 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.585 179.64 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 75.1 t60 -57.24 -42.29 81.21 Favored 'General case' 0 C--N 1.332 -0.169 0 N-CA-C 109.91 -0.404 . . . . 0.0 109.91 -179.854 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 81.2 mm-40 -60.11 -45.63 92.32 Favored 'General case' 0 C--O 1.243 0.726 0 CA-C-O 121.208 0.528 . . . . 0.0 109.873 179.318 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.415 ' O ' ' CB ' ' A' ' 14' ' ' GLN . 70.3 mtp180 -64.87 -33.34 75.78 Favored 'General case' 0 C--O 1.212 -0.912 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 179.327 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.574 ' CE1' HD23 ' A' ' 15' ' ' LEU . 49.0 t80 -59.37 -38.17 79.78 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 120.217 -0.593 . . . . 0.0 110.3 -179.295 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 3.4 t -62.07 -50.01 81.8 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 C-N-CA 119.774 -0.77 . . . . 0.0 111.37 179.974 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 97.3 mt-10 -79.38 -35.86 40.12 Favored 'General case' 0 C--N 1.322 -0.587 0 C-N-CA 120.232 -0.587 . . . . 0.0 112.061 -179.082 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . 0.415 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 66.2 tp60 -68.71 -51.68 39.04 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.527 -179.005 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.574 HD23 ' CE1' ' A' ' 11' ' ' TYR . 0.2 OUTLIER -63.35 -46.43 86.62 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.343 -179.518 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -57.76 -31.95 67.0 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 178.838 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 49.2 tt0 -75.24 -39.45 59.92 Favored 'General case' 0 C--O 1.239 0.552 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.198 178.879 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.417 ' O ' HG23 ' A' ' 21' ' ' THR . . . -58.07 -25.06 60.79 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-N 115.933 -0.576 . . . . 0.0 109.725 179.536 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.448 ' O ' ' N ' ' A' ' 22' ' ' ARG . 3.7 mt -85.36 -40.73 16.17 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.199 178.581 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 92.9 mttt -43.24 -45.69 5.86 Favored 'General case' 0 N--CA 1.464 0.273 0 C-N-CA 120.353 -0.539 . . . . 0.0 111.035 -179.2 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . 0.49 ' C ' ' H ' ' A' ' 23' ' ' GLY . 0.2 OUTLIER -63.62 -31.38 72.53 Favored 'General case' 0 C--N 1.324 -0.535 0 C-N-CA 120.467 -0.493 . . . . 0.0 110.758 -179.812 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.448 ' N ' ' O ' ' A' ' 19' ' ' LEU . 80.1 mmt-85 -69.05 10.24 0.32 Allowed 'General case' 0 C--O 1.232 0.18 0 C-N-CA 120.795 -0.362 . . . . 0.0 110.457 -179.745 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . 0.49 ' H ' ' C ' ' A' ' 21' ' ' THR . . . 91.52 22.49 31.4 Favored Glycine 0 N--CA 1.467 0.736 0 N-CA-C 111.162 -0.775 . . . . 0.0 111.162 179.738 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.642 HG12 ' N ' ' A' ' 25' ' ' LYS . 39.8 t -105.27 168.27 2.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-O 120.63 0.253 . . . . 0.0 110.575 -179.882 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.642 ' N ' HG12 ' A' ' 24' ' ' VAL . 98.9 mttt -134.96 105.15 6.25 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.171 179.356 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.491 ' CG1' ' OD2' ' A' ' 30' ' ' ASP . 1.7 t -117.92 93.66 2.67 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.443 0 C-N-CA 120.895 -0.322 . . . . 0.0 110.765 -179.656 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 25.5 pttt -81.43 165.22 21.47 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.711 179.619 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 98.0 m-85 -48.21 -31.83 6.33 Favored 'General case' 0 C--O 1.241 0.614 0 CA-C-O 121.254 0.55 . . . . 0.0 110.647 179.895 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -54.43 -23.22 15.05 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.012 179.552 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.491 ' OD2' ' CG1' ' A' ' 26' ' ' VAL . 21.4 t0 -65.11 -42.0 94.4 Favored 'General case' 0 C--O 1.218 -0.567 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.894 -179.54 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.482 ' O ' ' CB ' ' A' ' 35' ' ' PHE . 4.7 mp -65.16 -40.58 94.55 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-O 121.029 0.443 . . . . 0.0 109.856 -179.866 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 40.7 mt -58.91 -46.35 88.11 Favored 'General case' 0 C--N 1.312 -1.064 0 C-N-CA 119.34 -0.944 . . . . 0.0 111.086 -178.216 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.411 ' O ' ' CD1' ' A' ' 37' ' ' PHE . 83.3 tttt -85.67 -49.99 7.54 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.896 -178.889 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . 0.44 ' CB ' ' O ' ' A' ' 30' ' ' ASP . 49.7 t80 -61.51 -50.75 71.44 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.206 -178.742 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.482 ' CB ' ' O ' ' A' ' 31' ' ' LEU . 5.4 t80 -61.6 -46.79 88.33 Favored 'General case' 0 C--N 1.33 -0.264 0 O-C-N 123.325 0.391 . . . . 0.0 110.241 -179.152 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 93.1 m-20 -63.44 -38.31 90.64 Favored 'General case' 0 C--N 1.34 0.167 0 C-N-CA 120.597 -0.441 . . . . 0.0 111.224 -179.431 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.411 ' CD1' ' O ' ' A' ' 33' ' ' LYS . 2.8 m-85 -61.09 -46.49 90.41 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.487 -178.929 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.524 ' O ' ' N ' ' A' ' 42' ' ' CYS . 27.6 m -76.87 -37.29 27.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 C-N-CA 120.307 -0.557 . . . . 0.0 110.425 -179.779 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 61.5 tttm -56.49 -29.25 61.57 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.763 -179.627 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 66.4 t0 -49.73 -62.43 1.56 Allowed 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.748 -0.381 . . . . 0.0 111.138 -179.446 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 17.2 p -115.21 1.1 13.74 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 116.529 -0.305 . . . . 0.0 111.562 -179.84 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . 0.524 ' N ' ' O ' ' A' ' 38' ' ' VAL . 2.2 m 40.49 59.25 7.72 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.434 -178.479 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . 0.483 ' HD3' ' N ' ' A' ' 42' ' ' CYS . 9.1 Cg_exo -67.75 -29.65 35.31 Favored 'Trans proline' 0 N--CA 1.496 1.668 0 C-N-CA 122.442 2.094 . . . . 0.0 112.568 -179.415 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . 0.535 ' HE1' ' H ' ' A' ' 52' ' ' ASP . 0.0 OUTLIER -64.75 0.47 1.14 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.827 -179.272 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.487 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 45.9 t80 45.25 52.25 10.29 Favored Pre-proline 0 C--N 1.327 -0.395 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.078 -179.789 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.487 ' CD ' ' N ' ' A' ' 45' ' ' PHE . 19.8 Cg_endo -59.23 -7.17 4.64 Favored 'Trans proline' 0 C--N 1.307 -1.627 0 C-N-CA 122.965 2.443 . . . . 0.0 112.176 179.804 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 99.3 mm-40 -51.22 -54.38 26.2 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 120.534 -0.466 . . . . 0.0 110.167 -179.491 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -89.65 -13.36 37.21 Favored 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 120.737 -0.385 . . . . 0.0 110.697 179.028 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 77.32 71.58 1.19 Allowed Glycine 0 CA--C 1.522 0.53 0 N-CA-C 110.474 -1.051 . . . . 0.0 110.474 -179.318 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 1.7 t -137.22 162.99 31.97 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 121.052 -0.259 . . . . 0.0 110.719 -179.383 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.443 ' CD1' HD23 ' A' ' 89' ' ' LEU . 1.5 mt -91.6 141.97 13.71 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.101 179.445 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . 0.535 ' H ' ' HE1' ' A' ' 44' ' ' TRP . 9.3 m-20 -113.77 119.21 36.56 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.987 -0.552 . . . . 0.0 111.503 179.835 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.503 ' CG1' HD12 ' A' ' 90' ' ' ILE . 27.8 mm -95.21 -57.01 4.69 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 C-N-CA 120.768 -0.373 . . . . 0.0 110.963 178.694 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 99.7 mttt -75.81 -46.73 28.98 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-O 121.137 0.494 . . . . 0.0 111.52 -179.784 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 79.7 mtp180 -60.56 -32.4 71.47 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 116.031 -0.531 . . . . 0.0 109.897 -179.668 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 26.9 t-105 -59.67 -36.86 77.3 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 116.039 -0.528 . . . . 0.0 109.759 178.691 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 63.3 ttm-85 -66.75 -38.22 86.19 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.498 179.505 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 82.7 mtp180 -57.22 -48.09 79.69 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 120.577 -0.449 . . . . 0.0 111.318 -179.122 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 4.3 p -66.14 -34.25 68.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 C-N-CA 120.602 -0.439 . . . . 0.0 110.059 179.461 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -66.22 -38.85 94.17 Favored Glycine 0 CA--C 1.526 0.772 0 N-CA-C 111.197 -0.761 . . . . 0.0 111.197 179.545 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 99.9 m-20 -62.46 -46.02 90.41 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.758 0.313 . . . . 0.0 111.07 -179.524 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 88.6 m -65.74 -42.48 90.95 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.173 0.511 . . . . 0.0 110.305 179.941 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 6.8 m-85 -67.47 -30.05 69.66 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.289 179.572 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 59.7 tt0 -62.33 -43.75 98.09 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.228 -179.888 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 31.3 t0 -61.28 -50.74 71.81 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.11 0.481 . . . . 0.0 110.422 179.232 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 34.0 m-85 -62.88 -34.91 78.37 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.075 -0.512 . . . . 0.0 109.947 179.318 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . 0.548 ' CE2' ' O ' ' A' ' 71' ' ' GLY . 76.2 t80 -62.43 -36.85 83.68 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.005 -0.543 . . . . 0.0 109.96 179.679 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 23.5 m-20 -62.63 -37.77 87.63 Favored 'General case' 0 CA--C 1.519 -0.217 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.334 179.801 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 66.5 p -61.27 -19.45 61.73 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 119.812 -0.755 . . . . 0.0 109.16 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 60.0 m-85 -99.27 -49.99 4.28 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 112.752 0.649 . . . . 0.0 112.752 179.731 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . 0.548 ' O ' ' CE2' ' A' ' 67' ' ' TYR . . . 173.02 92.73 0.08 OUTLIER Glycine 0 CA--C 1.537 1.429 0 N-CA-C 111.024 -0.83 . . . . 0.0 111.024 -178.874 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . 0.514 ' O ' HG23 ' A' ' 75' ' ' VAL . 52.9 Cg_endo -84.23 16.06 2.02 Favored 'Trans proline' 0 N--CA 1.487 1.103 0 C-N-CA 124.12 3.214 . . . . 0.0 111.182 179.458 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 92.4 mt-10 -88.24 -49.65 6.85 Favored 'General case' 0 CA--C 1.51 -0.583 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.248 -178.896 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.423 ' O ' ' O ' ' A' ' 75' ' ' VAL . 0.5 OUTLIER -62.14 -44.31 96.9 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.015 -0.993 . . . . 0.0 110.614 179.671 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.514 HG23 ' O ' ' A' ' 72' ' ' PRO . 78.8 t 36.31 94.16 0.04 OUTLIER Pre-proline 0 N--CA 1.467 0.408 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.395 -179.52 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_exo -57.63 126.21 21.14 Favored 'Trans proline' 0 N--CA 1.493 1.473 0 C-N-CA 121.377 1.385 . . . . 0.0 112.283 -179.672 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 60.6 t -83.83 -25.9 7.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.905 179.144 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . 0.43 ' H ' HG23 ' A' ' 78' ' ' THR . 22.0 p -44.73 -24.25 0.19 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.499 -179.112 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -59.86 -40.67 89.41 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.348 179.635 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 35.9 t80 -64.61 -39.47 93.78 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.717 179.872 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 11.6 t -58.66 -46.67 86.66 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.028 -179.409 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 14.6 m-85 -62.7 -49.07 76.55 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.731 -0.388 . . . . 0.0 110.942 179.622 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' TRP . . . . . . . . . . . . . 53.1 t90 -53.82 -39.17 65.29 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.579 -179.576 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 92.8 m-20 -61.64 -47.02 87.27 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 120.473 -0.491 . . . . 0.0 111.167 -179.431 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 36.5 tp -72.63 -54.58 8.68 Favored 'General case' 0 C--O 1.221 -0.444 0 C-N-CA 120.186 -0.606 . . . . 0.0 110.496 179.717 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -55.56 -26.09 18.99 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-O 120.765 0.317 . . . . 0.0 110.507 179.575 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 70.8 tttt -65.66 -51.46 59.33 Favored 'General case' 0 C--N 1.322 -0.613 0 C-N-CA 119.966 -0.693 . . . . 0.0 110.224 179.952 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . 0.401 ' O ' ' OE1' ' A' ' 88' ' ' GLU . 1.1 pp20? -80.07 -19.77 46.74 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.009 -179.498 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.443 HD23 ' CD1' ' A' ' 51' ' ' ILE . 14.6 tp -61.68 -44.37 97.08 Favored 'General case' 0 N--CA 1.446 -0.639 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.901 -179.142 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.503 HD12 ' CG1' ' A' ' 53' ' ' ILE . 3.4 mt -64.02 -43.78 97.65 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.109 0 C-N-CA 120.174 -0.611 . . . . 0.0 109.833 -179.406 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 95.8 m-20 -64.14 -14.84 57.76 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.65 -179.345 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 21.1 tttt -79.48 153.54 29.53 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.519 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -92.74 -9.44 40.65 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.777 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -63.2 -18.26 63.3 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.427 179.961 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 10.9 t -69.3 134.17 30.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.144 -179.732 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' ASN . . . . . 0.564 ' O ' ' N ' ' A' ' 98' ' ' GLN . 0.7 OUTLIER -55.42 161.23 3.04 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.889 -179.579 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_exo -42.61 -12.93 0.04 OUTLIER 'Trans proline' 0 N--CA 1.491 1.346 0 C-N-CA 123.006 2.471 . . . . 0.0 112.23 178.995 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . 0.564 ' N ' ' O ' ' A' ' 96' ' ' ASN . 2.2 pt20 . . . . . 0 C--N 1.321 -0.642 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.425 -179.672 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 58.6 p . . . . . 0 C--O 1.231 0.097 0 CA-C-O 120.766 0.317 . . . . 0.0 110.619 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 85.1 mt-10 -132.71 167.95 19.2 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.044 -179.741 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' GLU . . . . . 0.497 ' OE1' ' N ' ' A' ' 108' ' ' GLU . 57.1 mp0 -101.39 121.38 41.81 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.77 -0.456 . . . . 0.0 109.77 179.096 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 45.0 pt -46.34 -17.06 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.202 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.463 ' N ' ' C ' ' A' ' 108' ' ' GLU . 34.1 mt -63.82 -42.12 97.72 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.297 179.685 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . 0.433 ' O ' ' O ' ' A' ' 114' ' ' SER . 88.6 tttt -63.84 -44.28 93.67 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.527 179.437 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . 0.423 ' O ' ' O ' ' A' ' 111' ' ' LYS . 1.2 p 38.66 -161.44 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.877 179.921 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 113' ' ' ASN . . . . . 0.42 ' N ' ' OG ' ' A' ' 112' ' ' SER . 94.2 m-20 -63.62 -43.12 97.78 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.745 -179.52 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 114' ' ' SER . . . . . 0.433 ' O ' ' O ' ' A' ' 111' ' ' LYS . 6.4 m -93.9 129.05 40.49 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.277 179.96 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 84.9 mt-30 -86.92 34.58 0.67 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.838 0.351 . . . . 0.0 110.309 -179.776 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 64.1 p -65.75 -31.14 71.96 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.409 -179.858 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 97.0 m-20 . . . . . 0 C--N 1.327 -0.387 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.527 179.777 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.675 0 N-CA-C 110.873 -0.891 . . . . 0.0 110.873 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 86.7 mt-30 -63.72 -34.1 77.13 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.807 0.337 . . . . 0.0 110.709 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -46.96 -24.34 0.59 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.677 179.926 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 34.6 tp -48.99 -34.19 12.57 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-O 121.103 0.478 . . . . 0.0 110.232 -179.55 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 46.5 m -54.66 -37.78 66.13 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.115 179.871 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 97.5 mm-40 -62.79 -32.06 73.16 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.375 179.804 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 59.8 t-80 -60.63 -43.89 96.99 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.933 0.397 . . . . 0.0 110.376 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 81.2 tt0 -60.59 -51.28 70.1 Favored 'General case' 0 C--O 1.244 0.808 0 CA-C-O 121.335 0.588 . . . . 0.0 110.105 179.729 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.413 ' O ' ' CB ' ' A' ' 14' ' ' GLN . 76.3 mtt-85 -62.56 -31.52 72.33 Favored 'General case' 0 C--O 1.211 -0.938 0 CA-C-N 115.897 -0.592 . . . . 0.0 109.458 179.513 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.461 ' OH ' ' CD2' ' A' ' 89' ' ' LEU . 36.5 t80 -60.23 -37.59 80.81 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 120.936 -0.306 . . . . 0.0 110.326 -179.52 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 2.4 t -62.75 -49.69 82.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 C-N-CA 120.056 -0.657 . . . . 0.0 110.914 -179.803 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 95.6 mt-10 -79.25 -35.9 40.77 Favored 'General case' 0 C--N 1.326 -0.436 0 C-N-CA 120.398 -0.521 . . . . 0.0 111.682 -179.302 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . 0.413 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 70.9 tp60 -69.15 -52.39 28.58 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.199 -178.941 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.613 HD13 ' O ' ' A' ' 15' ' ' LEU . 0.3 OUTLIER -61.73 -45.64 93.05 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 -179.406 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.486 ' HB3' HG11 ' A' ' 26' ' ' VAL . 63.9 mttm -55.51 -35.94 66.15 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 120.482 -0.487 . . . . 0.0 110.156 179.486 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 77.3 mt-30 -71.87 -42.0 67.36 Favored 'General case' 0 C--O 1.241 0.641 0 CA-C-O 121.264 0.554 . . . . 0.0 110.552 178.64 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.59 ' O ' HG22 ' A' ' 21' ' ' THR . . . -54.23 -45.18 72.25 Favored 'General case' 0 C--O 1.223 -0.31 0 CA-C-N 115.788 -0.642 . . . . 0.0 109.599 179.93 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.503 ' O ' ' N ' ' A' ' 22' ' ' ARG . 4.4 mt -65.62 -37.9 87.88 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.856 0.36 . . . . 0.0 110.511 178.666 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 77.0 tttt -44.07 -36.74 2.69 Favored 'General case' 0 C--N 1.321 -0.637 0 C-N-CA 120.537 -0.465 . . . . 0.0 109.848 -179.44 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . 0.59 HG22 ' O ' ' A' ' 18' ' ' ALA . 1.2 t -63.27 -32.06 73.37 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.215 179.318 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.503 ' N ' ' O ' ' A' ' 19' ' ' LEU . 26.3 mmt-85 -73.46 19.53 0.1 Allowed 'General case' 0 N--CA 1.462 0.162 0 CA-C-O 120.959 0.409 . . . . 0.0 110.546 -179.715 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . 0.488 ' H ' ' C ' ' A' ' 21' ' ' THR . . . 81.45 15.34 76.49 Favored Glycine 0 CA--C 1.524 0.609 0 N-CA-C 110.625 -0.99 . . . . 0.0 110.625 179.974 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.451 HG12 ' H ' ' A' ' 25' ' ' LYS . 3.4 t -92.61 167.53 1.62 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 N-CA-C 110.097 -0.334 . . . . 0.0 110.097 -179.795 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.451 ' H ' HG12 ' A' ' 24' ' ' VAL . 55.5 mtmt -128.56 133.21 48.31 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 110.143 -0.317 . . . . 0.0 110.143 179.71 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.486 HG11 ' HB3' ' A' ' 16' ' ' LYS . 2.1 m -133.37 110.54 14.98 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.333 0 CA-C-N 116.62 -0.264 . . . . 0.0 110.512 179.854 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 25.7 pttt -108.92 165.15 11.79 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-O 120.615 0.245 . . . . 0.0 110.459 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 76.3 m-85 -48.52 -39.57 23.78 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.043 0.449 . . . . 0.0 110.318 179.941 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.421 ' HA ' HD12 ' A' ' 32' ' ' LEU . . . -55.69 -23.17 27.07 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.073 179.516 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.428 ' O ' ' CB ' ' A' ' 34' ' ' PHE . 44.7 t0 -62.14 -44.41 96.69 Favored 'General case' 0 C--O 1.221 -0.395 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.641 -179.719 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.483 ' O ' ' CB ' ' A' ' 35' ' ' PHE . 5.2 mp -68.08 -40.06 82.75 Favored 'General case' 0 C--O 1.218 -0.558 0 CA-C-O 121.099 0.476 . . . . 0.0 110.11 179.24 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.421 HD12 ' HA ' ' A' ' 29' ' ' ALA . 46.0 mt -58.84 -44.61 90.98 Favored 'General case' 0 C--N 1.317 -0.84 0 C-N-CA 119.856 -0.738 . . . . 0.0 110.862 -178.634 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.619 ' NZ ' ' CE2' ' A' ' 67' ' ' TYR . 88.3 tttt -85.61 -49.09 8.29 Favored 'General case' 0 C--N 1.321 -0.631 0 C-N-CA 120.741 -0.384 . . . . 0.0 111.704 -179.325 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . 0.428 ' CB ' ' O ' ' A' ' 30' ' ' ASP . 54.1 t80 -61.34 -50.52 72.6 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.927 -178.682 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.483 ' CB ' ' O ' ' A' ' 31' ' ' LEU . 6.1 t80 -61.83 -46.95 87.26 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.339 -179.685 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 90.8 m-20 -64.37 -36.18 83.31 Favored 'General case' 0 C--N 1.341 0.202 0 CA-C-O 120.747 0.308 . . . . 0.0 111.478 -179.617 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 1.8 m-85 -58.33 -45.47 88.02 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.854 -179.176 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.542 ' O ' ' N ' ' A' ' 42' ' ' CYS . 19.7 m -79.48 -39.05 20.26 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.871 179.97 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 85.9 tttt -55.21 -28.45 53.2 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.775 -179.229 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 96.5 m-20 -50.41 -63.28 1.17 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.389 -0.368 . . . . 0.0 111.134 -179.43 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.445 ' O ' ' SG ' ' A' ' 42' ' ' CYS . 22.9 p -114.51 4.48 15.23 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.983 -179.87 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . 0.542 ' N ' ' O ' ' A' ' 38' ' ' VAL . 19.5 p 41.29 54.68 7.9 Favored Pre-proline 0 C--N 1.331 -0.214 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.679 -179.109 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . 0.461 ' C ' ' H ' ' A' ' 45' ' ' PHE . 57.8 Cg_endo -72.93 -25.16 16.78 Favored 'Trans proline' 0 N--CA 1.491 1.352 0 C-N-CA 122.469 2.113 . . . . 0.0 112.142 -179.996 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 1.2 t-105 -61.53 -1.41 0.56 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.526 -179.52 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.461 ' H ' ' C ' ' A' ' 43' ' ' PRO . 4.8 t80 50.02 54.36 15.61 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-O 121.021 0.438 . . . . 0.0 110.087 -179.856 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.461 ' CD ' ' N ' ' A' ' 45' ' ' PHE . 29.5 Cg_endo -65.21 -10.55 26.24 Favored 'Trans proline' 0 C--N 1.308 -1.584 0 C-N-CA 122.863 2.375 . . . . 0.0 112.117 179.948 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 86.9 mt-30 -58.44 -52.39 65.84 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.248 -179.613 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 50.2 tt0 -88.81 -13.76 38.61 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.172 179.472 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 72.53 65.58 2.29 Favored Glycine 0 CA--C 1.522 0.528 0 N-CA-C 110.494 -1.042 . . . . 0.0 110.494 -179.3 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . 0.543 ' OG1' ' NE2' ' A' ' 98' ' ' GLN . 2.4 t -136.76 155.88 49.25 Favored 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 120.998 -0.281 . . . . 0.0 110.775 -179.536 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.5 mt -85.24 140.74 15.53 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-O 121.074 0.464 . . . . 0.0 110.537 179.308 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -110.78 121.47 45.43 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.474 -0.785 . . . . 0.0 110.995 179.378 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.473 ' CG1' HD12 ' A' ' 90' ' ' ILE . 32.6 mm -94.81 -56.53 5.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.203 179.324 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 68.6 mmtt -74.07 -49.04 25.82 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.359 -179.522 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 78.1 mtp85 -61.07 -35.17 76.23 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.212 -179.742 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 22.8 t-105 -61.94 -38.54 88.83 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.791 179.407 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 61.7 ttt85 -62.86 -39.05 93.23 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.276 -179.901 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -59.23 -50.75 72.82 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 120.89 -0.324 . . . . 0.0 111.103 -179.345 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 6.4 p -73.54 -36.85 48.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-O 120.84 0.352 . . . . 0.0 110.825 179.748 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . 0.428 ' O ' ' CB ' ' A' ' 64' ' ' GLN . . . -64.06 -54.85 27.66 Favored Glycine 0 C--O 1.223 -0.59 0 N-CA-C 111.438 -0.665 . . . . 0.0 111.438 -179.104 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 62.5 m-20 -63.35 -35.86 81.8 Favored 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 120.828 -0.349 . . . . 0.0 110.581 -179.536 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 3.8 m -64.01 -62.57 1.55 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.841 0.353 . . . . 0.0 111.355 -179.509 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 21.1 m-85 -63.5 -41.97 98.52 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.972 -179.701 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . 0.511 ' O ' ' ND2' ' A' ' 68' ' ' ASN . 56.7 tt0 -62.92 -42.21 99.72 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.877 -179.582 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 24.5 t0 -54.7 -56.75 15.85 Favored 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 120.476 -0.49 . . . . 0.0 110.944 -179.61 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 65.2 m-85 -64.46 -41.47 96.49 Favored 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 120.678 -0.409 . . . . 0.0 110.787 179.846 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . 0.619 ' CE2' ' NZ ' ' A' ' 33' ' ' LYS . 65.6 t80 -57.61 -41.0 80.4 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.618 -179.403 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . 0.526 ' CG ' HG21 ' A' ' 75' ' ' VAL . 3.1 m120 -62.15 -43.82 97.99 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.122 -179.075 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 81.1 p -77.69 -18.64 56.42 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.238 -179.812 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 34.9 m-85 -109.73 16.09 22.32 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.381 179.933 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -160.41 -108.32 0.23 Allowed Glycine 0 CA--C 1.532 1.147 0 C-N-CA 120.539 -0.838 . . . . 0.0 111.213 -179.947 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 65.3 Cg_endo -73.71 141.49 30.84 Favored 'Trans proline' 0 N--CA 1.497 1.715 0 C-N-CA 121.98 1.787 . . . . 0.0 113.211 -179.487 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 81.5 tt0 -86.44 -43.38 12.84 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.548 179.343 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.664 ' CD ' ' H ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -82.75 -26.67 31.67 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 115.892 -0.595 . . . . 0.0 111.326 -179.46 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.535 ' H ' ' HD3' ' A' ' 74' ' ' LYS . 87.5 t 57.38 115.57 0.02 OUTLIER Pre-proline 0 N--CA 1.45 -0.436 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.683 -179.554 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_exo -53.73 127.84 27.1 Favored 'Trans proline' 0 N--CA 1.495 1.576 0 C-N-CA 121.473 1.449 . . . . 0.0 111.697 179.74 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.523 ' O ' HG12 ' A' ' 77' ' ' VAL . 61.1 t -82.65 -7.42 10.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.98 179.827 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 68.2 p -48.95 -22.02 0.77 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.549 -179.455 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.06 -27.06 68.63 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.532 179.722 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 34.6 t80 -60.95 -40.44 93.34 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.147 -179.815 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 20.9 m -57.98 -42.08 84.35 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.527 -179.687 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 13.5 m-85 -57.35 -53.8 54.03 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.772 -0.371 . . . . 0.0 110.621 -179.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' TRP . . . . . 0.484 ' C ' ' CD1' ' A' ' 83' ' ' TRP . 9.0 t-105 -56.39 -40.55 74.81 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.499 -179.983 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 83.8 m-20 -61.27 -45.41 94.61 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 120.484 -0.486 . . . . 0.0 111.111 -179.01 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 42.4 tp -72.83 -57.62 3.94 Favored 'General case' 0 C--O 1.218 -0.567 0 C-N-CA 120.337 -0.545 . . . . 0.0 110.574 179.84 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -53.75 -26.41 13.68 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 C-N-CA 120.733 -0.387 . . . . 0.0 110.379 179.452 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.415 ' CB ' ' O ' ' A' ' 83' ' ' TRP . 64.2 tttt -65.44 -50.93 63.56 Favored 'General case' 0 C--N 1.322 -0.608 0 C-N-CA 120.404 -0.519 . . . . 0.0 110.393 179.938 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . 0.434 ' O ' ' OD1' ' A' ' 91' ' ' ASP . 1.1 pp20? -80.75 -19.71 44.33 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.774 179.954 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.461 ' CD2' ' OH ' ' A' ' 11' ' ' TYR . 12.6 tp -62.17 -43.76 98.12 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.322 -178.746 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.473 HD12 ' CG1' ' A' ' 53' ' ' ILE . 3.1 mt -63.69 -45.47 97.33 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 C-N-CA 120.271 -0.572 . . . . 0.0 110.847 -178.783 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . 0.434 ' OD1' ' O ' ' A' ' 88' ' ' GLU . 4.4 p30 -81.64 -4.92 57.45 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.433 -0.348 . . . . 0.0 111.075 -178.757 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . 0.471 ' O ' ' CB ' ' A' ' 93' ' ' LYS . 86.4 tttt -57.24 -15.71 6.59 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.633 -179.904 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . 0.471 ' CB ' ' O ' ' A' ' 92' ' ' LYS . 59.4 tttt 79.63 -68.11 0.13 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.731 179.805 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 70.3 tt0 -73.94 54.7 0.52 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.057 0.456 . . . . 0.0 110.005 -179.741 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.441 ' O ' ' O ' ' A' ' 96' ' ' ASN . 1.9 t -87.46 164.76 2.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.4 -179.636 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' ASN . . . . . 0.641 ' H ' ' ND2' ' A' ' 96' ' ' ASN . 0.0 OUTLIER -42.19 167.04 0.07 OUTLIER Pre-proline 0 C--N 1.327 -0.395 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.353 179.731 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 77.0 Cg_exo -40.38 -14.01 0.03 OUTLIER 'Trans proline' 0 C--N 1.312 -1.386 0 C-N-CA 122.844 2.363 . . . . 0.0 112.485 179.174 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . 0.601 ' N ' ' O ' ' A' ' 96' ' ' ASN . 12.1 tt0 . . . . . 0 C--N 1.322 -0.629 0 C-N-CA 120.799 -0.361 . . . . 0.0 110.174 179.17 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 45.3 p . . . . . 0 N--CA 1.458 -0.072 0 CA-C-O 120.865 0.364 . . . . 0.0 110.698 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 46.4 mm-40 -74.93 155.02 37.88 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.605 -179.836 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' GLU . . . . . 0.553 ' C ' ' H ' ' A' ' 110' ' ' LEU . 99.3 mt-10 -89.85 135.11 33.83 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.177 179.536 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 47.3 pt -59.14 0.77 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 115.965 -0.562 . . . . 0.0 110.201 179.564 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.553 ' H ' ' C ' ' A' ' 108' ' ' GLU . 96.6 mt -100.73 -9.43 21.8 Favored 'General case' 0 C--N 1.334 -0.097 0 C-N-CA 120.592 -0.443 . . . . 0.0 110.507 -179.857 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . 0.454 ' O ' ' O ' ' A' ' 114' ' ' SER . 86.3 tttt -71.3 -13.38 61.87 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.676 179.927 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 11.7 t -58.93 -45.38 90.53 Favored 'General case' 0 C--N 1.326 -0.45 0 C-N-CA 120.724 -0.391 . . . . 0.0 110.613 -179.895 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 13.4 m120 -64.54 -41.89 96.07 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.867 -179.785 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 114' ' ' SER . . . . . 0.454 ' O ' ' O ' ' A' ' 111' ' ' LYS . 35.5 t -158.5 177.99 10.63 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.468 -179.815 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 95.5 mt-30 -53.5 -41.52 66.37 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.945 0.402 . . . . 0.0 110.467 -179.812 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 62.8 p -146.75 162.88 37.63 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.571 179.749 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 . . . . . 0 C--N 1.33 -0.268 0 C-N-CA 120.92 -0.312 . . . . 0.0 110.517 179.452 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.695 0 N-CA-C 111.134 -0.787 . . . . 0.0 111.134 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 99.3 mm-40 -56.92 -28.43 62.01 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.819 0.342 . . . . 0.0 110.34 -179.799 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . 0.499 ' O ' ' N ' ' A' ' 7' ' ' GLN . 91.0 mt-10 -57.67 -21.54 40.74 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.563 179.853 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 49.9 tp -40.46 -30.3 0.11 Allowed 'General case' 0 C--O 1.234 0.279 0 CA-C-O 121.004 0.431 . . . . 0.0 110.358 -179.31 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 16.3 t -59.88 -42.43 93.74 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 120.693 -0.403 . . . . 0.0 109.924 179.42 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . 0.499 ' N ' ' O ' ' A' ' 4' ' ' GLU . 87.0 mt-30 -61.39 -35.42 77.43 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.666 179.689 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 63.3 t60 -57.33 -44.1 83.95 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.059 -179.822 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 81.0 mm-40 -61.33 -45.22 95.35 Favored 'General case' 0 C--O 1.241 0.651 0 CA-C-O 121.061 0.457 . . . . 0.0 110.007 179.648 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.427 ' O ' ' CB ' ' A' ' 14' ' ' GLN . 64.5 mtp85 -64.41 -33.25 75.43 Favored 'General case' 0 C--O 1.212 -0.871 0 N-CA-C 109.22 -0.659 . . . . 0.0 109.22 179.636 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.478 ' CE1' HD23 ' A' ' 15' ' ' LEU . 53.4 t80 -60.09 -37.77 80.93 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 120.554 -0.458 . . . . 0.0 110.365 -179.52 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 4.5 t -61.62 -49.44 84.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 C-N-CA 120.056 -0.658 . . . . 0.0 111.048 179.935 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 80.9 mm-40 -80.72 -43.05 20.89 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 120.33 -0.548 . . . . 0.0 111.659 -179.33 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . 0.427 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 69.1 tp60 -61.36 -52.75 63.34 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.881 -0.6 . . . . 0.0 111.325 -178.977 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.595 HD13 ' O ' ' A' ' 15' ' ' LEU . 0.2 OUTLIER -63.21 -45.27 92.45 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 120.649 -0.42 . . . . 0.0 110.086 -179.613 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.532 ' HB3' HG11 ' A' ' 26' ' ' VAL . 92.0 mttt -58.16 -33.57 69.36 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 120.674 -0.411 . . . . 0.0 110.527 179.236 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 76.8 mt-30 -71.95 -41.68 67.48 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.178 0.513 . . . . 0.0 110.446 178.664 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.543 ' O ' HG22 ' A' ' 21' ' ' THR . . . -55.12 -42.98 73.68 Favored 'General case' 0 C--O 1.222 -0.368 0 CA-C-N 116.074 -0.512 . . . . 0.0 109.69 179.843 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.453 ' O ' ' N ' ' A' ' 22' ' ' ARG . 5.0 mt -66.62 -37.96 85.94 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.995 0.426 . . . . 0.0 110.703 178.579 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 61.6 tttm -45.61 -37.36 5.52 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 -179.62 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . 0.543 HG22 ' O ' ' A' ' 18' ' ' ALA . 1.0 OUTLIER -61.14 -33.18 73.0 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.01 179.392 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.453 ' N ' ' O ' ' A' ' 19' ' ' LEU . 10.3 mmm180 -72.93 15.63 0.19 Allowed 'General case' 0 N--CA 1.464 0.266 0 CA-C-O 120.868 0.366 . . . . 0.0 110.41 -179.633 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . 0.471 ' H ' ' C ' ' A' ' 21' ' ' THR . . . 84.41 13.67 72.94 Favored Glycine 0 CA--C 1.525 0.696 0 N-CA-C 110.561 -1.016 . . . . 0.0 110.561 -179.872 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.549 HG12 ' N ' ' A' ' 25' ' ' LYS . 11.7 t -88.01 167.65 1.69 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 N-CA-C 110.314 -0.254 . . . . 0.0 110.314 179.993 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.549 ' N ' HG12 ' A' ' 24' ' ' VAL . 88.8 tttt -130.0 129.85 44.25 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.214 179.616 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.532 HG11 ' HB3' ' A' ' 16' ' ' LYS . 3.6 m -128.15 108.56 17.99 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.307 0 CA-C-N 116.503 -0.317 . . . . 0.0 110.543 -179.884 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.564 ' HD3' ' H ' ' A' ' 29' ' ' ALA . 12.5 tmtt? -109.49 165.22 11.82 Favored 'General case' 0 CA--C 1.527 0.074 0 N-CA-C 109.959 -0.385 . . . . 0.0 109.959 -179.824 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 89.8 m-85 -47.06 -35.94 7.5 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.923 0.392 . . . . 0.0 110.246 -179.973 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.564 ' H ' ' HD3' ' A' ' 27' ' ' LYS . . . -57.95 -24.03 56.25 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 121.185 0.517 . . . . 0.0 110.042 179.452 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 65.9 t0 -60.66 -48.36 82.14 Favored 'General case' 0 C--O 1.222 -0.367 0 CA-C-N 115.606 -0.724 . . . . 0.0 110.594 -179.697 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.539 ' H ' HD12 ' A' ' 31' ' ' LEU . 5.4 mp -63.72 -42.09 97.98 Favored 'General case' 0 C--O 1.217 -0.631 0 CA-C-O 121.048 0.452 . . . . 0.0 110.155 179.448 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.418 ' H ' ' HG ' ' A' ' 32' ' ' LEU . 30.4 mt -59.29 -44.95 92.45 Favored 'General case' 0 C--N 1.31 -1.119 0 C-N-CA 119.332 -0.947 . . . . 0.0 110.423 -178.892 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.465 ' O ' ' CD1' ' A' ' 37' ' ' PHE . 99.7 mttt -73.96 -41.68 61.62 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.075 -0.511 . . . . 0.0 112.366 -179.189 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . 0.863 ' O ' HG22 ' A' ' 38' ' ' VAL . 5.1 m-85 -83.07 -61.59 1.82 Allowed 'General case' 0 CA--C 1.511 -0.534 0 C-N-CA 120.738 -0.385 . . . . 0.0 111.214 -178.664 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.504 ' CB ' ' O ' ' A' ' 31' ' ' LEU . 17.1 t80 -41.98 -45.91 3.97 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.198 -179.322 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 80.1 m-20 -72.74 -41.49 65.08 Favored 'General case' 0 CA--C 1.529 0.164 0 C-N-CA 120.291 -0.564 . . . . 0.0 111.809 -179.44 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.465 ' CD1' ' O ' ' A' ' 33' ' ' LYS . 3.5 m-30 -63.34 -51.13 67.26 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 111.975 0.361 . . . . 0.0 111.975 -178.037 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.863 HG22 ' O ' ' A' ' 34' ' ' PHE . 6.5 m -67.68 -42.65 86.64 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.716 -179.563 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -65.47 -30.57 71.37 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.137 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 57.2 t0 -54.21 -49.23 69.88 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 120.84 -0.344 . . . . 0.0 110.544 -179.233 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 9.5 p -109.2 -8.67 15.09 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.037 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . 0.536 ' N ' ' O ' ' A' ' 38' ' ' VAL . 16.9 m 42.43 55.9 10.3 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.498 -179.526 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . 0.53 ' C ' ' H ' ' A' ' 45' ' ' PHE . 74.3 Cg_endo -78.33 -26.63 5.99 Favored 'Trans proline' 0 N--CA 1.491 1.361 0 C-N-CA 122.491 2.127 . . . . 0.0 112.997 -179.358 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . 0.413 ' CH2' ' CE3' ' A' ' 56' ' ' TRP . 0.0 OUTLIER -71.78 22.49 0.05 OUTLIER 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.968 -179.624 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.53 ' H ' ' C ' ' A' ' 43' ' ' PRO . 33.6 t80 40.03 61.63 6.16 Favored Pre-proline 0 C--N 1.326 -0.423 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.214 -179.091 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.468 ' HD3' ' N ' ' A' ' 45' ' ' PHE . 32.4 Cg_exo -60.39 -12.1 19.11 Favored 'Trans proline' 0 N--CA 1.496 1.657 0 C-N-CA 122.654 2.236 . . . . 0.0 112.257 -179.68 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 88.6 mt-30 -53.31 -53.96 43.32 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 120.534 -0.466 . . . . 0.0 110.45 -179.01 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 34.0 tp10 -88.93 -29.46 19.55 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.886 -0.413 . . . . 0.0 109.886 178.819 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 83.9 61.77 1.82 Allowed Glycine 0 CA--C 1.528 0.847 0 N-CA-C 110.01 -1.236 . . . . 0.0 110.01 -178.33 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 13.8 t -131.2 169.91 15.29 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-O 120.664 0.269 . . . . 0.0 110.524 -179.115 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.1 mt -87.02 132.14 33.21 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.314 0 C-N-CA 120.709 -0.397 . . . . 0.0 110.228 178.939 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -118.37 121.0 39.29 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.221 179.54 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 16.8 mm -91.74 -47.07 14.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.195 -179.578 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.449 ' HA ' ' HE ' ' A' ' 57' ' ' ARG . 88.3 tttt -64.11 -48.93 74.22 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-O 121.01 0.433 . . . . 0.0 111.152 -179.398 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 78.6 mmt-85 -64.7 -33.58 76.29 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.116 -179.745 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' TRP . . . . . 0.413 ' CE3' ' CH2' ' A' ' 44' ' ' TRP . 37.5 t-105 -59.81 -39.87 86.46 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-O 120.955 0.407 . . . . 0.0 110.269 -179.803 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.449 ' HE ' ' HA ' ' A' ' 54' ' ' LYS . 87.7 mtm180 -64.67 -38.34 90.67 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.453 -179.922 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 68.4 mmt-85 -60.59 -51.69 68.34 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.824 -0.35 . . . . 0.0 111.218 -179.643 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 3.5 p -66.16 -35.52 75.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.329 179.707 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -66.96 -45.03 87.07 Favored Glycine 0 CA--C 1.526 0.733 0 N-CA-C 111.246 -0.742 . . . . 0.0 111.246 179.867 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 99.8 m-20 -63.34 -43.84 96.57 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.718 0.294 . . . . 0.0 111.28 -179.577 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 74.8 m -64.14 -47.42 80.01 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.012 0.434 . . . . 0.0 110.557 -179.738 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 8.0 m-85 -66.4 -33.85 76.63 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.534 179.55 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 70.4 tp60 -57.69 -43.07 84.84 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.843 0.354 . . . . 0.0 110.295 -179.831 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -62.92 -52.8 61.65 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.922 0.391 . . . . 0.0 110.542 179.612 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' TYR . . . . . 0.413 ' O ' ' OG1' ' A' ' 69' ' ' THR . 38.7 m-85 -65.03 -25.23 67.75 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.476 179.399 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 61.5 t80 -65.5 -45.13 84.78 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.424 -179.912 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 88.6 m-20 -64.4 -39.45 93.87 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.592 -179.523 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.413 ' OG1' ' O ' ' A' ' 66' ' ' TYR . 82.2 p -49.77 -35.62 23.06 Favored 'General case' 0 C--N 1.324 -0.53 0 C-N-CA 120.578 -0.449 . . . . 0.0 111.159 -179.039 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 14.9 m-85 -67.36 -46.56 73.01 Favored 'General case' 0 C--N 1.321 -0.653 0 C-N-CA 119.888 -0.725 . . . . 0.0 111.056 -179.09 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . 0.509 ' H ' ' HD3' ' A' ' 72' ' ' PRO . . . 112.6 71.91 0.6 Allowed Glycine 0 N--CA 1.471 1.003 0 N-CA-C 110.952 -0.859 . . . . 0.0 110.952 -179.933 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . 0.509 ' HD3' ' H ' ' A' ' 71' ' ' GLY . 25.1 Cg_exo -62.02 143.69 95.36 Favored 'Trans proline' 0 N--CA 1.498 1.766 0 C-N-CA 123.247 2.631 . . . . 0.0 111.379 179.809 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 83.5 tt0 -74.93 -49.79 18.99 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-O 120.874 0.368 . . . . 0.0 110.544 -179.728 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.513 ' HD3' ' H ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -138.46 4.42 2.4 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.594 -179.547 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 63.8 t 57.42 92.97 0.06 OUTLIER Pre-proline 0 CA--C 1.534 0.331 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.068 -178.632 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_exo -54.15 125.71 19.71 Favored 'Trans proline' 0 N--CA 1.491 1.348 0 C-N-CA 121.722 1.615 . . . . 0.0 112.303 -178.982 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.456 ' O ' ' N ' ' A' ' 80' ' ' PHE . 43.6 t -84.67 -20.22 8.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.773 179.313 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 57.9 p -41.54 -27.49 0.1 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.585 -179.031 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . 0.409 ' N ' ' O ' ' A' ' 77' ' ' VAL . . . -62.39 -39.91 94.78 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.12 0.486 . . . . 0.0 110.64 179.839 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . 0.456 ' N ' ' O ' ' A' ' 77' ' ' VAL . 3.3 m-85 -62.19 -35.89 80.22 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.428 179.907 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 54.2 p -60.22 -40.04 88.74 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.244 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 13.7 m-85 -60.6 -53.4 57.95 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 120.696 -0.402 . . . . 0.0 110.707 179.816 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' TRP . . . . . . . . . . . . . 31.0 t90 -58.25 -38.68 77.4 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.738 179.806 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 82.3 m-20 -62.01 -45.7 92.43 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 120.684 -0.406 . . . . 0.0 110.957 -179.536 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 43.5 tp -71.45 -54.0 12.11 Favored 'General case' 0 C--O 1.218 -0.561 0 C-N-CA 120.439 -0.505 . . . . 0.0 110.466 179.606 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -57.23 -26.36 25.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-O 120.794 0.33 . . . . 0.0 110.61 179.622 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 66.4 tttt -65.59 -50.84 63.59 Favored 'General case' 0 C--N 1.32 -0.692 0 C-N-CA 120.32 -0.552 . . . . 0.0 110.107 -179.839 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . 0.438 ' OE1' ' O ' ' A' ' 88' ' ' GLU . 1.0 OUTLIER -80.38 -20.03 45.0 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.84 -179.815 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.419 HD12 ' HA ' ' A' ' 89' ' ' LEU . 14.1 tp -61.42 -44.42 97.17 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.47 -179.245 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 3.2 mt -63.52 -43.47 98.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 C-N-CA 120.25 -0.58 . . . . 0.0 109.841 -179.66 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 68.0 t0 -53.0 -43.46 66.49 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.751 -178.739 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 68.2 mmtt -62.5 134.91 57.07 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.954 0.406 . . . . 0.0 110.413 -179.779 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . 0.443 ' C ' ' H ' ' A' ' 95' ' ' VAL . 98.6 mttt -72.52 -9.87 59.09 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.539 -179.921 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 80.3 mm-40 -72.34 43.56 0.11 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.561 179.904 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.443 ' H ' ' C ' ' A' ' 93' ' ' LYS . 5.7 m -120.03 132.43 69.73 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.19 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.42 179.874 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' ASN . . . . . 0.432 HD22 ' HD2' ' A' ' 97' ' ' PRO . 0.7 OUTLIER -49.21 158.82 0.68 Allowed Pre-proline 0 C--N 1.327 -0.389 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.493 -179.628 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' PRO . . . . . 0.432 ' HD2' HD22 ' A' ' 96' ' ' ASN . 19.2 Cg_endo -60.55 -12.64 21.79 Favored 'Trans proline' 0 N--CA 1.495 1.59 0 C-N-CA 122.829 2.353 . . . . 0.0 112.061 179.543 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 8.6 pt20 . . . . . 0 C--N 1.323 -0.56 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.785 -179.711 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 75.2 p . . . . . 0 N--CA 1.46 0.071 0 CA-C-O 120.905 0.383 . . . . 0.0 110.762 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . 0.525 ' OE1' ' N ' ' A' ' 107' ' ' GLU . 44.3 mp0 -139.71 167.26 22.5 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.349 -179.752 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' GLU . . . . . 0.461 ' C ' ' N ' ' A' ' 110' ' ' LEU . 81.2 mm-40 -94.21 128.86 40.91 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.071 179.49 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 45.4 pt -47.23 -15.85 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.187 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.461 ' N ' ' C ' ' A' ' 108' ' ' GLU . 34.8 mt -64.01 -42.86 97.01 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.367 179.767 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -70.52 -32.33 69.75 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.542 179.692 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 14.2 t -58.91 -45.77 89.51 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.908 -178.973 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 32.0 t30 -66.37 -46.59 76.17 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.871 0.367 . . . . 0.0 110.858 179.801 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 31.2 p -162.28 158.81 24.78 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.61 179.785 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 84.4 mt-30 -99.06 13.04 34.22 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.79 0.329 . . . . 0.0 110.382 179.769 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 14.8 m -59.23 -47.59 84.8 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.147 -179.751 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 99.4 m-20 . . . . . 0 C--N 1.329 -0.285 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.568 179.543 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.682 0 N-CA-C 111.033 -0.827 . . . . 0.0 111.033 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 87.6 mt-30 -61.78 -23.22 66.05 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.902 0.382 . . . . 0.0 110.315 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 34.1 tp10 -51.92 -21.68 3.21 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.519 179.898 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.48 ' O ' ' OE1' ' A' ' 9' ' ' GLU . 33.6 tp -41.07 -39.59 1.27 Allowed 'General case' 0 C--O 1.235 0.312 0 CA-C-O 121.026 0.441 . . . . 0.0 110.284 -179.348 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 89.9 p -47.53 -36.76 10.9 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 120.758 -0.377 . . . . 0.0 110.244 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 72.3 tp60 -63.77 -32.46 73.97 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.467 179.608 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 53.9 t60 -59.24 -44.8 92.35 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 120.664 -0.414 . . . . 0.0 110.235 -179.932 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.48 ' OE1' ' O ' ' A' ' 5' ' ' LEU . 56.5 mp0 -61.73 -49.19 77.44 Favored 'General case' 0 C--O 1.244 0.77 0 C-N-CA 120.36 -0.536 . . . . 0.0 110.342 179.707 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.442 ' O ' ' CB ' ' A' ' 14' ' ' GLN . 75.3 mtm-85 -63.8 -31.73 73.0 Favored 'General case' 0 C--O 1.211 -0.968 0 C-N-CA 120.19 -0.604 . . . . 0.0 109.429 179.485 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 31.5 t80 -59.86 -36.69 77.4 Favored 'General case' 0 C--N 1.323 -0.575 0 C-N-CA 120.889 -0.324 . . . . 0.0 110.315 -179.664 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 4.0 t -63.78 -49.34 82.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 C-N-CA 120.077 -0.649 . . . . 0.0 111.196 179.924 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -81.22 -34.28 32.3 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 120.438 -0.505 . . . . 0.0 111.874 -179.265 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . 0.442 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 70.5 tp60 -70.39 -52.98 18.51 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.049 -178.93 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.573 HD13 ' O ' ' A' ' 15' ' ' LEU . 0.2 OUTLIER -62.7 -47.01 85.49 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 109.988 -0.375 . . . . 0.0 109.988 -179.501 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.431 ' HB3' HG11 ' A' ' 26' ' ' VAL . 97.0 mttt -57.32 -32.73 66.99 Favored 'General case' 0 C--N 1.33 -0.257 0 C-N-CA 120.667 -0.413 . . . . 0.0 110.143 179.355 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 56.1 tt0 -71.05 -37.6 72.53 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.98 0.419 . . . . 0.0 110.467 179.304 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -58.14 -36.97 73.75 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.184 -179.858 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.4 mt -82.16 -27.04 32.91 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.01 0.433 . . . . 0.0 110.48 179.376 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -55.77 -37.73 68.93 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.072 -179.783 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . 0.424 HG22 ' H ' ' A' ' 21' ' ' THR . 1.3 t -76.56 -20.82 56.44 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.633 179.817 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 61.0 mmt-85 -73.7 -3.31 27.52 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 120.769 0.318 . . . . 0.0 110.308 179.67 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 107.0 19.67 9.37 Favored Glycine 0 CA--C 1.526 0.747 0 N-CA-C 110.728 -0.949 . . . . 0.0 110.728 -179.601 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.613 HG12 ' N ' ' A' ' 25' ' ' LYS . 26.2 t -105.35 167.43 3.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 N-CA-C 110.327 -0.249 . . . . 0.0 110.327 -179.934 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.613 ' N ' HG12 ' A' ' 24' ' ' VAL . 99.6 mttt -125.86 131.99 52.28 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.348 179.359 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.431 HG11 ' HB3' ' A' ' 16' ' ' LYS . 1.7 m -134.79 108.94 11.09 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.289 0 CA-C-N 116.506 -0.315 . . . . 0.0 110.355 179.838 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.6 ' HD3' ' H ' ' A' ' 29' ' ' ALA . 14.5 tmtt? -109.25 161.72 14.97 Favored 'General case' 0 C--O 1.221 -0.398 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 179.976 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.478 ' CE2' HD21 ' A' ' 32' ' ' LEU . 58.0 t80 -40.58 -29.58 0.09 Allowed 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.095 0.474 . . . . 0.0 110.966 179.588 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.6 ' H ' ' HD3' ' A' ' 27' ' ' LYS . . . -60.65 -24.44 65.56 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.835 -179.797 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.84 -45.77 91.05 Favored 'General case' 0 C--O 1.221 -0.426 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.406 -179.335 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.494 ' H ' HD12 ' A' ' 31' ' ' LEU . 5.5 mp -64.77 -41.03 96.17 Favored 'General case' 0 C--O 1.216 -0.693 0 CA-C-O 120.989 0.423 . . . . 0.0 110.156 179.591 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.478 HD21 ' CE2' ' A' ' 28' ' ' TYR . 56.2 mt -55.34 -46.1 76.4 Favored 'General case' 0 C--N 1.316 -0.869 0 C-N-CA 119.453 -0.899 . . . . 0.0 111.118 -178.765 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 63.9 tttm -84.68 -50.45 7.63 Favored 'General case' 0 C--N 1.32 -0.676 0 C-N-CA 120.496 -0.482 . . . . 0.0 111.771 -179.25 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . 0.441 ' O ' HG22 ' A' ' 38' ' ' VAL . 74.9 t80 -61.16 -50.42 73.25 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.312 -178.786 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.485 ' CB ' ' O ' ' A' ' 31' ' ' LEU . 17.7 t80 -60.75 -46.12 91.66 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.29 -179.36 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 91.7 m-20 -70.17 -25.27 63.36 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 120.601 -0.44 . . . . 0.0 111.339 -179.541 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -65.03 -53.43 46.05 Favored 'General case' 0 N--CA 1.462 0.143 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.593 -179.074 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.505 ' O ' ' N ' ' A' ' 42' ' ' CYS . 2.6 m -72.86 -39.46 58.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 C-N-CA 120.481 -0.488 . . . . 0.0 111.037 -179.579 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 25.1 mmtt -57.93 -25.82 61.4 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.724 -179.528 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 85.3 m-20 -49.84 -63.6 1.06 Allowed 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 120.684 -0.406 . . . . 0.0 111.004 179.933 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.4 ' C ' ' SG ' ' A' ' 42' ' ' CYS . 1.6 p -114.59 -11.01 12.45 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.538 -0.301 . . . . 0.0 111.319 -179.939 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . 0.505 ' N ' ' O ' ' A' ' 38' ' ' VAL . 1.5 m 63.72 47.35 0.77 Allowed Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.697 -179.385 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . 0.499 ' CD ' ' N ' ' A' ' 42' ' ' CYS . 57.9 Cg_endo -72.23 -30.45 13.03 Favored 'Trans proline' 0 N--CA 1.493 1.458 0 C-N-CA 122.699 2.266 . . . . 0.0 112.432 179.928 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . 0.429 ' HE1' ' HA ' ' A' ' 51' ' ' ILE . 2.0 t-105 -58.32 -3.41 0.27 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.433 -179.643 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.494 ' H ' ' C ' ' A' ' 43' ' ' PRO . 2.9 t80 50.45 53.45 14.06 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.168 0.508 . . . . 0.0 110.16 -179.837 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.477 ' CD ' ' N ' ' A' ' 45' ' ' PHE . 38.3 Cg_endo -67.94 -12.35 35.01 Favored 'Trans proline' 0 C--N 1.308 -1.602 0 C-N-CA 122.835 2.357 . . . . 0.0 112.065 179.846 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 52.9 tt0 -59.11 -46.43 88.35 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.194 -179.688 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 44.9 tt0 -89.27 -18.03 27.82 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.029 0.443 . . . . 0.0 110.332 179.584 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 77.11 66.56 1.79 Allowed Glycine 0 CA--C 1.525 0.696 0 N-CA-C 110.247 -1.141 . . . . 0.0 110.247 -178.921 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . 0.506 ' OG1' ' NE2' ' A' ' 98' ' ' GLN . 2.9 t -138.0 155.67 48.61 Favored 'General case' 0 C--N 1.33 -0.282 0 C-N-CA 121.043 -0.263 . . . . 0.0 110.658 -179.548 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.429 ' HA ' ' HE1' ' A' ' 44' ' ' TRP . 1.5 mt -87.7 140.6 15.54 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.2 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.305 179.3 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . 0.432 ' OD2' ' O ' ' A' ' 43' ' ' PRO . 69.8 m-20 -111.14 120.12 41.25 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.191 179.631 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.511 ' CG1' HD12 ' A' ' 90' ' ' ILE . 24.9 mm -94.78 -56.07 5.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.893 179.215 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -78.0 -49.41 14.12 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.561 -179.464 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.569 ' CG ' HH21 ' A' ' 58' ' ' ARG . 83.8 mtt85 -59.95 -32.59 70.95 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.132 -0.486 . . . . 0.0 109.958 -179.708 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' TRP . . . . . 0.748 ' HE1' ' HE1' ' A' ' 83' ' ' TRP . 18.2 t-105 -62.89 -39.9 95.91 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.52 179.359 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 83.6 mtp180 -63.48 -35.24 79.8 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.444 -179.794 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . 0.569 HH21 ' CG ' ' A' ' 55' ' ' ARG . 43.6 mtm-85 -60.16 -50.92 71.77 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 120.509 -0.476 . . . . 0.0 111.006 -179.96 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.405 HG13 ' N ' ' A' ' 60' ' ' GLY . 7.4 p -73.96 -39.48 51.39 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.377 0 C-N-CA 120.861 -0.335 . . . . 0.0 110.644 179.581 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . 0.433 ' O ' ' CB ' ' A' ' 64' ' ' GLN . . . -63.07 -49.21 73.67 Favored Glycine 0 C--O 1.222 -0.634 0 N-CA-C 111.353 -0.699 . . . . 0.0 111.353 -179.225 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 66.2 t0 -61.82 -44.87 95.99 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 120.625 0.25 . . . . 0.0 111.156 -179.497 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' CYS . . . . . 0.436 ' SG ' ' O ' ' A' ' 58' ' ' ARG . 73.3 m -62.9 -55.83 22.57 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.207 -179.227 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 12.6 m-85 -64.22 -43.23 95.63 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.1 -179.821 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . 0.433 ' CB ' ' O ' ' A' ' 60' ' ' GLY . 61.3 tt0 -62.37 -39.82 94.43 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.651 -179.45 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -57.01 -54.07 50.93 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 120.765 -0.374 . . . . 0.0 110.849 -179.865 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 66.4 m-85 -67.86 -39.77 83.72 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.706 179.764 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . 0.523 ' O ' ' N ' ' A' ' 71' ' ' GLY . 57.1 t80 -58.75 -41.88 87.52 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.427 -179.501 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . 0.409 ' CG ' ' O ' ' A' ' 64' ' ' GLN . 4.4 m120 -62.79 -45.29 93.35 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.331 -178.964 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 24.6 p -74.98 -20.12 59.8 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 120.608 -0.437 . . . . 0.0 109.985 -179.433 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 47.6 m-85 -114.11 16.28 18.14 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.401 179.945 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . 0.523 ' N ' ' O ' ' A' ' 67' ' ' TYR . . . -154.18 -111.03 0.41 Allowed Glycine 0 CA--C 1.534 1.239 0 N-CA-C 111.06 -0.816 . . . . 0.0 111.06 -179.984 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -73.06 140.1 30.78 Favored 'Trans proline' 0 N--CA 1.494 1.548 0 C-N-CA 121.989 1.793 . . . . 0.0 113.177 -179.34 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 80.7 mm-40 -86.28 -42.84 13.41 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.487 179.326 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.694 ' CD ' ' H ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -80.78 -24.63 38.48 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.027 179.933 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.498 ' H ' ' HD3' ' A' ' 74' ' ' LYS . 75.2 t 53.91 101.04 0.03 OUTLIER Pre-proline 0 N--CA 1.449 -0.481 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.189 -179.719 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 44.5 Cg_exo -55.05 129.28 34.44 Favored 'Trans proline' 0 N--CA 1.492 1.413 0 C-N-CA 121.666 1.578 . . . . 0.0 111.758 179.845 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.504 ' O ' HG12 ' A' ' 77' ' ' VAL . 48.3 t -82.31 -6.81 10.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.835 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 43.2 p -44.26 -23.23 0.09 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.64 -179.817 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . 0.407 ' N ' ' C ' ' A' ' 77' ' ' VAL . . . -57.62 -28.91 64.09 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.079 0.466 . . . . 0.0 110.431 179.73 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 48.8 t80 -61.19 -39.63 90.9 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.153 179.529 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 66.9 m -56.14 -40.14 73.36 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.391 -179.9 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 14.2 m-85 -60.99 -48.94 79.49 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 120.737 -0.385 . . . . 0.0 110.792 179.65 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' TRP . . . . . 0.748 ' HE1' ' HE1' ' A' ' 56' ' ' TRP . 40.5 m0 -57.72 -36.11 71.58 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.57 -179.652 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 78.7 m-20 -62.77 -47.47 83.37 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 120.388 -0.525 . . . . 0.0 110.899 -179.863 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 36.7 tp -71.25 -52.47 18.84 Favored 'General case' 0 C--O 1.219 -0.524 0 C-N-CA 120.333 -0.547 . . . . 0.0 110.588 179.611 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -58.42 -26.68 31.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 C-N-CA 120.804 -0.358 . . . . 0.0 110.552 -179.889 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.405 ' CB ' ' O ' ' A' ' 83' ' ' TRP . 63.4 tttt -65.97 -49.65 67.12 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.634 179.884 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.1 pp20? -80.07 -20.72 44.53 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.007 -179.665 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.538 ' O ' HD13 ' A' ' 89' ' ' LEU . 0.2 OUTLIER -61.49 -47.12 87.11 Favored 'General case' 0 N--CA 1.443 -0.793 0 C-N-CA 120.172 -0.611 . . . . 0.0 110.322 -179.111 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.511 HD12 ' CG1' ' A' ' 53' ' ' ILE . 3.4 mt -64.4 -44.4 97.11 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.156 0 C-N-CA 120.174 -0.611 . . . . 0.0 109.775 -179.815 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . 0.458 ' O ' ' OD1' ' A' ' 91' ' ' ASP . 64.6 t0 -62.19 -37.22 84.46 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.063 -179.16 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . 0.639 ' O ' HG23 ' A' ' 95' ' ' VAL . 26.6 tttm -42.12 145.57 0.36 Allowed 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.929 0.395 . . . . 0.0 110.363 -179.58 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 57.5 mttp -79.43 -17.09 55.01 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.669 -179.637 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 71.1 mm-40 -109.64 53.14 0.7 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.642 -179.777 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.639 HG23 ' O ' ' A' ' 92' ' ' LYS . 44.9 t -73.09 148.08 9.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-O 120.911 0.386 . . . . 0.0 110.431 179.696 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' ASN . . . . . 0.614 ' O ' ' N ' ' A' ' 98' ' ' GLN . 0.0 OUTLIER -41.91 166.81 0.07 OUTLIER Pre-proline 0 C--N 1.327 -0.402 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.291 179.971 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_exo -39.59 -13.16 0.02 OUTLIER 'Trans proline' 0 N--CA 1.493 1.471 0 C-N-CA 123.079 2.52 . . . . 0.0 112.713 178.868 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . 0.614 ' N ' ' O ' ' A' ' 96' ' ' ASN . 8.8 tt0 . . . . . 0 C--N 1.323 -0.556 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.101 179.197 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 11.0 m . . . . . 0 N--CA 1.457 -0.106 0 CA-C-O 120.721 0.296 . . . . 0.0 110.329 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 94.4 mt-10 -117.54 141.33 48.49 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.498 -179.794 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' GLU . . . . . 0.551 ' C ' ' H ' ' A' ' 110' ' ' LEU . 95.2 mt-10 -66.45 133.12 49.78 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 120.644 -0.423 . . . . 0.0 110.132 179.325 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 42.2 pt -55.39 -2.14 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.19 179.466 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.551 ' H ' ' C ' ' A' ' 108' ' ' GLU . 95.6 mt -96.45 5.96 49.75 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-O 120.806 0.336 . . . . 0.0 110.463 -179.762 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -114.45 129.68 56.67 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.385 179.904 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 30.2 p -136.86 -119.94 0.15 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.273 179.884 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 113' ' ' ASN . . . . . 0.416 ' C ' ' OD1' ' A' ' 113' ' ' ASN . 43.4 t-20 -64.39 -41.39 96.7 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.371 179.8 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 68.6 m -134.27 154.8 51.08 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.61 -179.848 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 87.4 mt-30 -87.08 85.42 7.23 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.391 179.9 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 7.3 m -63.58 -45.26 91.23 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.63 -179.771 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 72.7 m-20 . . . . . 0 C--N 1.331 -0.216 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.763 -179.397 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . 0.526 ' O ' ' N ' ' A' ' 6' ' ' SER . . . . . . . . 0 CA--C 1.523 0.592 0 N-CA-C 110.464 -1.054 . . . . 0.0 110.464 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 20.6 pt20 -43.09 -24.94 0.09 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.847 0.356 . . . . 0.0 110.658 -179.679 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . 0.415 ' N ' ' O ' ' A' ' 2' ' ' GLY . 98.0 mt-10 -73.8 -64.69 0.95 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.69 -179.862 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.734 HD12 ' N ' ' A' ' 6' ' ' SER . 4.0 pp -83.83 -41.07 17.9 Favored 'General case' 0 C--O 1.223 -0.32 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.246 -179.944 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . 0.734 ' N ' HD12 ' A' ' 5' ' ' LEU . 16.5 m -49.95 -45.91 51.77 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 120.823 -0.351 . . . . 0.0 110.695 -178.7 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . 0.433 ' OE1' ' O ' ' A' ' 46' ' ' PRO . 84.8 mt-30 -62.14 -29.18 70.16 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 120.751 -0.38 . . . . 0.0 110.536 179.483 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' HIS . . . . . 0.489 ' O ' HG23 ' A' ' 12' ' ' VAL . 33.3 m170 -80.15 -53.41 6.71 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.807 0.336 . . . . 0.0 111.616 -179.408 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 80.4 mm-40 -65.78 -43.7 87.98 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.282 -179.096 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.536 ' O ' ' N ' ' A' ' 14' ' ' GLN . 96.1 mtt-85 -68.98 -55.24 11.52 Favored 'General case' 0 C--O 1.216 -0.668 0 C-N-CA 120.531 -0.468 . . . . 0.0 110.582 -179.369 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 46.3 t80 -46.68 -38.7 10.18 Favored 'General case' 0 C--N 1.319 -0.759 0 C-N-CA 119.793 -0.763 . . . . 0.0 110.903 -179.215 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.489 HG23 ' O ' ' A' ' 8' ' ' HIS . 73.9 t -71.41 -60.15 2.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 N-CA-C 112.337 0.495 . . . . 0.0 112.337 -179.389 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.477 ' O ' ' CB ' ' A' ' 17' ' ' GLN . 95.3 mt-10 -80.16 -47.68 14.34 Favored 'General case' 0 C--O 1.213 -0.861 0 C-N-CA 120.804 -0.359 . . . . 0.0 111.431 -178.77 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . 0.536 ' N ' ' O ' ' A' ' 10' ' ' ARG . 51.5 tp60 -50.9 -44.16 59.94 Favored 'General case' 0 C--N 1.317 -0.83 0 C-N-CA 120.794 -0.363 . . . . 0.0 110.577 -179.192 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.5 HD13 ' O ' ' A' ' 15' ' ' LEU . 0.2 OUTLIER -78.01 -59.15 2.9 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 120.123 -0.631 . . . . 0.0 111.896 -179.041 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.667 ' HB3' HG11 ' A' ' 26' ' ' VAL . 98.5 mttt -56.8 -35.49 68.8 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.882 -178.54 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . 0.477 ' CB ' ' O ' ' A' ' 13' ' ' GLU . 60.3 tt0 -71.61 -40.24 69.95 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.499 179.885 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -55.64 -32.8 63.48 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 -179.783 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.444 HD13 ' CZ ' ' A' ' 82' ' ' TYR . 3.5 mt -86.09 -31.81 21.7 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.151 179.132 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -51.62 -43.97 62.73 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.933 -178.696 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . 0.462 HG22 ' H ' ' A' ' 21' ' ' THR . 0.2 OUTLIER -64.96 -30.45 71.44 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.577 179.91 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 78.5 mmt-85 -67.7 -7.56 28.01 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.318 -179.772 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 107.17 19.52 9.4 Favored Glycine 0 CA--C 1.525 0.683 0 N-CA-C 111.121 -0.792 . . . . 0.0 111.121 179.696 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.63 HG12 ' N ' ' A' ' 25' ' ' LYS . 38.8 t -101.82 167.95 2.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 N-CA-C 110.212 -0.292 . . . . 0.0 110.212 179.897 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.63 ' N ' HG12 ' A' ' 24' ' ' VAL . 99.0 mttt -132.74 144.63 50.41 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.399 179.57 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.667 HG11 ' HB3' ' A' ' 16' ' ' LYS . 30.0 m -132.12 130.55 60.93 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.354 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.699 179.91 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 14.3 pttp -109.81 163.78 13.2 Favored 'General case' 0 C--O 1.228 -0.056 0 CA-C-O 120.741 0.305 . . . . 0.0 110.499 179.66 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 93.6 m-85 -49.77 -32.13 13.14 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.959 0.409 . . . . 0.0 110.519 179.999 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -55.12 -24.35 25.6 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.39 179.84 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.46 ' O ' ' CB ' ' A' ' 34' ' ' PHE . 99.0 m-20 -64.44 -46.1 84.62 Favored 'General case' 0 C--O 1.22 -0.492 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.808 -179.987 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.478 ' O ' ' CB ' ' A' ' 35' ' ' PHE . 5.3 mp -63.53 -40.42 96.99 Favored 'General case' 0 C--N 1.315 -0.902 0 C-N-CA 120.23 -0.588 . . . . 0.0 110.407 -179.747 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 30.8 mt -58.8 -49.78 76.39 Favored 'General case' 0 C--N 1.313 -0.98 0 C-N-CA 119.634 -0.826 . . . . 0.0 111.549 -178.179 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -87.75 -51.19 6.0 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 112.591 0.589 . . . . 0.0 112.591 -178.58 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . 0.682 ' O ' HG22 ' A' ' 38' ' ' VAL . 9.7 t80 -59.68 -50.25 74.56 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.805 -178.344 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.478 ' CB ' ' O ' ' A' ' 31' ' ' LEU . 10.0 t80 -63.47 -47.91 79.82 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.499 -0.48 . . . . 0.0 110.666 -179.966 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 55.1 t0 -67.69 -29.19 68.39 Favored 'General case' 0 N--CA 1.456 -0.145 0 C-N-CA 120.426 -0.51 . . . . 0.0 111.176 -179.418 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.572 ' CZ ' HG22 ' A' ' 59' ' ' VAL . 9.9 t80 -66.34 -51.53 56.25 Favored 'General case' 0 C--N 1.332 -0.173 0 C-N-CA 120.642 -0.423 . . . . 0.0 111.611 -178.255 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.682 HG22 ' O ' ' A' ' 34' ' ' PHE . 9.1 m -76.47 -39.14 33.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.95 -179.708 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -62.74 -26.78 68.86 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.596 -179.555 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 40.5 t0 -52.97 -52.95 56.43 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.856 -179.299 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 12.0 p -114.07 -6.65 13.1 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.143 179.947 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . 0.522 ' N ' ' O ' ' A' ' 38' ' ' VAL . 3.3 m 43.44 56.52 12.22 Favored Pre-proline 0 CA--C 1.532 0.267 0 CA-C-O 120.885 0.374 . . . . 0.0 110.28 -178.967 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . 0.539 ' C ' ' H ' ' A' ' 45' ' ' PHE . 61.2 Cg_endo -79.34 -15.19 12.76 Favored 'Trans proline' 0 C--N 1.313 -1.304 0 C-N-CA 122.378 2.052 . . . . 0.0 112.428 -179.795 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . 0.503 ' CZ3' ' CE3' ' A' ' 56' ' ' TRP . 0.0 OUTLIER -69.71 22.06 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.474 -179.238 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.539 ' H ' ' C ' ' A' ' 43' ' ' PRO . 18.1 t80 36.25 68.86 1.33 Allowed Pre-proline 0 C--O 1.233 0.191 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.343 179.981 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.433 ' O ' ' OE1' ' A' ' 7' ' ' GLN . 48.9 Cg_endo -75.18 -0.45 10.04 Favored 'Trans proline' 0 C--N 1.305 -1.751 0 C-N-CA 122.69 2.26 . . . . 0.0 112.189 -179.252 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 86.9 mt-30 -60.31 -52.83 63.6 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 120.604 -0.438 . . . . 0.0 110.538 -179.797 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 58.9 tt0 -89.23 -14.49 35.83 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.778 0.323 . . . . 0.0 110.448 179.717 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . 0.471 ' O ' ' CB ' ' A' ' 98' ' ' GLN . . . 72.94 58.02 5.0 Favored Glycine 0 CA--C 1.524 0.63 0 N-CA-C 110.336 -1.106 . . . . 0.0 110.336 -178.929 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 2.6 t -132.54 169.2 16.94 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.886 0.374 . . . . 0.0 110.79 -179.331 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.478 ' CD1' HD23 ' A' ' 89' ' ' LEU . 1.4 mt -85.02 142.17 13.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.434 179.345 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 80.0 m-20 -111.25 121.54 45.53 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.648 -0.705 . . . . 0.0 111.246 179.468 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.459 ' CG1' HD12 ' A' ' 90' ' ' ILE . 31.1 mm -94.11 -55.0 6.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.28 179.231 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -71.96 -55.23 7.83 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-O 120.873 0.368 . . . . 0.0 111.796 -178.708 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 86.5 mtm-85 -57.51 -30.49 65.18 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.178 -0.465 . . . . 0.0 109.999 -179.607 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' TRP . . . . . 0.503 ' CE3' ' CZ3' ' A' ' 44' ' ' TRP . 12.5 t-105 -62.73 -41.36 99.13 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.727 178.856 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 96.5 mtt-85 -63.24 -33.57 75.77 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.453 -179.835 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . 0.489 ' O ' ' SG ' ' A' ' 62' ' ' CYS . 96.7 mtt180 -63.14 -51.77 65.15 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.552 -0.459 . . . . 0.0 111.285 -179.384 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.572 HG22 ' CZ ' ' A' ' 37' ' ' PHE . 3.3 p -66.24 -35.52 75.17 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.333 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.678 179.84 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -73.22 -48.87 17.74 Favored Glycine 0 CA--C 1.528 0.861 0 C-N-CA 120.911 -0.662 . . . . 0.0 111.778 -179.674 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 95.8 m-20 -62.92 -44.51 95.88 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.669 0.271 . . . . 0.0 111.473 -179.074 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' CYS . . . . . 0.489 ' SG ' ' O ' ' A' ' 58' ' ' ARG . 74.6 m -60.73 -58.93 6.36 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.877 0.37 . . . . 0.0 110.877 -179.356 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 24.7 m-85 -61.64 -41.0 96.88 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.81 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 53.9 tt0 -60.59 -39.29 87.56 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.5 -0.318 . . . . 0.0 111.055 -179.873 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.472 ' O ' ' OD1' ' A' ' 68' ' ' ASN . 20.2 t0 -58.25 -52.1 67.01 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 120.943 0.402 . . . . 0.0 110.68 -179.704 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 83.6 m-85 -73.18 -41.14 64.18 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 120.473 -0.491 . . . . 0.0 111.309 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 62.6 t80 -57.55 -47.39 82.16 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.803 -178.78 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . 0.472 ' OD1' ' O ' ' A' ' 65' ' ' ASP . 0.2 OUTLIER -62.8 -41.65 99.37 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.676 -179.853 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.468 ' N ' ' ND2' ' A' ' 68' ' ' ASN . 40.8 p -66.43 -17.97 65.09 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.268 179.972 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 7.9 m-85 -98.8 14.87 27.28 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.547 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 166.22 -87.71 0.1 OUTLIER Glycine 0 CA--C 1.535 1.328 0 C-N-CA 120.764 -0.731 . . . . 0.0 111.734 179.53 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . 0.423 ' O ' ' O ' ' A' ' 68' ' ' ASN . 33.7 Cg_exo -51.13 126.59 19.38 Favored 'Trans proline' 0 N--CA 1.496 1.624 0 C-N-CA 121.866 1.711 . . . . 0.0 112.592 179.938 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.521 ' N ' ' OE1' ' A' ' 73' ' ' GLU . 58.4 mp0 -86.82 -43.93 12.11 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.905 -0.588 . . . . 0.0 110.506 179.286 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.628 ' CD ' ' H ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -104.26 -7.57 19.95 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.108 -179.695 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.419 ' N ' ' HD3' ' A' ' 74' ' ' LYS . 30.2 t 59.41 133.38 0.03 OUTLIER Pre-proline 0 N--CA 1.448 -0.551 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.718 -178.978 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -53.43 129.21 32.58 Favored 'Trans proline' 0 N--CA 1.493 1.459 0 C-N-CA 121.535 1.49 . . . . 0.0 111.238 178.043 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.425 ' O ' ' N ' ' A' ' 80' ' ' PHE . 59.6 t -80.85 -16.54 12.47 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.687 179.891 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 65.7 p -45.94 -22.82 0.23 Allowed 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.945 0.402 . . . . 0.0 110.072 -179.931 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -67.6 -34.8 77.74 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.68 179.403 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . 0.425 ' N ' ' O ' ' A' ' 77' ' ' VAL . 10.2 m-85 -57.74 -35.38 70.63 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.33 -179.633 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 94.9 p -60.36 -40.29 90.22 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.355 179.87 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' TYR . . . . . 0.444 ' CZ ' HD13 ' A' ' 19' ' ' LEU . 13.8 m-85 -60.17 -49.39 77.81 Favored 'General case' 0 C--O 1.223 -0.29 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.797 179.81 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' TRP . . . . . 0.519 ' N ' ' CD1' ' A' ' 83' ' ' TRP . 9.6 m0 -59.12 -40.39 85.24 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.311 179.956 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 78.0 m-20 -62.68 -43.23 99.33 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 120.691 -0.404 . . . . 0.0 110.572 -179.923 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -70.25 -55.43 9.29 Favored 'General case' 0 C--O 1.221 -0.416 0 N-CA-C 110.215 -0.291 . . . . 0.0 110.215 179.409 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -60.88 -25.52 35.95 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.884 0 C-N-CA 120.959 -0.296 . . . . 0.0 110.717 -179.66 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.426 ' CB ' ' O ' ' A' ' 83' ' ' TRP . 42.2 tttp -65.26 -50.16 66.83 Favored 'General case' 0 C--N 1.317 -0.807 0 C-N-CA 120.467 -0.493 . . . . 0.0 110.555 179.716 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.1 pp20? -80.34 -19.69 45.91 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.679 -179.891 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.478 HD23 ' CD1' ' A' ' 51' ' ' ILE . 14.5 tp -61.5 -45.02 96.0 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.354 -179.015 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.459 HD12 ' CG1' ' A' ' 53' ' ' ILE . 3.6 mt -65.04 -43.86 95.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 C-N-CA 120.293 -0.563 . . . . 0.0 109.956 -179.778 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 94.1 m-20 -65.16 -8.02 15.15 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.841 -178.938 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 84.7 tttt -66.9 146.13 54.73 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.42 179.91 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -61.7 -41.64 97.87 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.661 -179.843 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . 0.46 ' O ' ' C ' ' A' ' 95' ' ' VAL . 97.9 mt-10 -77.66 6.94 6.34 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.828 -179.82 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.46 ' C ' ' O ' ' A' ' 94' ' ' GLU . 2.7 m 30.72 -110.62 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.283 0 O-C-N 123.692 0.62 . . . . 0.0 110.707 -179.806 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' ASN . . . . . 0.531 ' O ' ' N ' ' A' ' 98' ' ' GLN . 1.3 m120 -153.32 160.86 30.43 Favored Pre-proline 0 N--CA 1.45 -0.438 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.568 179.356 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_exo -44.5 -12.23 0.05 OUTLIER 'Trans proline' 0 C--N 1.31 -1.473 0 C-N-CA 122.689 2.259 . . . . 0.0 112.146 178.974 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . 0.531 ' N ' ' O ' ' A' ' 96' ' ' ASN . 6.0 pt20 . . . . . 0 C--N 1.323 -0.57 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.896 -179.861 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 24.1 p . . . . . 0 C--O 1.231 0.1 0 CA-C-O 120.84 0.352 . . . . 0.0 110.623 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 85.4 mt-10 -56.99 142.52 41.62 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.385 -179.587 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 108' ' ' GLU . . . . . 0.555 ' C ' ' H ' ' A' ' 110' ' ' LEU . 92.2 mt-10 -65.4 136.25 56.26 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.768 -0.373 . . . . 0.0 110.201 179.626 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 45.3 pt -61.14 4.14 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.364 179.622 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.555 ' H ' ' C ' ' A' ' 108' ' ' GLU . 96.4 mt -101.73 -5.98 24.26 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.892 0.377 . . . . 0.0 110.538 -179.735 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 63.2 tttm -102.37 128.77 48.81 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.683 -179.969 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . 0.532 ' OG ' ' N ' ' A' ' 113' ' ' ASN . 3.1 p -87.57 -147.13 0.14 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.463 -179.875 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 113' ' ' ASN . . . . . 0.532 ' N ' ' OG ' ' A' ' 112' ' ' SER . 90.5 m-20 -62.09 -42.32 99.09 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.385 -179.442 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 92.9 p -153.86 -5.74 0.17 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.582 179.941 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 94.9 mm-40 -70.82 150.3 45.96 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.422 -179.695 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 73.1 p -72.8 169.73 16.14 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.405 -179.873 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 88.8 m-20 . . . . . 0 C--N 1.33 -0.258 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.47 -179.69 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.752 0 N-CA-C 110.984 -0.846 . . . . 0.0 110.984 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 88.1 mt-30 -64.24 -38.97 92.95 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.779 0.323 . . . . 0.0 110.733 179.997 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . 0.412 ' O ' ' N ' ' A' ' 7' ' ' GLN . 90.4 mt-10 -47.96 -22.95 0.66 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.509 -179.969 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 51.8 tp -41.97 -34.57 0.71 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.26 -179.55 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 42.6 m -55.09 -42.05 72.34 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.077 0.465 . . . . 0.0 110.327 -179.899 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . 0.412 ' N ' ' O ' ' A' ' 4' ' ' GLU . 95.2 mt-30 -61.1 -30.8 70.57 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.883 -0.598 . . . . 0.0 110.689 179.614 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 59.4 t-80 -62.1 -41.72 98.5 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.023 0.439 . . . . 0.0 110.117 179.72 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 80.1 mm-40 -60.27 -46.65 89.07 Favored 'General case' 0 C--O 1.245 0.819 0 CA-C-O 121.562 0.696 . . . . 0.0 110.026 179.937 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.41 ' O ' ' CB ' ' A' ' 14' ' ' GLN . 24.5 mtm180 -63.48 -29.02 70.37 Favored 'General case' 0 C--O 1.217 -0.608 0 C-N-CA 120.241 -0.583 . . . . 0.0 109.799 179.506 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 37.8 t80 -62.86 -36.71 84.16 Favored 'General case' 0 C--N 1.328 -0.327 0 O-C-N 123.562 0.539 . . . . 0.0 109.888 179.902 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 3.7 t -62.66 -48.32 88.71 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 C-N-CA 119.837 -0.745 . . . . 0.0 110.834 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 79.8 mm-40 -80.87 -38.9 27.31 Favored 'General case' 0 C--N 1.322 -0.595 0 C-N-CA 119.935 -0.706 . . . . 0.0 111.767 -179.173 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . 0.41 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 63.9 tp60 -65.38 -53.05 48.92 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.538 -0.755 . . . . 0.0 110.865 -179.171 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.577 HD13 ' O ' ' A' ' 15' ' ' LEU . 0.3 OUTLIER -63.12 -45.86 90.02 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.453 -0.499 . . . . 0.0 109.917 -179.126 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 53.8 mttp -54.82 -32.5 60.48 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 120.204 -0.599 . . . . 0.0 110.503 179.79 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 59.9 tt0 -67.16 -41.32 86.19 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.556 179.994 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -57.58 -30.35 65.2 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.617 -0.72 . . . . 0.0 109.763 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.2 mt -86.44 -28.82 23.28 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.253 0.549 . . . . 0.0 110.651 178.848 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -51.12 -43.02 61.06 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.779 -178.784 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.73 -28.87 69.89 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.55 179.762 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 82.8 mmt-85 -71.01 -6.34 38.21 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.353 -179.831 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 108.04 20.12 8.57 Favored Glycine 0 CA--C 1.524 0.65 0 N-CA-C 111.16 -0.776 . . . . 0.0 111.16 179.93 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.609 HG12 ' N ' ' A' ' 25' ' ' LYS . 18.3 t -102.29 169.38 1.88 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 N-CA-C 110.345 -0.243 . . . . 0.0 110.345 179.857 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.609 ' N ' HG12 ' A' ' 24' ' ' VAL . 99.4 mttt -115.43 146.69 41.38 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.368 179.803 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.474 ' O ' HG23 ' A' ' 26' ' ' VAL . 2.3 m -115.31 23.4 5.34 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.272 0 CA-C-O 120.996 0.427 . . . . 0.0 110.662 -179.584 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.517 ' N ' ' OD2' ' A' ' 30' ' ' ASP . 33.5 pttt -51.97 163.58 0.34 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.219 -179.712 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 75.8 m-85 -58.15 -35.83 72.12 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.819 -0.352 . . . . 0.0 110.654 -179.727 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.42 ' HB3' ' HD2' ' A' ' 27' ' ' LYS . . . -53.84 -23.8 13.6 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.691 -179.953 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.517 ' OD2' ' N ' ' A' ' 27' ' ' LYS . 59.3 m-20 -63.5 -46.68 84.97 Favored 'General case' 0 C--O 1.223 -0.335 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.685 -179.509 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.502 ' H ' HD12 ' A' ' 31' ' ' LEU . 5.4 mp -67.28 -41.09 86.03 Favored 'General case' 0 C--O 1.221 -0.446 0 CA-C-O 121.251 0.548 . . . . 0.0 110.487 179.575 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.411 HD12 ' HA ' ' A' ' 29' ' ' ALA . 55.7 mt -56.73 -44.84 82.06 Favored 'General case' 0 C--N 1.314 -0.948 0 C-N-CA 119.546 -0.862 . . . . 0.0 111.057 -178.927 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 86.5 tttt -86.09 -49.38 7.82 Favored 'General case' 0 C--N 1.32 -0.714 0 C-N-CA 120.475 -0.49 . . . . 0.0 111.421 -178.922 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 58.0 t80 -61.93 -49.88 74.36 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.237 -178.687 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.482 ' CB ' ' O ' ' A' ' 31' ' ' LEU . 7.9 t80 -62.96 -46.9 85.57 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.189 -179.827 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 94.4 m-20 -65.31 -34.32 78.07 Favored 'General case' 0 C--N 1.347 0.477 0 CA-C-O 120.721 0.296 . . . . 0.0 111.167 -179.432 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.458 ' CE2' ' CD2' ' A' ' 63' ' ' PHE . 1.9 m-85 -60.53 -47.85 84.35 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.919 0.39 . . . . 0.0 111.111 -179.053 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.529 ' O ' ' N ' ' A' ' 42' ' ' CYS . 27.8 m -77.82 -40.2 26.98 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.592 -179.704 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.43 ' N ' HG23 ' A' ' 38' ' ' VAL . 88.2 tttt -56.59 -26.93 56.78 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.635 -179.847 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 93.2 m-20 -54.4 -62.38 1.69 Allowed 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 120.748 -0.381 . . . . 0.0 111.292 -179.043 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.478 ' O ' ' SG ' ' A' ' 42' ' ' CYS . 45.8 p -114.0 5.53 16.14 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.101 -179.506 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . 0.529 ' N ' ' O ' ' A' ' 38' ' ' VAL . 28.1 p 37.5 57.97 4.28 Favored Pre-proline 0 N--CA 1.465 0.288 0 CA-C-O 120.772 0.32 . . . . 0.0 110.341 -179.235 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 69.3 Cg_endo -75.79 -11.92 20.04 Favored 'Trans proline' 0 C--N 1.312 -1.343 0 C-N-CA 122.779 2.32 . . . . 0.0 112.339 -179.312 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . 0.404 ' O ' ' C ' ' A' ' 45' ' ' PHE . 0.0 OUTLIER -82.5 12.48 4.51 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.024 -179.569 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.454 ' CE1' ' OE1' ' A' ' 47' ' ' GLN . 21.3 t80 39.85 54.59 5.99 Favored Pre-proline 0 C--N 1.331 -0.206 0 CA-C-O 120.864 0.364 . . . . 0.0 110.227 179.882 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.438 ' CD ' ' N ' ' A' ' 45' ' ' PHE . 19.1 Cg_endo -58.88 -2.62 1.18 Allowed 'Trans proline' 0 C--N 1.308 -1.598 0 C-N-CA 122.898 2.399 . . . . 0.0 112.256 -179.522 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.454 ' OE1' ' CE1' ' A' ' 45' ' ' PHE . 88.2 mt-30 -60.73 -52.62 64.33 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.238 179.933 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 76.9 tt0 -89.09 -21.92 23.15 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-O 121.053 0.454 . . . . 0.0 110.397 179.104 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 78.89 63.24 2.11 Favored Glycine 0 CA--C 1.523 0.554 0 N-CA-C 110.534 -1.026 . . . . 0.0 110.534 -179.486 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . 0.427 ' OG1' ' NE2' ' A' ' 98' ' ' GLN . 11.2 t -137.19 160.8 37.96 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.836 0.351 . . . . 0.0 110.748 -179.411 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.3 mt -83.53 133.53 28.95 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.425 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.521 179.603 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -116.95 120.83 39.64 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.373 -0.83 . . . . 0.0 110.345 179.298 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 20.3 mm -91.43 -48.13 13.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.922 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -63.17 -44.98 93.91 Favored 'General case' 0 C--O 1.238 0.46 0 CA-C-O 121.255 0.55 . . . . 0.0 110.66 -179.399 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 85.0 mtt85 -64.14 -34.36 77.89 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.115 -0.493 . . . . 0.0 109.903 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 29.4 t-105 -59.39 -39.13 82.38 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-O 121.125 0.488 . . . . 0.0 110.4 -179.466 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 83.7 mtp180 -64.12 -39.08 93.26 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.347 179.949 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . 0.442 ' O ' ' OD2' ' A' ' 61' ' ' ASP . 83.9 mtt85 -60.88 -52.06 66.64 Favored 'General case' 0 C--N 1.331 -0.228 0 C-N-CA 120.715 -0.394 . . . . 0.0 111.209 -179.972 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 5.9 p -69.01 -31.05 48.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.13 179.179 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -67.71 -44.58 80.61 Favored Glycine 0 CA--C 1.526 0.74 0 N-CA-C 111.344 -0.703 . . . . 0.0 111.344 -179.819 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . 0.442 ' OD2' ' O ' ' A' ' 58' ' ' ARG . 0.5 OUTLIER -65.87 -38.01 87.66 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.779 0.323 . . . . 0.0 110.609 -179.42 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 76.1 m -64.98 -49.57 69.78 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.04 0.448 . . . . 0.0 110.678 -179.45 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . 0.458 ' CD2' ' CE2' ' A' ' 37' ' ' PHE . 12.0 m-85 -67.29 -28.94 68.43 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.282 179.626 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 56.9 tt0 -61.48 -45.42 94.32 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 120.658 -0.417 . . . . 0.0 110.967 -179.872 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 24.4 t0 -62.97 -51.83 65.37 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.005 0.431 . . . . 0.0 110.595 179.699 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 54.1 m-85 -62.34 -32.81 73.64 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.037 -0.528 . . . . 0.0 110.234 179.819 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . 0.416 ' OH ' ' CD ' ' A' ' 76' ' ' PRO . 58.2 t80 -61.83 -40.2 94.46 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.312 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 88.6 m-20 -63.96 -39.92 95.23 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.343 -179.626 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 61.4 p -49.3 -34.3 15.17 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.693 -179.31 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 69.1 m-85 -65.58 -47.0 77.25 Favored 'General case' 0 C--N 1.322 -0.609 0 C-N-CA 120.075 -0.65 . . . . 0.0 111.134 -179.906 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . 0.497 ' H ' ' HD3' ' A' ' 72' ' ' PRO . . . 110.91 71.48 0.64 Allowed Glycine 0 N--CA 1.472 1.036 0 N-CA-C 110.853 -0.899 . . . . 0.0 110.853 -179.545 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . 0.497 ' HD3' ' H ' ' A' ' 71' ' ' GLY . 24.5 Cg_exo -62.78 142.06 87.46 Favored 'Trans proline' 0 C--N 1.305 -1.74 0 C-N-CA 123.241 2.628 . . . . 0.0 111.891 -179.861 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 97.6 mt-10 -83.2 -46.29 12.88 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-O 121.047 0.451 . . . . 0.0 110.206 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.548 ' HD3' ' H ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -137.14 3.87 2.66 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.573 -0.739 . . . . 0.0 111.861 -179.72 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 54.1 t 57.1 100.11 0.04 OUTLIER Pre-proline 0 C--N 1.325 -0.486 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.485 -178.248 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . 0.416 ' CD ' ' OH ' ' A' ' 67' ' ' TYR . 48.6 Cg_exo -53.38 126.8 22.84 Favored 'Trans proline' 0 N--CA 1.494 1.556 0 C-N-CA 122.032 1.821 . . . . 0.0 112.176 -179.647 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.477 ' O ' ' N ' ' A' ' 79' ' ' ALA . 45.3 t -84.01 -20.81 8.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.875 179.497 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 71.5 p -40.75 -24.99 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.464 -179.262 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . 0.477 ' N ' ' O ' ' A' ' 77' ' ' VAL . . . -65.5 -41.83 92.79 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.144 0.497 . . . . 0.0 110.868 179.597 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . 0.454 ' N ' ' O ' ' A' ' 77' ' ' VAL . 2.4 m-85 -62.77 -39.37 93.96 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.644 179.853 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 73.4 p -54.17 -42.39 69.58 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.355 -179.725 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 9.5 m-85 -61.05 -54.24 47.22 Favored 'General case' 0 CA--C 1.52 -0.208 0 C-N-CA 120.847 -0.341 . . . . 0.0 110.659 179.832 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' TRP . . . . . . . . . . . . . 37.7 t90 -56.78 -36.7 70.15 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.543 179.724 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 92.6 m-20 -62.86 -48.54 78.56 Favored 'General case' 0 C--O 1.235 0.327 0 C-N-CA 120.775 -0.37 . . . . 0.0 111.155 -179.409 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 33.1 tp -70.41 -51.53 28.86 Favored 'General case' 0 N--CA 1.447 -0.62 0 C-N-CA 120.532 -0.467 . . . . 0.0 110.376 179.676 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -58.22 -27.35 32.1 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 C-N-CA 120.511 -0.475 . . . . 0.0 110.513 -179.766 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 64.5 tttt -65.11 -48.9 72.0 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.666 -178.898 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.2 pp20? -80.48 -21.33 42.11 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.739 -179.876 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.537 ' O ' HD13 ' A' ' 89' ' ' LEU . 0.2 OUTLIER -62.11 -43.09 99.59 Favored 'General case' 0 N--CA 1.447 -0.625 0 C-N-CA 120.046 -0.662 . . . . 0.0 110.113 -178.68 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 2.2 mt -63.33 -43.12 98.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 C-N-CA 119.949 -0.7 . . . . 0.0 110.052 -179.618 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 -55.57 -17.1 4.81 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.764 -178.478 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 75.3 tttt -61.52 134.28 56.68 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.315 179.635 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -62.37 -41.22 98.46 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.683 -179.806 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . 0.448 ' O ' ' C ' ' A' ' 95' ' ' VAL . 81.0 mm-40 -74.85 -2.22 25.78 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.971 -179.603 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.448 ' C ' ' O ' ' A' ' 94' ' ' GLU . 1.9 m 30.55 -106.71 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.29 0 O-C-N 123.831 0.707 . . . . 0.0 110.442 179.939 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' ASN . . . . . 0.439 ' O ' ' N ' ' A' ' 98' ' ' GLN . 0.8 OUTLIER -152.63 164.43 20.33 Favored Pre-proline 0 C--N 1.322 -0.596 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.658 179.047 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -46.07 -13.28 0.09 OUTLIER 'Trans proline' 0 N--CA 1.494 1.52 0 C-N-CA 122.797 2.332 . . . . 0.0 112.464 179.079 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . 0.439 ' N ' ' O ' ' A' ' 96' ' ' ASN . 3.5 pt20 . . . . . 0 C--N 1.323 -0.571 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.856 179.951 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 19.4 m . . . . . 0 C--O 1.23 0.079 0 CA-C-O 120.489 0.185 . . . . 0.0 110.691 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 93.8 mt-10 -125.18 163.28 22.8 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.485 -179.709 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 108' ' ' GLU . . . . . 0.536 ' OE1' ' N ' ' A' ' 108' ' ' GLU . 54.5 mp0 -90.41 120.19 31.32 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.061 -0.518 . . . . 0.0 109.937 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 42.4 pt -43.1 -19.15 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.491 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.514 ' N ' ' O ' ' A' ' 108' ' ' GLU . 35.1 mt -63.61 -42.04 98.25 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.429 -179.821 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 66.4 tttm -67.57 -38.34 83.92 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.449 179.895 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 51.2 m -59.47 -47.29 86.05 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.79 -179.211 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 90.1 m-20 -65.82 -42.51 90.54 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.633 179.823 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 114' ' ' SER . . . . . 0.701 ' OG ' HG23 ' A' ' 116' ' ' THR . 23.1 t -158.23 139.12 13.04 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.526 179.78 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 75.2 mt-30 -89.44 20.72 3.72 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.805 179.824 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 116' ' ' THR . . . . . 0.701 HG23 ' OG ' ' A' ' 114' ' ' SER . 41.3 p -63.37 -32.51 73.96 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.44 179.873 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 65.6 t0 . . . . . 0 C--N 1.328 -0.363 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.677 179.832 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.71 0 N-CA-C 110.887 -0.885 . . . . 0.0 110.887 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 99.2 mm-40 -61.81 -39.79 92.99 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.825 0.345 . . . . 0.0 110.573 179.803 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -55.52 -22.4 21.15 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.517 179.765 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 51.2 tp -42.31 -34.14 0.74 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.564 -179.999 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 56.2 m -54.21 -37.48 64.6 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.568 179.362 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 97.8 mm-40 -62.49 -37.3 85.48 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.588 179.741 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 59.1 t-80 -56.03 -43.93 78.28 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.585 179.689 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 81.9 tt0 -59.85 -53.16 61.18 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.563 179.114 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.479 ' O ' ' N ' ' A' ' 14' ' ' GLN . 86.8 mtt180 -60.61 -31.65 70.82 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.597 179.085 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.501 ' O ' ' HB2' ' A' ' 15' ' ' LEU . 51.1 t80 -60.66 -36.47 78.77 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.563 -179.601 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 3.0 t -63.24 -48.66 86.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.604 -179.198 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -83.49 -41.97 17.41 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.629 -179.571 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . 0.479 ' N ' ' O ' ' A' ' 10' ' ' ARG . 67.6 tp60 -61.39 -52.87 62.83 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.602 -179.119 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.708 HD13 ' O ' ' A' ' 15' ' ' LEU . 0.3 OUTLIER -61.25 -47.43 86.08 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.575 -179.976 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.478 ' HB3' HG11 ' A' ' 26' ' ' VAL . 87.0 mttt -56.29 -35.28 67.32 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.59 179.487 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 80.0 mt-30 -72.94 -36.08 67.13 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.622 178.636 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.416 ' O ' HG23 ' A' ' 21' ' ' THR . . . -57.22 -32.59 66.68 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.58 179.512 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.1 mt -85.59 -33.34 21.71 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.576 177.997 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -46.97 -42.37 17.79 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.529 -179.541 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . 0.512 ' C ' ' H ' ' A' ' 23' ' ' GLY . 0.2 OUTLIER -71.43 -25.75 62.45 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.581 -179.578 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 82.6 mmt-85 -72.88 19.52 0.09 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.562 179.674 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . 0.512 ' H ' ' C ' ' A' ' 21' ' ' THR . . . 86.31 18.26 59.3 Favored Glycine 0 CA--C 1.524 0.627 0 N-CA-C 110.934 -0.866 . . . . 0.0 110.934 -179.604 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.634 HG12 ' N ' ' A' ' 25' ' ' LYS . 22.8 t -105.39 168.85 2.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 120.787 0.327 . . . . 0.0 110.622 -179.927 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.634 ' N ' HG12 ' A' ' 24' ' ' VAL . 63.1 mttp -131.01 136.43 48.5 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.524 179.305 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.478 HG11 ' HB3' ' A' ' 16' ' ' LYS . 4.8 m -134.37 108.3 10.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.545 -179.459 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.477 ' O ' ' N ' ' A' ' 30' ' ' ASP . 13.0 ttmt -107.4 158.78 16.9 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.541 178.867 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.422 ' H ' ' HG2' ' A' ' 27' ' ' LYS . 97.9 m-85 -39.01 -34.22 0.15 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.534 179.39 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -60.19 -25.48 65.61 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.575 -179.706 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.487 ' O ' ' CB ' ' A' ' 34' ' ' PHE . 1.0 OUTLIER -60.06 -46.3 90.01 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.614 -179.028 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.566 ' H ' HD12 ' A' ' 31' ' ' LEU . 5.8 mp -63.68 -42.68 97.99 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.493 -179.959 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 36.8 mt -58.49 -46.11 87.34 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.588 -178.465 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.461 ' NZ ' ' CZ ' ' A' ' 37' ' ' PHE . 65.3 tttm -87.53 -49.22 7.33 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.52 -177.038 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . 0.487 ' CB ' ' O ' ' A' ' 30' ' ' ASP . 43.0 t80 -60.9 -50.25 74.16 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.53 -178.182 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.521 ' CB ' ' O ' ' A' ' 31' ' ' LEU . 7.1 t80 -61.84 -46.09 90.98 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.614 -178.938 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 86.1 m-20 -65.39 -35.2 80.23 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.574 -179.248 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.544 ' CE2' ' CD2' ' A' ' 63' ' ' PHE . 1.9 m-85 -60.89 -46.74 89.44 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.569 -179.191 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.622 ' O ' ' N ' ' A' ' 42' ' ' CYS . 25.8 m -76.52 -37.46 30.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.532 -178.825 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -62.56 -29.67 70.75 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.584 -179.633 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 81.3 m-20 -59.14 -44.84 92.09 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.557 -178.588 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.524 ' C ' ' SG ' ' A' ' 42' ' ' CYS . 41.6 p -115.06 -3.25 12.63 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.58 -178.849 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . 0.622 ' N ' ' O ' ' A' ' 38' ' ' VAL . 1.8 p 36.19 60.48 3.15 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.572 -179.608 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . 0.402 ' HD3' ' N ' ' A' ' 42' ' ' CYS . 57.1 Cg_endo -77.7 -40.22 0.43 Allowed 'Trans proline' 0 C--N 1.305 -1.717 0 C-N-CA 122.796 2.331 . . . . 0.0 112.115 -179.334 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . 0.801 ' HE1' ' H ' ' A' ' 52' ' ' ASP . 0.0 OUTLIER -73.43 3.44 6.02 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.552 -179.633 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.558 ' O ' ' N ' ' A' ' 47' ' ' GLN . 64.0 m-85 54.91 50.49 6.34 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.577 -179.527 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.528 ' CD ' ' N ' ' A' ' 45' ' ' PHE . 52.9 Cg_exo -40.1 -16.77 0.04 OUTLIER 'Trans proline' 0 C--N 1.305 -1.747 0 C-N-CA 122.835 2.357 . . . . 0.0 112.165 179.116 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.558 ' N ' ' O ' ' A' ' 45' ' ' PHE . 71.9 tp60 -63.84 -48.5 76.52 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.542 -179.532 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 51.6 tp10 -89.41 -45.22 9.62 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.636 179.867 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . 0.486 ' O ' ' NE2' ' A' ' 98' ' ' GLN . . . 96.61 68.45 0.98 Allowed Glycine 0 CA--C 1.524 0.616 0 N-CA-C 110.956 -0.857 . . . . 0.0 110.956 -179.306 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 7.0 t -130.03 170.2 14.3 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.842 0.353 . . . . 0.0 110.556 -179.333 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.3 mt -103.75 132.14 50.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.665 178.814 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . 0.801 ' H ' ' HE1' ' A' ' 44' ' ' TRP . 96.3 m-20 -118.51 121.42 40.23 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.549 179.04 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 22.0 mm -91.51 -53.86 8.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.584 -179.167 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 88.9 tttt -64.17 -48.27 76.61 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.564 -179.78 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 22.9 ttm-85 -61.53 -40.67 95.49 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.627 -179.611 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' TRP . . . . . 0.598 ' CE3' ' CH2' ' A' ' 44' ' ' TRP . 36.0 t-105 -51.74 -37.28 50.47 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.577 179.706 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -66.61 -38.92 87.97 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.596 -179.959 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 94.2 mtt-85 -61.53 -52.5 64.21 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.586 -179.857 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.443 HG13 ' N ' ' A' ' 60' ' ' GLY . 2.8 p -63.34 -43.62 98.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.628 179.879 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . 0.443 ' N ' HG13 ' A' ' 59' ' ' VAL . . . -64.53 -33.46 87.29 Favored Glycine 0 CA--C 1.525 0.697 0 N-CA-C 110.938 -0.865 . . . . 0.0 110.938 -179.709 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 10.9 m-20 -66.1 -37.01 84.7 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.788 0.327 . . . . 0.0 110.615 -179.701 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 84.0 m -63.45 -53.67 48.48 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.572 -179.82 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . 0.544 ' CD2' ' CE2' ' A' ' 37' ' ' PHE . 56.2 m-85 -67.66 -30.37 69.9 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.572 -179.608 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 60.0 tt0 -60.72 -42.26 96.92 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.579 179.382 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 29.5 t0 -63.18 -53.8 47.53 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.525 179.581 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' TYR . . . . . 0.457 ' O ' ' OG1' ' A' ' 69' ' ' THR . 60.6 m-85 -63.17 -35.55 80.68 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.518 179.615 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 62.5 t80 -57.9 -38.36 75.7 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.61 179.788 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 98.8 m-20 -66.66 -38.82 87.63 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.553 -179.896 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.457 ' OG1' ' O ' ' A' ' 66' ' ' TYR . 58.1 p -61.38 -29.74 70.1 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.618 -179.337 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -65.81 -40.94 92.33 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.572 -179.718 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . 0.506 ' H ' ' HD3' ' A' ' 72' ' ' PRO . . . 104.38 71.75 0.85 Allowed Glycine 0 CA--C 1.525 0.705 0 N-CA-C 110.937 -0.865 . . . . 0.0 110.937 179.665 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . 0.506 ' HD3' ' H ' ' A' ' 71' ' ' GLY . 19.3 Cg_exo -65.37 144.49 80.34 Favored 'Trans proline' 0 C--N 1.305 -1.721 0 C-N-CA 122.788 2.325 . . . . 0.0 112.173 179.326 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -76.29 -50.32 14.66 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.572 -179.806 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.519 ' HD3' ' H ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -138.88 6.08 2.4 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.56 -179.495 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 52.0 t 56.06 94.32 0.05 OUTLIER Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.612 -179.775 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -52.38 124.22 14.53 Favored 'Trans proline' 0 C--N 1.304 -1.767 0 C-N-CA 122.796 2.331 . . . . 0.0 112.143 -179.755 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.412 ' O ' ' N ' ' A' ' 80' ' ' PHE . 41.7 t -84.18 -15.43 11.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.565 -179.467 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 69.0 p -42.17 -27.18 0.12 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.546 179.927 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.87 -41.67 98.14 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.596 179.613 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . 0.412 ' N ' ' O ' ' A' ' 77' ' ' VAL . 2.3 m-85 -66.4 -33.28 75.35 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.547 -179.984 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 41.8 t -60.56 -42.52 96.78 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.568 179.802 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 7.6 m-85 -59.92 -52.23 66.3 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.553 179.445 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' TRP . . . . . 0.4 ' O ' ' CB ' ' A' ' 87' ' ' LYS . 41.1 t90 -59.03 -36.49 75.08 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.612 179.855 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 78.2 m-20 -62.02 -46.99 86.74 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.576 -179.559 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.402 ' O ' ' HG3' ' A' ' 88' ' ' GLU . 30.9 tp -70.64 -56.96 5.27 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.609 179.506 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -54.93 -24.97 15.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.563 179.547 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.4 ' CB ' ' O ' ' A' ' 83' ' ' TRP . 55.0 tttt -68.89 -47.6 65.46 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.581 -179.825 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . 0.463 ' OE1' ' O ' ' A' ' 88' ' ' GLU . 1.3 pp20? -82.71 -18.71 39.88 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.569 -179.802 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.601 ' O ' HD13 ' A' ' 89' ' ' LEU . 0.2 OUTLIER -61.99 -46.15 90.51 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.526 179.504 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 2.7 mt -62.73 -40.68 89.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.606 179.561 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 51.3 t0 -50.72 -42.56 57.41 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.59 -179.943 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 97.2 mttt -68.03 143.63 55.46 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.604 179.888 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -75.5 9.02 2.4 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.622 -179.818 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 40.4 tp10 -59.34 -33.72 71.48 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.499 179.859 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.413 ' H ' HG22 ' A' ' 95' ' ' VAL . 8.3 m -67.18 133.26 31.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.501 179.826 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' ASN . . . . . 0.541 ' O ' ' N ' ' A' ' 98' ' ' GLN . 1.1 m-20 -85.54 162.82 46.84 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.588 -179.624 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_exo -42.64 -13.45 0.04 OUTLIER 'Trans proline' 0 C--N 1.305 -1.763 0 C-N-CA 122.896 2.397 . . . . 0.0 112.101 179.271 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . 0.541 ' N ' ' O ' ' A' ' 96' ' ' ASN . 5.0 pt20 . . . . . 0 C--N 1.33 -0.263 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.573 -179.81 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 82.0 p . . . . . 0 C--O 1.232 0.156 0 CA-C-O 120.783 0.325 . . . . 0.0 110.619 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 92.2 mt-10 54.26 -164.18 0.11 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.508 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 108' ' ' GLU . . . . . 0.577 ' C ' ' H ' ' A' ' 110' ' ' LEU . 72.7 mm-40 -90.04 125.85 35.55 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.589 179.22 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 44.0 pt -58.86 2.26 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.577 -179.976 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.577 ' H ' ' C ' ' A' ' 108' ' ' GLU . 91.6 mt -95.18 -5.65 43.47 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.628 179.871 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 86.5 tttt -121.48 127.13 50.74 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.594 179.948 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . 0.436 ' OG ' ' N ' ' A' ' 113' ' ' ASN . 95.4 p -148.52 -113.02 0.07 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.563 -179.962 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 113' ' ' ASN . . . . . 0.436 ' N ' ' OG ' ' A' ' 112' ' ' SER . 77.4 m-20 -62.17 -34.79 77.09 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.618 179.617 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 62.4 p -153.07 160.2 42.92 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.53 179.735 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 86.4 mt-30 -90.15 129.65 36.4 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.581 179.993 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 116' ' ' THR . . . . . 0.406 ' OG1' ' N ' ' A' ' 117' ' ' ASP . 67.5 p -108.68 -74.46 0.66 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.602 179.874 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 117' ' ' ASP . . . . . 0.406 ' N ' ' OG1' ' A' ' 116' ' ' THR . 92.5 m-20 . . . . . 0 C--N 1.329 -0.317 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.616 179.827 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.717 0 N-CA-C 110.95 -0.86 . . . . 0.0 110.95 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 99.4 mm-40 -62.61 -36.9 84.23 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.955 0.407 . . . . 0.0 110.369 -179.987 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 93.7 mt-10 -51.21 -21.75 2.24 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.483 179.846 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 41.5 tp -42.98 -34.86 1.06 Allowed 'General case' 0 C--O 1.236 0.348 0 CA-C-O 120.998 0.427 . . . . 0.0 110.429 -179.625 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . 0.589 ' CB ' HH12 ' A' ' 10' ' ' ARG . 50.2 m -54.15 -35.18 61.96 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 120.493 -0.483 . . . . 0.0 109.958 179.789 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 71.3 tp60 -64.71 -33.24 75.5 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.96 -0.563 . . . . 0.0 110.44 179.504 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 86.3 t60 -59.16 -45.11 91.84 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-O 120.95 0.405 . . . . 0.0 110.069 -179.947 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -60.51 -43.38 97.13 Favored 'General case' 0 C--O 1.241 0.649 0 CA-C-N 116.034 -0.53 . . . . 0.0 109.874 179.478 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.589 HH12 ' CB ' ' A' ' 6' ' ' SER . 80.2 mtt85 -66.22 -37.31 85.24 Favored 'General case' 0 C--O 1.21 -0.974 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 179.61 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -53.28 -38.76 63.38 Favored 'General case' 0 C--N 1.319 -0.753 0 C-N-CA 120.445 -0.502 . . . . 0.0 110.172 -179.967 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 2.3 t -65.67 -52.93 44.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 C-N-CA 119.932 -0.707 . . . . 0.0 111.497 -179.868 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 77.0 tt0 -80.49 -48.64 12.5 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 120.403 -0.519 . . . . 0.0 112.004 -178.73 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . 0.501 ' N ' ' O ' ' A' ' 10' ' ' ARG . 60.9 tp60 -53.64 -53.0 58.12 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.909 -178.848 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.582 HD13 ' O ' ' A' ' 15' ' ' LEU . 0.4 OUTLIER -63.26 -49.29 74.7 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.35 -0.54 . . . . 0.0 110.121 -179.589 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 62.8 mttm -53.25 -33.81 54.55 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 120.499 -0.48 . . . . 0.0 110.268 179.319 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 89.3 mm-40 -75.42 -35.66 60.94 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.566 179.183 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -57.06 -34.44 68.25 Favored 'General case' 0 C--O 1.223 -0.296 0 CA-C-N 116.044 -0.526 . . . . 0.0 109.956 -179.931 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.9 mt -85.42 -33.48 21.93 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.096 0.474 . . . . 0.0 110.564 179.243 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -47.46 -43.28 24.05 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.541 -179.129 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . 0.493 ' C ' ' H ' ' A' ' 23' ' ' GLY . 0.1 OUTLIER -72.02 -24.07 61.5 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.555 -179.908 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 71.8 mmt-85 -74.69 24.08 0.09 Allowed 'General case' 0 C--O 1.233 0.187 0 CA-C-O 120.945 0.402 . . . . 0.0 110.435 179.906 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . 0.493 ' H ' ' C ' ' A' ' 21' ' ' THR . . . 82.49 17.96 67.43 Favored Glycine 0 CA--C 1.526 0.724 0 N-CA-C 110.89 -0.884 . . . . 0.0 110.89 179.876 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.593 HG12 ' N ' ' A' ' 25' ' ' LYS . 21.9 t -105.42 167.12 3.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 N-CA-C 110.294 -0.261 . . . . 0.0 110.294 -179.901 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.593 ' N ' HG12 ' A' ' 24' ' ' VAL . 69.9 mmtt -129.43 132.26 46.94 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.26 179.518 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.688 HG23 ' O ' ' A' ' 26' ' ' VAL . 30.8 m -127.83 105.22 13.26 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.252 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.239 -179.956 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.423 ' N ' ' OD1' ' A' ' 30' ' ' ASP . 8.3 pttm -104.89 163.39 12.56 Favored 'General case' 0 C--O 1.218 -0.579 0 N-CA-C 109.806 -0.442 . . . . 0.0 109.806 179.812 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 84.2 m-85 -42.86 -34.89 1.03 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.961 0.41 . . . . 0.0 110.782 179.981 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -56.85 -23.27 42.91 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.819 179.839 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.423 ' OD1' ' N ' ' A' ' 27' ' ' LYS . 1.1 m-20 -61.91 -46.97 87.04 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.613 -179.159 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.5 ' O ' ' CB ' ' A' ' 35' ' ' PHE . 5.8 mp -67.24 -41.56 85.42 Favored 'General case' 0 C--O 1.215 -0.73 0 CA-C-O 120.943 0.401 . . . . 0.0 110.393 179.738 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 42.3 mt -57.27 -45.86 83.64 Favored 'General case' 0 C--N 1.314 -0.973 0 C-N-CA 119.419 -0.913 . . . . 0.0 111.03 -178.359 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -84.32 -50.17 8.07 Favored 'General case' 0 C--N 1.32 -0.696 0 C-N-CA 120.472 -0.491 . . . . 0.0 111.909 -179.089 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . 0.858 ' O ' HG22 ' A' ' 38' ' ' VAL . 42.0 t80 -62.47 -49.56 74.92 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.461 -178.531 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.5 ' CB ' ' O ' ' A' ' 31' ' ' LEU . 22.4 t80 -61.22 -44.56 97.08 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.103 -179.567 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -69.37 -40.56 77.39 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 120.275 -0.57 . . . . 0.0 111.663 179.975 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.573 ' CE2' ' CE1' ' A' ' 63' ' ' PHE . 3.0 m-85 -62.08 -48.66 79.22 Favored 'General case' 0 CA--C 1.518 -0.278 0 CA-C-O 120.858 0.361 . . . . 0.0 111.887 -178.281 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.858 HG22 ' O ' ' A' ' 34' ' ' PHE . 17.1 m -70.03 -41.62 79.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.467 -179.745 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -63.04 -31.7 72.89 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.506 -0.316 . . . . 0.0 110.95 -179.732 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 98.8 m-20 -56.66 -49.71 74.24 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 120.906 -0.317 . . . . 0.0 111.113 -179.169 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.46 ' O ' ' SG ' ' A' ' 42' ' ' CYS . 15.4 p -106.64 -7.61 17.29 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.545 -0.298 . . . . 0.0 110.954 -179.741 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . 0.554 ' N ' ' O ' ' A' ' 38' ' ' VAL . 28.6 p 38.04 57.52 4.8 Favored Pre-proline 0 N--CA 1.463 0.186 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.303 -179.234 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -75.95 -31.42 5.06 Favored 'Trans proline' 0 C--N 1.314 -1.257 0 C-N-CA 122.551 2.167 . . . . 0.0 112.582 -179.4 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . 0.631 ' CH2' ' CE3' ' A' ' 56' ' ' TRP . 0.0 OUTLIER -77.76 13.75 1.25 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.89 -179.646 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.532 ' CD2' ' OD2' ' A' ' 52' ' ' ASP . 6.1 m-85 39.56 53.58 5.06 Favored Pre-proline 0 C--O 1.232 0.142 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.076 -179.874 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.444 ' CD ' ' N ' ' A' ' 45' ' ' PHE . 11.1 Cg_endo -53.38 -5.7 0.28 Allowed 'Trans proline' 0 C--N 1.31 -1.488 0 C-N-CA 122.714 2.276 . . . . 0.0 112.004 -179.688 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.462 ' H ' ' C ' ' A' ' 45' ' ' PHE . 64.1 tp60 -64.17 -48.79 74.6 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.333 -179.448 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -89.42 -30.24 18.47 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-O 120.908 0.385 . . . . 0.0 110.531 179.155 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 87.65 75.19 1.28 Allowed Glycine 0 CA--C 1.523 0.573 0 N-CA-C 110.844 -0.902 . . . . 0.0 110.844 -179.445 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 13.6 t -144.11 165.22 28.43 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.623 0.249 . . . . 0.0 110.653 -179.792 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.1 mt -98.96 133.85 40.05 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.265 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 179.283 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . 0.611 ' H ' ' HE1' ' A' ' 44' ' ' TRP . 73.7 m-20 -117.91 121.17 40.0 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.276 179.083 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 18.5 mm -87.32 -46.49 16.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.825 179.998 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -66.22 -45.84 79.29 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-O 121.108 0.48 . . . . 0.0 111.283 -179.775 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 77.3 mmt-85 -63.72 -33.97 76.84 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.908 -0.587 . . . . 0.0 109.909 -179.507 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' TRP . . . . . 0.631 ' CE3' ' CH2' ' A' ' 44' ' ' TRP . 50.3 t-105 -59.29 -36.79 76.21 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-O 121.3 0.572 . . . . 0.0 110.049 179.994 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 44.0 ttm180 -65.21 -41.33 94.58 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.308 179.55 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 95.2 mtt-85 -61.75 -53.07 61.01 Favored 'General case' 0 N--CA 1.466 0.334 0 C-N-CA 120.793 -0.363 . . . . 0.0 111.562 -179.491 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.499 HG13 ' N ' ' A' ' 60' ' ' GLY . 4.8 p -63.16 -45.93 97.26 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.391 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.198 179.632 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . 0.499 ' N ' HG13 ' A' ' 59' ' ' VAL . . . -63.04 -36.72 93.85 Favored Glycine 0 CA--C 1.524 0.615 0 N-CA-C 111.05 -0.82 . . . . 0.0 111.05 179.903 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 53.9 m-20 -65.24 -35.74 82.0 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.652 0.263 . . . . 0.0 110.692 -179.479 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 80.9 m -64.29 -55.33 22.09 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.821 0.344 . . . . 0.0 110.718 -179.93 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . 0.573 ' CE1' ' CE2' ' A' ' 37' ' ' PHE . 59.4 m-85 -64.47 -33.99 77.17 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.427 179.47 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 57.9 tt0 -60.0 -42.89 95.26 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 120.891 -0.324 . . . . 0.0 110.614 -179.88 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 20.8 t0 -61.1 -51.71 68.0 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.825 179.834 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 41.3 m-85 -65.97 -35.03 79.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.739 179.735 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 56.9 t80 -59.57 -44.41 93.31 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.291 -179.424 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 39.6 t30 -64.37 -40.33 95.62 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.579 179.941 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 41.0 p -66.1 -22.5 66.4 Favored 'General case' 0 CA--C 1.516 -0.332 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.342 179.933 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -70.04 -46.85 64.14 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 120.009 -0.676 . . . . 0.0 110.995 179.911 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . 0.509 ' H ' ' HD3' ' A' ' 72' ' ' PRO . . . 113.29 70.73 0.55 Allowed Glycine 0 CA--C 1.532 1.101 0 N-CA-C 110.698 -0.961 . . . . 0.0 110.698 -179.494 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . 0.509 ' HD3' ' H ' ' A' ' 71' ' ' GLY . 23.6 Cg_exo -63.93 147.34 92.01 Favored 'Trans proline' 0 N--CA 1.499 1.822 0 C-N-CA 123.029 2.486 . . . . 0.0 112.068 179.979 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -80.8 -49.52 11.0 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-O 120.953 0.406 . . . . 0.0 110.338 179.63 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.492 ' HD3' ' H ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -137.46 2.62 2.49 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.654 -179.481 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 68.8 t 57.7 93.5 0.05 OUTLIER Pre-proline 0 C--N 1.325 -0.48 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.211 -178.805 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -53.58 126.66 22.5 Favored 'Trans proline' 0 N--CA 1.495 1.59 0 C-N-CA 121.805 1.67 . . . . 0.0 111.786 -179.583 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.466 ' O ' ' N ' ' A' ' 80' ' ' PHE . 40.8 t -83.25 -20.53 9.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.679 179.822 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 63.6 p -41.55 -26.34 0.07 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.265 -179.27 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . 0.433 ' N ' ' O ' ' A' ' 77' ' ' VAL . . . -64.02 -42.69 97.04 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.546 179.654 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . 0.466 ' N ' ' O ' ' A' ' 77' ' ' VAL . 10.8 m-85 -64.5 -35.45 80.98 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.143 179.694 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 37.3 m -59.89 -42.09 93.01 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.353 179.814 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 4.1 m-85 -60.17 -51.36 69.91 Favored 'General case' 0 C--N 1.331 -0.215 0 C-N-CA 120.88 -0.328 . . . . 0.0 110.609 -179.951 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' TRP . . . . . . . . . . . . . 47.2 t90 -59.23 -39.01 81.39 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.645 179.66 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 12.4 m120 -61.86 -44.14 97.43 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.562 -179.651 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 25.0 tp -72.14 -59.32 2.8 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 120.358 -0.537 . . . . 0.0 110.135 179.359 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -50.74 -28.79 6.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-O 120.895 0.379 . . . . 0.0 110.395 179.709 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 66.0 tttt -65.26 -50.99 63.67 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.9 -179.293 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.1 pp20? -79.96 -20.1 46.35 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.801 -179.683 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.528 ' O ' HD13 ' A' ' 89' ' ' LEU . 0.2 OUTLIER -61.85 -46.24 90.31 Favored 'General case' 0 N--CA 1.443 -0.815 0 C-N-CA 120.158 -0.617 . . . . 0.0 110.486 -178.771 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 3.2 mt -63.67 -44.21 98.37 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 C-N-CA 119.891 -0.723 . . . . 0.0 109.937 -179.605 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 -64.88 -12.29 47.2 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.785 -178.988 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 68.1 tttt -74.04 139.83 44.98 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.377 179.736 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -74.86 -10.22 59.29 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.84 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 80.3 mm-40 -86.47 52.31 2.46 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.562 179.857 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 27.1 m -115.89 131.71 67.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.485 179.915 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' ASN . . . . . 0.445 ' OD1' ' N ' ' A' ' 96' ' ' ASN . 0.0 OUTLIER -58.76 161.88 7.73 Favored Pre-proline 0 C--N 1.324 -0.528 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.474 179.777 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -58.98 -13.22 17.86 Favored 'Trans proline' 0 N--CA 1.495 1.597 0 C-N-CA 122.821 2.347 . . . . 0.0 112.153 179.682 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . 0.43 ' OE1' ' OD1' ' A' ' 96' ' ' ASN . 0.9 OUTLIER . . . . . 0 C--N 1.321 -0.659 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.557 179.818 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 28.3 m . . . . . 0 N--CA 1.46 0.045 0 CA-C-O 120.695 0.284 . . . . 0.0 110.704 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -130.31 179.51 5.87 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.57 -179.97 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 108' ' ' GLU . . . . . 0.496 ' C ' ' N ' ' A' ' 110' ' ' LEU . 98.7 mt-10 -108.64 122.82 47.9 Favored 'General case' 0 CA--C 1.513 -0.445 0 CA-C-N 115.943 -0.571 . . . . 0.0 109.895 179.132 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 38.3 pt -49.45 -11.63 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.036 179.779 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.496 ' N ' ' C ' ' A' ' 108' ' ' GLU . 36.3 mt -68.16 -40.88 82.25 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.725 179.779 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -68.47 -39.98 81.16 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.357 -179.921 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 16.2 t -62.52 -44.42 96.4 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.856 -179.549 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 10.3 m120 -63.03 -40.82 98.86 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.539 -179.941 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 35.6 p -158.04 160.92 37.93 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.593 179.872 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 14.8 pt20 -100.88 7.66 43.54 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.377 179.89 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 11.4 m -60.75 -44.63 96.46 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.395 -179.676 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 59.7 t0 . . . . . 0 C--N 1.328 -0.328 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.842 -179.962 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.646 0 N-CA-C 110.987 -0.845 . . . . 0.0 110.987 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . 0.489 ' O ' ' N ' ' A' ' 5' ' ' LEU . 89.3 mt-30 -65.37 -22.08 66.76 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.819 0.342 . . . . 0.0 110.576 -179.828 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . 0.496 ' O ' ' N ' ' A' ' 7' ' ' GLN . 91.2 mt-10 -43.09 -20.52 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.558 179.912 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.489 ' N ' ' O ' ' A' ' 3' ' ' GLN . 59.6 tp -41.42 -37.47 1.05 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.602 179.671 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 96.3 p -59.09 -37.0 76.07 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.611 179.675 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . 0.496 ' N ' ' O ' ' A' ' 4' ' ' GLU . 58.3 tt0 -65.11 -37.01 86.1 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.552 179.05 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 78.8 t60 -53.83 -45.81 70.99 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.519 179.636 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -60.77 -46.24 91.22 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.553 179.688 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.487 ' O ' ' CB ' ' A' ' 14' ' ' GLN . 88.5 mtt-85 -64.91 -32.28 73.91 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.566 179.496 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.584 ' CE1' HD23 ' A' ' 15' ' ' LEU . 48.1 t80 -59.72 -35.19 74.03 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.529 179.854 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 4.2 t -65.21 -48.27 84.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.53 -178.935 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -83.79 -32.71 25.22 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.563 -179.82 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . 0.487 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 60.8 tp60 -73.58 -50.27 22.11 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.562 -178.186 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.68 HD13 ' O ' ' A' ' 15' ' ' LEU . 0.3 OUTLIER -63.45 -47.6 81.2 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.521 179.761 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.452 ' HB3' HG11 ' A' ' 26' ' ' VAL . 92.7 mttt -57.33 -32.76 67.04 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.582 179.086 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 60.1 tt0 -73.12 -37.52 66.64 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.598 178.461 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -56.76 -32.98 66.13 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.533 179.442 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.416 ' O ' ' N ' ' A' ' 22' ' ' ARG . 2.8 mt -85.73 -33.13 21.55 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.597 178.569 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 63.9 tttm -44.44 -42.65 7.18 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.559 -179.928 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . 0.576 ' C ' ' H ' ' A' ' 23' ' ' GLY . 0.2 OUTLIER -75.39 -27.7 59.19 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.516 -179.706 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.416 ' N ' ' O ' ' A' ' 19' ' ' LEU . 77.8 mmt-85 -68.9 21.64 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.536 -179.874 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . 0.576 ' H ' ' C ' ' A' ' 21' ' ' THR . . . 87.56 14.11 64.1 Favored Glycine 0 CA--C 1.525 0.7 0 N-CA-C 110.887 -0.885 . . . . 0.0 110.887 -179.567 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.558 HG12 ' N ' ' A' ' 25' ' ' LYS . 11.3 t -104.89 167.19 2.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-O 120.871 0.367 . . . . 0.0 110.538 179.726 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.558 ' N ' HG12 ' A' ' 24' ' ' VAL . 99.3 mttt -135.23 120.95 19.53 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.534 179.62 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.466 HG23 ' O ' ' A' ' 26' ' ' VAL . 17.2 m -120.53 116.12 49.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.551 -179.769 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 29.9 pttt -108.67 166.93 10.43 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.541 179.953 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 98.4 m-85 -47.29 -40.01 15.86 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.551 179.384 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -57.99 -23.38 53.7 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.609 179.547 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 54.9 t0 -62.08 -43.79 98.08 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.548 -179.647 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.525 ' O ' ' CB ' ' A' ' 35' ' ' PHE . 5.6 mp -66.48 -43.45 85.38 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.588 179.545 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.431 ' O ' ' OD2' ' A' ' 36' ' ' ASP . 35.4 mt -58.4 -42.44 87.18 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.508 -177.852 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 85.3 tttt -86.33 -51.69 6.08 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.577 -178.229 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 57.6 t80 -61.7 -49.53 76.11 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.543 -177.669 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.525 ' CB ' ' O ' ' A' ' 31' ' ' LEU . 6.7 t80 -62.26 -44.83 95.66 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.593 -178.398 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . 0.431 ' OD2' ' O ' ' A' ' 32' ' ' LEU . 98.4 m-20 -66.95 -35.45 80.0 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.45 -179.644 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 2.3 m-85 -61.18 -52.56 64.29 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.558 -178.642 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.561 ' O ' ' N ' ' A' ' 42' ' ' CYS . 23.0 m -68.06 -38.89 80.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.623 -178.442 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -61.62 -25.94 67.67 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.517 -179.067 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 67.3 t0 -55.61 -55.3 33.69 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.49 -178.693 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.506 ' O ' ' SG ' ' A' ' 42' ' ' CYS . 15.5 p -115.35 -2.65 12.58 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.561 -178.517 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . 0.561 ' N ' ' O ' ' A' ' 38' ' ' VAL . 23.1 p 38.25 59.25 5.05 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.558 -179.418 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . 0.418 ' C ' ' H ' ' A' ' 45' ' ' PHE . 64.8 Cg_endo -77.12 -23.97 9.99 Favored 'Trans proline' 0 C--N 1.305 -1.72 0 C-N-CA 122.871 2.38 . . . . 0.0 112.142 -179.57 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . 0.534 ' CZ3' ' CE3' ' A' ' 56' ' ' TRP . 0.0 OUTLIER -69.36 5.1 1.41 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.569 -179.477 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.418 ' H ' ' C ' ' A' ' 43' ' ' PRO . 38.4 t80 48.2 57.56 17.97 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.572 179.79 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 23.2 Cg_endo -61.0 -7.09 7.18 Favored 'Trans proline' 0 C--N 1.305 -1.74 0 C-N-CA 122.758 2.305 . . . . 0.0 112.16 -178.777 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 82.6 mt-30 -54.7 -52.91 60.95 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.541 -179.796 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 43.8 tp10 -89.68 -27.69 19.95 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.619 179.317 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 85.73 66.04 1.43 Allowed Glycine 0 CA--C 1.525 0.671 0 N-CA-C 110.978 -0.849 . . . . 0.0 110.978 -178.847 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 10.7 t -132.77 170.2 15.61 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.788 0.327 . . . . 0.0 110.584 -179.449 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.8 mt -93.66 141.55 14.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.549 179.532 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . 0.522 ' H ' ' HE1' ' A' ' 44' ' ' TRP . 1.2 m-20 -114.51 122.76 47.56 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.542 179.784 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.47 ' CG1' HD12 ' A' ' 90' ' ' ILE . 25.2 mm -96.16 -55.75 5.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.648 179.648 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 67.8 mttm -73.34 -49.26 28.29 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.569 -178.978 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -62.16 -32.01 72.58 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.561 -178.555 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' TRP . . . . . 0.534 ' CE3' ' CZ3' ' A' ' 44' ' ' TRP . 13.0 t-105 -62.86 -38.28 90.2 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.557 179.304 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -64.31 -36.4 83.98 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.523 -179.728 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 94.6 mtt180 -60.54 -53.4 57.93 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.591 -179.294 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.429 HG13 ' N ' ' A' ' 60' ' ' GLY . 2.6 p -66.96 -42.72 89.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.629 -179.862 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . 0.429 ' N ' HG13 ' A' ' 59' ' ' VAL . . . -62.72 -37.77 95.37 Favored Glycine 0 CA--C 1.525 0.707 0 N-CA-C 110.915 -0.874 . . . . 0.0 110.915 179.695 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 95.4 m-20 -65.88 -40.37 91.55 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.878 0.371 . . . . 0.0 110.602 -179.238 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 76.7 m -63.34 -57.18 11.2 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.568 -178.927 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 37.8 m-85 -64.4 -42.67 95.96 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.62 -179.153 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 55.8 tt0 -63.92 -34.43 77.95 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.558 -179.345 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.401 ' O ' HG23 ' A' ' 69' ' ' THR . 41.2 t0 -60.33 -53.44 57.62 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.597 -179.945 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 65.7 m-85 -69.81 -39.19 76.67 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.507 179.962 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 69.5 t80 -60.55 -41.07 93.77 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.586 -179.844 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . 0.452 ' OD1' ' O ' ' A' ' 72' ' ' PRO . 51.2 t-20 -65.36 -45.52 83.83 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.536 -179.387 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.401 HG23 ' O ' ' A' ' 65' ' ' ASP . 80.4 p -68.87 -16.78 63.86 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.594 -179.185 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 2.3 m-85 -76.02 -5.66 47.45 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.596 -179.325 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . 0.493 ' O ' ' N ' ' A' ' 73' ' ' GLU . . . 153.94 -67.14 0.31 Allowed Glycine 0 CA--C 1.525 0.715 0 N-CA-C 110.912 -0.875 . . . . 0.0 110.912 179.535 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . 0.452 ' O ' ' OD1' ' A' ' 68' ' ' ASN . 38.6 Cg_exo -39.69 88.12 0.01 OUTLIER 'Trans proline' 0 C--N 1.304 -1.812 0 C-N-CA 122.815 2.344 . . . . 0.0 112.114 -176.874 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.493 ' N ' ' O ' ' A' ' 71' ' ' GLY . 83.2 tt0 -66.24 -34.65 78.49 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.576 179.589 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.7 ' CD ' ' H ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -97.0 -16.72 20.46 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.549 179.9 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.511 ' O ' ' O ' ' A' ' 74' ' ' LYS . 19.8 t 57.4 132.04 0.02 OUTLIER Pre-proline 0 C--N 1.329 -0.323 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.526 179.447 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 41.1 Cg_exo -50.44 123.65 11.68 Favored 'Trans proline' 0 C--N 1.305 -1.737 0 C-N-CA 122.864 2.376 . . . . 0.0 112.101 178.352 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.417 ' O ' ' N ' ' A' ' 80' ' ' PHE . 40.6 t -81.79 -20.33 10.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.531 -179.795 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . 0.41 ' O ' ' OG ' ' A' ' 81' ' ' SER . 22.7 p -43.1 -24.8 0.09 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.585 178.815 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.91 -37.74 86.88 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.534 179.92 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . 0.417 ' N ' ' O ' ' A' ' 77' ' ' VAL . 2.5 m-85 -63.1 -37.17 86.16 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.601 -179.263 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . 0.41 ' OG ' ' O ' ' A' ' 78' ' ' THR . 93.3 p -58.62 -39.6 80.94 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.574 -179.727 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 11.2 m-85 -61.17 -47.73 84.82 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.601 179.688 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' TRP . . . . . 0.422 ' O ' ' CB ' ' A' ' 87' ' ' LYS . 40.0 t90 -59.19 -37.82 78.35 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.568 -179.528 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 97.5 m-20 -61.24 -47.04 87.87 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.549 -178.598 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 25.4 tp -72.27 -55.44 7.17 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.563 179.782 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -56.11 -25.37 19.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.567 179.506 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.422 ' CB ' ' O ' ' A' ' 83' ' ' TRP . 57.1 tttt -67.56 -50.78 56.89 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.61 179.467 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . 0.469 ' C ' ' CD ' ' A' ' 88' ' ' GLU . 0.9 OUTLIER -78.96 -20.17 49.89 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.551 -179.873 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.581 ' O ' HD13 ' A' ' 89' ' ' LEU . 0.2 OUTLIER -60.29 -49.42 77.66 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.535 179.845 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.47 HD12 ' CG1' ' A' ' 53' ' ' ILE . 3.3 mt -63.79 -41.09 91.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.56 179.21 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 97.5 m-20 -69.18 -16.43 63.62 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.572 -179.409 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 70.4 tttt -68.4 140.97 55.83 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.561 -179.886 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -70.9 -4.56 25.05 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.488 -179.522 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 27.5 tp10 -84.57 46.78 1.27 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.562 -179.579 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 34.1 m -125.83 132.91 70.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.519 -179.807 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' ASN . . . . . 0.587 ' O ' ' N ' ' A' ' 98' ' ' GLN . 10.1 m-20 -87.18 157.58 53.54 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.548 -179.249 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_exo -41.35 -13.24 0.03 OUTLIER 'Trans proline' 0 C--N 1.305 -1.733 0 C-N-CA 122.812 2.341 . . . . 0.0 112.147 178.785 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . 0.587 ' N ' ' O ' ' A' ' 96' ' ' ASN . 6.9 pt20 . . . . . 0 C--N 1.33 -0.262 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.554 179.951 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 28.9 m . . . . . 0 C--O 1.231 0.11 0 CA-C-O 120.82 0.343 . . . . 0.0 110.556 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 86.9 mt-10 -124.19 -175.61 3.29 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.519 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 108' ' ' GLU . . . . . 0.55 ' O ' ' N ' ' A' ' 110' ' ' LEU . 73.8 mm-40 -106.58 122.45 46.34 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.553 179.373 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . 0.418 ' O ' ' OG ' ' A' ' 112' ' ' SER . 43.8 pt -45.49 -12.87 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.595 179.869 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.55 ' N ' ' O ' ' A' ' 108' ' ' GLU . 25.6 mt -67.11 -44.94 78.68 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.509 179.843 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 62.4 tttm -65.34 -33.86 76.96 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.566 -179.605 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . 0.418 ' OG ' ' O ' ' A' ' 109' ' ' ILE . 97.0 p -63.57 -46.83 84.09 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.551 -179.813 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 31.7 t30 -65.57 -42.45 91.79 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.588 179.608 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 114' ' ' SER . . . . . 0.444 ' C ' ' H ' ' A' ' 116' ' ' THR . 22.8 t -164.51 132.57 3.38 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.552 179.994 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 86.6 mt-30 -77.94 27.65 0.18 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.54 179.984 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 116' ' ' THR . . . . . 0.444 ' H ' ' C ' ' A' ' 114' ' ' SER . 7.8 m -61.22 -41.3 96.62 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.557 179.914 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 95.0 m-20 . . . . . 0 C--N 1.329 -0.299 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.592 179.656 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.704 0 N-CA-C 110.941 -0.864 . . . . 0.0 110.941 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 52.3 tt0 -63.14 -29.38 70.75 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.871 0.367 . . . . 0.0 110.444 -179.827 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 95.2 mt-10 -55.97 -22.98 29.52 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.651 179.811 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 43.2 tp -44.23 -35.3 2.2 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.511 -179.525 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 78.2 p -55.03 -35.14 64.13 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.641 -0.423 . . . . 0.0 109.92 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 68.2 tp60 -64.11 -35.57 81.17 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.181 179.561 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 83.2 t60 -60.28 -44.62 95.18 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.257 179.988 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -58.78 -46.53 87.3 Favored 'General case' 0 C--O 1.241 0.613 0 C-N-CA 120.522 -0.471 . . . . 0.0 110.183 -179.923 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.443 ' O ' ' CB ' ' A' ' 14' ' ' GLN . 87.2 mtt-85 -67.21 -36.53 81.92 Favored 'General case' 0 C--O 1.21 -1.008 0 N-CA-C 109.322 -0.622 . . . . 0.0 109.322 179.607 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.445 ' OH ' HD11 ' A' ' 51' ' ' ILE . 20.3 t80 -57.87 -27.9 63.67 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 120.878 -0.329 . . . . 0.0 110.313 -179.433 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 6.7 t -73.8 -51.16 25.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 C-N-CA 120.241 -0.584 . . . . 0.0 111.109 179.69 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -81.49 -23.72 37.17 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.084 0.469 . . . . 0.0 111.635 -179.329 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . 0.443 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 66.5 tp60 -77.49 -53.57 7.47 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.978 -179.117 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.572 HD13 ' O ' ' A' ' 15' ' ' LEU . 0.2 OUTLIER -63.47 -45.4 90.98 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-O 120.896 0.379 . . . . 0.0 110.062 -179.907 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.552 ' HB3' HG11 ' A' ' 26' ' ' VAL . 98.3 mttt -59.99 -36.22 76.7 Favored 'General case' 0 C--O 1.232 0.145 0 C-N-CA 120.617 -0.433 . . . . 0.0 109.953 179.568 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 73.9 mt-30 -72.94 -40.33 65.48 Favored 'General case' 0 C--O 1.238 0.453 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.632 178.738 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -57.33 -26.57 61.14 Favored 'General case' 0 CA--C 1.518 -0.256 0 CA-C-N 115.918 -0.583 . . . . 0.0 109.97 179.935 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 4.2 mt -84.71 -40.96 16.71 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.846 -0.342 . . . . 0.0 110.452 178.949 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 28.8 mtmt -45.45 -44.2 12.04 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.124 -178.885 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . 0.447 ' H ' HG22 ' A' ' 21' ' ' THR . 0.1 OUTLIER -58.5 -34.33 70.82 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 120.422 -0.511 . . . . 0.0 110.425 -179.5 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 84.2 mmt-85 -66.56 -7.09 17.72 Favored 'General case' 0 C--N 1.332 -0.195 0 C-N-CA 120.656 -0.418 . . . . 0.0 110.295 -179.881 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 107.22 23.7 6.87 Favored Glycine 0 CA--C 1.526 0.778 0 N-CA-C 111.021 -0.832 . . . . 0.0 111.021 -179.721 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.66 HG12 ' N ' ' A' ' 25' ' ' LYS . 38.6 t -102.89 169.32 1.96 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 N-CA-C 110.337 -0.246 . . . . 0.0 110.337 -179.991 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.66 ' N ' HG12 ' A' ' 24' ' ' VAL . 99.0 mttt -134.65 131.82 38.22 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.985 -0.376 . . . . 0.0 109.985 179.268 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.552 HG11 ' HB3' ' A' ' 16' ' ' LYS . 28.4 m -122.88 129.23 75.26 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.285 0 N-CA-C 109.989 -0.374 . . . . 0.0 109.989 179.887 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 23.7 ttmt -109.53 159.99 16.61 Favored 'General case' 0 N--CA 1.463 0.18 0 N-CA-C 110.065 -0.346 . . . . 0.0 110.065 179.585 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -50.61 -31.77 16.93 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.001 0.429 . . . . 0.0 109.867 179.341 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -55.34 -23.31 23.29 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.225 179.414 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.423 ' O ' ' CB ' ' A' ' 34' ' ' PHE . 86.0 m-20 -61.2 -48.15 82.84 Favored 'General case' 0 C--O 1.219 -0.512 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.56 -179.525 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.495 ' O ' ' CB ' ' A' ' 35' ' ' PHE . 5.3 mp -66.07 -41.45 90.74 Favored 'General case' 0 C--O 1.216 -0.708 0 C-N-CA 120.571 -0.452 . . . . 0.0 110.385 179.469 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 37.8 mt -58.97 -46.3 88.45 Favored 'General case' 0 C--N 1.313 -0.99 0 C-N-CA 119.468 -0.893 . . . . 0.0 111.176 -178.013 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.441 ' O ' ' CB ' ' A' ' 37' ' ' PHE . 87.9 tttt -85.49 -48.17 9.22 Favored 'General case' 0 C--N 1.319 -0.754 0 C-N-CA 120.553 -0.459 . . . . 0.0 112.091 -178.692 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . 0.825 ' O ' HG22 ' A' ' 38' ' ' VAL . 44.0 t80 -63.54 -48.07 79.04 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.376 -178.993 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.495 ' CB ' ' O ' ' A' ' 31' ' ' LEU . 18.4 t80 -61.85 -48.41 80.68 Favored 'General case' 0 C--N 1.33 -0.242 0 C-N-CA 120.475 -0.49 . . . . 0.0 110.363 -179.146 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 65.8 t0 -72.96 -34.8 66.72 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 120.474 -0.49 . . . . 0.0 111.462 -179.803 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.712 ' CZ ' HG22 ' A' ' 59' ' ' VAL . 4.3 t80 -60.99 -48.5 81.55 Favored 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 120.984 -0.286 . . . . 0.0 111.635 -178.296 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.825 HG22 ' O ' ' A' ' 34' ' ' PHE . 15.4 m -74.6 -36.93 42.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 C-N-CA 120.408 -0.517 . . . . 0.0 110.688 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -55.7 -29.79 60.02 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.867 -179.813 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 68.0 t0 -47.03 -61.49 1.85 Allowed 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 120.646 -0.421 . . . . 0.0 110.745 -179.744 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 13.9 p -114.8 2.01 14.27 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.345 -0.388 . . . . 0.0 111.049 179.822 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . 0.539 ' N ' ' O ' ' A' ' 38' ' ' VAL . 1.9 m 38.07 58.59 4.9 Favored Pre-proline 0 CA--C 1.534 0.364 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.831 -178.706 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . 0.49 ' C ' ' H ' ' A' ' 45' ' ' PHE . 26.9 Cg_exo -63.39 -36.97 52.32 Favored 'Trans proline' 0 N--CA 1.5 1.885 0 C-N-CA 122.617 2.211 . . . . 0.0 112.857 -179.069 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . 0.829 ' HE1' ' H ' ' A' ' 52' ' ' ASP . 0.0 OUTLIER -66.45 6.19 0.48 Allowed 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.62 -179.281 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.493 ' C ' ' H ' ' A' ' 47' ' ' GLN . 19.8 m-85 44.25 56.48 13.51 Favored Pre-proline 0 C--N 1.33 -0.24 0 N-CA-C 109.887 -0.412 . . . . 0.0 109.887 -179.832 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 10.2 Cg_endo -51.27 -6.34 0.12 Allowed 'Trans proline' 0 N--CA 1.493 1.445 0 C-N-CA 122.773 2.316 . . . . 0.0 111.917 179.929 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.493 ' H ' ' C ' ' A' ' 45' ' ' PHE . 95.9 mm-40 -62.72 -52.04 64.82 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.128 -179.913 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.482 ' N ' ' CD ' ' A' ' 48' ' ' GLU . 0.0 OUTLIER -88.0 -31.82 19.14 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-O 121.04 0.448 . . . . 0.0 110.169 178.973 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 85.7 66.18 1.42 Allowed Glycine 0 CA--C 1.523 0.554 0 N-CA-C 110.616 -0.994 . . . . 0.0 110.616 -178.731 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 14.8 t -125.98 170.24 11.91 Favored 'General case' 0 CA--C 1.517 -0.305 0 CA-C-O 120.679 0.276 . . . . 0.0 110.772 -179.502 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.445 HD11 ' OH ' ' A' ' 11' ' ' TYR . 1.3 mt -102.36 138.88 25.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.198 179.814 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . 0.829 ' H ' ' HE1' ' A' ' 44' ' ' TRP . 84.2 m-20 -114.28 122.15 45.84 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.726 179.644 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.504 ' CG1' HD12 ' A' ' 90' ' ' ILE . 29.9 mm -94.63 -55.86 5.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.506 179.735 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -78.01 -50.48 12.02 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-O 121.032 0.444 . . . . 0.0 111.707 -179.06 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 93.1 mtt-85 -59.47 -32.01 69.85 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.082 -0.508 . . . . 0.0 109.863 -179.64 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' TRP . . . . . 0.573 ' CE3' ' CH2' ' A' ' 44' ' ' TRP . 23.2 t-105 -60.7 -40.81 93.64 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.449 179.098 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 92.5 mtm-85 -63.28 -33.63 75.93 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 120.291 -0.564 . . . . 0.0 109.831 179.92 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 74.0 ttt180 -60.41 -52.47 65.1 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 120.315 -0.554 . . . . 0.0 110.853 -179.571 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.712 HG22 ' CZ ' ' A' ' 37' ' ' PHE . 4.3 p -69.0 -42.8 82.26 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.571 0 CA-C-O 120.71 0.29 . . . . 0.0 110.567 179.48 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . 0.435 ' O ' ' CB ' ' A' ' 64' ' ' GLN . . . -65.27 -47.58 78.72 Favored Glycine 0 CA--C 1.525 0.688 0 CA-C-N 116.297 -0.41 . . . . 0.0 112.337 -178.945 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 96.9 m-20 -60.98 -40.76 94.65 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.784 0.292 . . . . 0.0 111.296 -178.552 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 70.7 m -61.72 -59.92 4.45 Favored 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 120.708 -0.397 . . . . 0.0 111.467 -179.299 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 15.4 m-85 -65.72 -42.71 90.75 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.342 -179.805 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . 0.473 ' HG2' HD21 ' A' ' 68' ' ' ASN . 58.2 tt0 -61.17 -41.31 96.57 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.388 -179.458 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 24.8 t0 -55.46 -56.78 16.19 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.872 0.368 . . . . 0.0 110.906 -179.757 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 50.5 m-85 -64.57 -43.31 94.3 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 120.57 -0.452 . . . . 0.0 110.421 179.664 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 64.7 t80 -52.65 -42.33 64.58 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.596 -179.351 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . 0.473 HD21 ' HG2' ' A' ' 64' ' ' GLN . 19.3 m-20 -62.77 -42.51 99.72 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.421 -179.298 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 25.0 p -71.67 -16.46 62.25 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.495 -179.992 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -87.35 12.83 11.04 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.769 -179.632 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 152.06 -79.17 0.2 Allowed Glycine 0 CA--C 1.53 0.98 0 C-N-CA 120.384 -0.912 . . . . 0.0 112.322 179.039 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_exo -40.59 100.84 0.03 OUTLIER 'Trans proline' 0 C--N 1.307 -1.642 0 C-N-CA 122.712 2.275 . . . . 0.0 112.06 -178.514 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 80.2 mm-40 -73.47 -42.76 61.51 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.655 -0.702 . . . . 0.0 109.928 179.19 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.668 ' CD ' ' H ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -94.95 -13.39 25.38 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.091 179.779 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.485 ' O ' ' O ' ' A' ' 74' ' ' LYS . 36.4 t 56.22 123.77 0.01 OUTLIER Pre-proline 0 CA--C 1.544 0.715 0 O-C-N 123.143 0.277 . . . . 0.0 111.416 -179.938 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_exo -53.24 128.04 27.56 Favored 'Trans proline' 0 N--CA 1.495 1.616 0 C-N-CA 121.166 1.244 . . . . 0.0 112.251 179.232 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.453 ' O ' ' N ' ' A' ' 80' ' ' PHE . 59.8 t -82.84 -18.42 10.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 115.38 -0.827 . . . . 0.0 110.65 179.211 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 62.7 p -42.98 -24.23 0.06 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.924 0.392 . . . . 0.0 110.433 -179.621 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . 0.436 ' N ' ' O ' ' A' ' 77' ' ' VAL . . . -64.88 -37.88 89.09 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.784 179.642 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . 0.453 ' N ' ' O ' ' A' ' 77' ' ' VAL . 3.7 m-85 -58.94 -33.14 70.25 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.418 -179.744 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 39.0 t -60.3 -42.94 96.59 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.115 179.708 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 -59.69 -49.91 75.92 Favored 'General case' 0 CA--C 1.517 -0.311 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.586 179.722 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' TRP . . . . . 0.471 ' C ' ' CD1' ' A' ' 83' ' ' TRP . 8.3 t-105 -54.51 -40.38 68.51 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.733 -179.826 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 87.6 m-20 -61.98 -44.84 95.9 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 120.461 -0.496 . . . . 0.0 111.153 -179.404 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 29.9 tp -73.29 -55.08 6.9 Favored 'General case' 0 C--O 1.222 -0.377 0 C-N-CA 120.31 -0.556 . . . . 0.0 110.565 179.569 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -55.58 -25.77 18.54 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 C-N-CA 120.591 -0.444 . . . . 0.0 110.406 179.921 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 67.4 tttt -67.4 -50.68 58.49 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.656 179.648 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . 0.413 ' OE1' ' O ' ' A' ' 88' ' ' GLU . 1.1 pp20? -79.76 -20.02 47.3 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.745 -0.661 . . . . 0.0 111.113 -179.077 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.531 ' O ' HD13 ' A' ' 89' ' ' LEU . 0.2 OUTLIER -62.05 -46.3 89.76 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 120.66 -0.416 . . . . 0.0 110.227 -179.446 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.504 HD12 ' CG1' ' A' ' 53' ' ' ILE . 3.8 mt -64.69 -43.05 96.61 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.215 0 C-N-CA 120.184 -0.606 . . . . 0.0 109.85 -179.662 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -54.92 -42.83 72.7 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.974 -178.758 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 58.9 mmtt -48.32 131.13 16.71 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 120.668 -0.413 . . . . 0.0 110.4 -179.991 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -63.57 -37.43 87.29 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.603 179.854 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 70.5 tt0 -69.92 54.98 0.13 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.347 -179.625 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 35.5 m -70.44 155.51 7.58 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-O 120.946 0.403 . . . . 0.0 110.057 -179.948 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' ASN . . . . . . . . . . . . . 1.3 m-20 -59.28 160.42 12.63 Favored Pre-proline 0 C--N 1.325 -0.476 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.873 -179.289 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -60.02 -10.83 13.46 Favored 'Trans proline' 0 N--CA 1.494 1.503 0 C-N-CA 123.101 2.534 . . . . 0.0 111.941 179.391 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 5.0 pt20 . . . . . 0 C--N 1.321 -0.633 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.869 -179.412 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 3.6 t . . . . . 0 C--O 1.231 0.118 0 CA-C-O 120.711 0.291 . . . . 0.0 110.635 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 89.9 mt-10 -89.0 149.17 23.38 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.459 -179.822 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 108' ' ' GLU . . . . . 0.522 ' C ' ' H ' ' A' ' 110' ' ' LEU . 97.0 mt-10 -73.84 139.16 44.89 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 120.378 -0.529 . . . . 0.0 109.655 179.092 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 26.7 pt -54.86 -5.21 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.127 179.452 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.622 ' O ' HD12 ' A' ' 110' ' ' LEU . 3.4 pp -170.35 120.05 0.59 Allowed 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 116.251 -0.431 . . . . 0.0 109.99 179.789 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . 0.448 ' HG3' ' H ' ' A' ' 114' ' ' SER . 25.5 pttm -139.4 151.12 46.03 Favored 'General case' 0 C--O 1.231 0.124 0 CA-C-O 120.67 0.271 . . . . 0.0 110.377 -179.512 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 88.1 p -60.42 -22.28 63.21 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.667 -179.358 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 39.7 t30 -64.63 -40.81 96.11 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.682 179.73 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 114' ' ' SER . . . . . 0.448 ' H ' ' HG3' ' A' ' 111' ' ' LYS . 23.3 t -117.64 -68.0 0.95 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.917 179.991 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 9.3 mt-30 41.31 86.48 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.034 0.445 . . . . 0.0 110.744 -179.73 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 72.0 p -74.28 -22.86 59.11 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.009 -0.542 . . . . 0.0 110.353 179.869 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 97.7 m-20 . . . . . 0 C--N 1.329 -0.298 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.6 179.855 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.704 0 N-CA-C 110.958 -0.857 . . . . 0.0 110.958 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 77.5 mt-30 -58.27 -31.31 67.33 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.898 0.38 . . . . 0.0 110.624 -179.921 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . 0.431 ' OE1' ' OE1' ' A' ' 7' ' ' GLN . 78.0 mm-40 -51.91 -23.48 5.0 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.284 -179.945 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 37.2 tp -42.84 -27.2 0.17 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.439 -179.406 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 37.6 t -59.68 -41.64 91.14 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.15 179.661 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . 0.431 ' OE1' ' OE1' ' A' ' 4' ' ' GLU . 89.1 mt-30 -61.96 -30.19 70.75 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.569 179.827 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 84.5 t60 -63.46 -44.83 93.33 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.822 0.344 . . . . 0.0 110.359 179.932 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 80.5 tt0 -59.66 -50.13 75.04 Favored 'General case' 0 C--O 1.243 0.721 0 CA-C-O 121.361 0.6 . . . . 0.0 110.352 179.7 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.43 ' O ' ' CB ' ' A' ' 14' ' ' GLN . 86.2 mtt180 -62.44 -33.18 74.3 Favored 'General case' 0 C--O 1.211 -0.956 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 179.55 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 31.7 t80 -58.89 -36.4 74.59 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 110.175 -0.305 . . . . 0.0 110.175 -179.588 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.406 HG11 ' CD2' ' A' ' 31' ' ' LEU . 3.6 t -64.36 -49.66 79.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 C-N-CA 119.987 -0.685 . . . . 0.0 111.488 179.997 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -81.08 -30.74 34.62 Favored 'General case' 0 C--N 1.324 -0.523 0 C-N-CA 120.582 -0.447 . . . . 0.0 111.826 -179.357 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . 0.43 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 60.5 tp60 -74.23 -52.17 13.18 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.916 -0.583 . . . . 0.0 110.896 -178.982 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.568 HD13 ' O ' ' A' ' 15' ' ' LEU . 0.2 OUTLIER -62.91 -44.21 96.7 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 120.407 -0.517 . . . . 0.0 109.809 -179.557 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.662 ' HB3' HG21 ' A' ' 26' ' ' VAL . 66.0 mttm -59.53 -34.4 72.6 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.848 0.356 . . . . 0.0 110.198 179.091 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 35.8 mm-40 -66.58 -42.01 87.65 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.489 0.661 . . . . 0.0 110.022 179.038 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.624 ' O ' HG22 ' A' ' 21' ' ' THR . . . -61.39 -28.66 69.4 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.912 -0.585 . . . . 0.0 109.732 179.277 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.9 mt -74.19 -33.85 63.56 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.933 0.397 . . . . 0.0 110.652 178.651 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 67.8 mttm -54.56 -37.33 65.34 Favored 'General case' 0 C--N 1.323 -0.548 0 C-N-CA 120.188 -0.605 . . . . 0.0 109.883 -179.775 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . 0.624 HG22 ' O ' ' A' ' 18' ' ' ALA . 1.2 t -60.57 -28.1 68.2 Favored 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 120.397 -0.521 . . . . 0.0 110.863 179.37 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 7.7 mmm180 -80.2 12.79 2.65 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-O 120.98 0.419 . . . . 0.0 110.584 -179.567 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 81.04 14.0 80.1 Favored Glycine 0 CA--C 1.522 0.514 0 N-CA-C 110.491 -1.044 . . . . 0.0 110.491 -179.8 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.581 HG12 ' N ' ' A' ' 25' ' ' LYS . 37.9 t -86.83 165.34 2.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 C-N-CA 120.981 -0.287 . . . . 0.0 110.446 -179.706 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.581 ' N ' HG12 ' A' ' 24' ' ' VAL . 99.1 mttt -139.12 129.61 25.76 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 120.916 -0.314 . . . . 0.0 110.235 179.429 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.662 HG21 ' HB3' ' A' ' 16' ' ' LYS . 13.7 m -126.74 130.89 71.57 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.239 0 N-CA-C 109.943 -0.391 . . . . 0.0 109.943 179.584 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.55 ' N ' ' OD2' ' A' ' 30' ' ' ASP . 10.9 ttmt -109.16 161.78 14.89 Favored 'General case' 0 C--O 1.221 -0.401 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 179.674 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.411 ' H ' ' HG2' ' A' ' 27' ' ' LYS . 98.4 m-85 -41.89 -33.28 0.51 Allowed 'General case' 0 C--O 1.236 0.392 0 CA-C-O 121.101 0.477 . . . . 0.0 110.796 179.646 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.401 ' HA ' HD12 ' A' ' 32' ' ' LEU . . . -55.7 -22.45 23.52 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.525 179.702 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.55 ' OD2' ' N ' ' A' ' 27' ' ' LYS . 3.2 m-20 -58.55 -49.48 77.27 Favored 'General case' 0 CA--C 1.516 -0.364 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.281 -179.396 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.5 ' O ' ' CB ' ' A' ' 35' ' ' PHE . 4.9 mp -67.21 -41.27 86.05 Favored 'General case' 0 C--O 1.215 -0.75 0 CA-C-O 120.985 0.421 . . . . 0.0 110.242 179.273 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.448 ' O ' ' OD1' ' A' ' 36' ' ' ASP . 40.8 mt -59.04 -44.97 91.84 Favored 'General case' 0 C--N 1.315 -0.927 0 C-N-CA 119.692 -0.803 . . . . 0.0 111.246 -178.238 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.527 ' O ' ' CD1' ' A' ' 37' ' ' PHE . 88.6 tttt -84.53 -37.79 20.82 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.939 -178.658 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . 0.581 ' O ' HG22 ' A' ' 38' ' ' VAL . 62.4 t80 -78.07 -51.03 10.93 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.393 -178.681 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.5 ' CB ' ' O ' ' A' ' 31' ' ' LEU . 12.9 t80 -60.07 -46.55 89.19 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.389 -179.327 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . 0.468 ' OD1' ' O ' ' A' ' 33' ' ' LYS . 3.7 p-10 -70.28 -31.37 68.7 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 120.216 -0.594 . . . . 0.0 111.198 -179.438 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.527 ' CD1' ' O ' ' A' ' 33' ' ' LYS . 1.4 m-85 -60.68 -55.62 31.07 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-O 120.73 0.3 . . . . 0.0 111.673 -179.037 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.581 HG22 ' O ' ' A' ' 34' ' ' PHE . 5.3 m -69.7 -37.65 74.38 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 C-N-CA 120.556 -0.458 . . . . 0.0 110.717 -179.565 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 65.5 tttm -56.92 -27.61 61.07 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.57 -179.822 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 93.4 m-20 -50.6 -62.98 1.27 Allowed 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 120.685 -0.406 . . . . 0.0 110.63 -179.546 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.492 ' O ' ' SG ' ' A' ' 42' ' ' CYS . 24.9 p -115.05 8.99 15.87 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.293 -179.943 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . 0.521 ' N ' ' O ' ' A' ' 38' ' ' VAL . 7.4 p 38.42 59.14 5.24 Favored Pre-proline 0 N--CA 1.465 0.279 0 CA-C-O 120.883 0.373 . . . . 0.0 110.679 -179.529 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . 0.49 ' C ' ' H ' ' A' ' 45' ' ' PHE . 57.5 Cg_endo -74.21 -28.1 10.99 Favored 'Trans proline' 0 C--N 1.31 -1.499 0 C-N-CA 122.79 2.327 . . . . 0.0 112.445 -179.619 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . 0.465 ' CD1' ' O ' ' A' ' 50' ' ' THR . 0.6 OUTLIER -62.28 1.37 0.33 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.603 -179.469 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.544 ' O ' ' N ' ' A' ' 47' ' ' GLN . 60.8 m-85 50.44 55.61 16.81 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.44 -179.277 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.425 ' CD ' ' N ' ' A' ' 45' ' ' PHE . 70.1 Cg_exo -42.14 -14.82 0.05 OUTLIER 'Trans proline' 0 C--N 1.307 -1.627 0 C-N-CA 122.849 2.366 . . . . 0.0 112.218 179.644 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.544 ' N ' ' O ' ' A' ' 45' ' ' PHE . 87.1 mt-30 -65.98 -53.07 43.64 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.248 -179.27 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 65.8 tt0 -88.87 -30.21 19.07 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.373 178.599 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 73.78 50.64 10.74 Favored Glycine 0 CA--C 1.526 0.764 0 N-CA-C 110.383 -1.087 . . . . 0.0 110.383 -179.239 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . 0.493 ' OG1' ' NE2' ' A' ' 98' ' ' GLN . 15.0 t -107.68 160.71 15.49 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.842 0.354 . . . . 0.0 110.744 -179.468 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.434 ' HB ' HD11 ' A' ' 90' ' ' ILE . 1.5 mt -89.71 137.35 21.59 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-O 121.143 0.497 . . . . 0.0 110.593 179.452 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 57.9 m-20 -108.18 120.77 43.29 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.435 -0.802 . . . . 0.0 111.328 179.227 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.475 ' CG1' HD12 ' A' ' 90' ' ' ILE . 30.2 mm -95.03 -57.01 4.68 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.255 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.17 179.166 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -77.09 -49.03 16.21 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-O 121.076 0.465 . . . . 0.0 111.215 -179.659 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 84.5 mtt85 -60.31 -32.47 71.25 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.01 -179.628 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 13.8 t-105 -61.87 -40.3 94.91 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.735 179.48 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 80.2 mtp85 -62.82 -38.55 91.16 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.531 -179.555 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 83.7 mtt85 -60.84 -52.65 64.16 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 120.593 -0.443 . . . . 0.0 111.385 -179.546 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.409 HG13 ' N ' ' A' ' 60' ' ' GLY . 3.2 p -66.55 -42.12 89.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.6 179.739 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . 0.409 ' N ' HG13 ' A' ' 59' ' ' VAL . . . -61.7 -45.37 96.4 Favored Glycine 0 CA--C 1.522 0.521 0 N-CA-C 111.229 -0.748 . . . . 0.0 111.229 -179.399 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 71.3 m-20 -64.67 -35.15 80.1 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 121.118 -0.233 . . . . 0.0 110.669 -179.444 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 72.4 m -64.21 -59.73 4.06 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.809 0.338 . . . . 0.0 111.144 -179.492 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 50.7 m-85 -65.4 -39.7 92.52 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.284 -0.417 . . . . 0.0 110.86 179.642 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . 0.402 ' CB ' ' O ' ' A' ' 60' ' ' GLY . 58.5 tt0 -63.91 -36.02 82.57 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.749 -179.65 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 31.4 t0 -60.75 -52.77 63.7 Favored 'General case' 0 C--N 1.323 -0.549 0 C-N-CA 120.709 -0.396 . . . . 0.0 110.497 179.957 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 69.8 m-85 -70.5 -42.73 70.94 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.911 179.69 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 65.0 t80 -57.99 -43.39 86.54 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.226 -179.457 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . 0.455 ' C ' ' OD1' ' A' ' 68' ' ' ASN . 21.2 t-20 -60.58 -44.32 96.35 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.28 -179.917 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 82.2 p -74.48 -18.36 60.63 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 120.555 -0.458 . . . . 0.0 110.111 -179.934 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 26.7 m-85 -109.04 16.5 22.53 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.261 179.736 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -167.7 -105.61 0.18 Allowed Glycine 0 CA--C 1.533 1.156 0 C-N-CA 120.579 -0.82 . . . . 0.0 111.126 -179.99 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . 0.585 ' HG2' HG22 ' A' ' 75' ' ' VAL . 67.7 Cg_endo -74.13 147.61 38.27 Favored 'Trans proline' 0 N--CA 1.494 1.558 0 C-N-CA 121.893 1.729 . . . . 0.0 113.093 -179.592 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 98.1 mt-10 -85.64 -47.49 9.77 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.286 179.541 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.704 ' CD ' ' H ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -95.84 -17.34 21.21 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.512 -178.821 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.585 HG22 ' HG2' ' A' ' 72' ' ' PRO . 26.7 t 59.2 131.87 0.02 OUTLIER Pre-proline 0 C--N 1.324 -0.505 0 CA-C-N 115.589 -0.732 . . . . 0.0 111.214 -179.186 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 49.4 Cg_exo -52.43 127.88 25.72 Favored 'Trans proline' 0 N--CA 1.494 1.536 0 C-N-CA 121.629 1.552 . . . . 0.0 111.358 179.045 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.458 ' O ' HG12 ' A' ' 77' ' ' VAL . 46.2 t -82.62 -8.5 11.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.898 179.988 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 73.7 p -48.22 -20.51 0.38 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.361 -179.707 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -60.45 -24.62 65.37 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.499 179.5 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 47.8 t80 -60.81 -39.25 88.26 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.436 -179.987 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 77.4 p -58.46 -40.52 82.88 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.529 -179.958 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' TYR . . . . . 0.43 ' OH ' HG11 ' A' ' 26' ' ' VAL . 23.5 m-85 -60.62 -52.3 65.75 Favored 'General case' 0 C--O 1.221 -0.412 0 C-N-CA 120.674 -0.41 . . . . 0.0 110.812 179.736 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' TRP . . . . . 0.405 ' O ' ' CB ' ' A' ' 87' ' ' LYS . 77.2 t90 -54.14 -39.67 66.69 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.431 -0.349 . . . . 0.0 110.638 -179.807 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 67.7 m-20 -63.28 -47.12 83.68 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.768 -0.373 . . . . 0.0 111.197 -179.813 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 32.7 tp -70.67 -54.39 12.07 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 120.21 -0.596 . . . . 0.0 110.705 179.399 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -56.53 -26.62 23.41 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.162 -179.81 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.405 ' CB ' ' O ' ' A' ' 83' ' ' TRP . 53.8 tttt -66.61 -49.18 67.14 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.841 -179.473 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.2 pp20? -79.6 -20.44 46.88 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.54 -179.788 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.516 ' O ' HD13 ' A' ' 89' ' ' LEU . 0.2 OUTLIER -62.36 -45.82 91.42 Favored 'General case' 0 N--CA 1.446 -0.64 0 C-N-CA 120.077 -0.649 . . . . 0.0 110.574 -179.224 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.475 HD12 ' CG1' ' A' ' 53' ' ' ILE . 3.5 mt -64.91 -43.57 96.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 C-N-CA 120.332 -0.547 . . . . 0.0 109.78 -179.936 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 91.1 m-20 -44.06 -36.86 2.72 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.844 -178.455 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -50.49 129.28 21.85 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 120.475 -0.49 . . . . 0.0 110.427 179.803 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -62.34 -40.72 97.29 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.652 -179.853 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . 0.468 ' O ' ' C ' ' A' ' 95' ' ' VAL . 97.7 mt-10 -71.33 -3.96 23.48 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.823 -179.607 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.468 ' C ' ' O ' ' A' ' 94' ' ' GLU . 2.4 m 29.58 -109.88 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.36 0 O-C-N 123.711 0.632 . . . . 0.0 110.403 -179.791 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' ASN . . . . . 0.498 ' N ' ' OD1' ' A' ' 96' ' ' ASN . 0.0 OUTLIER -154.17 169.93 9.24 Favored Pre-proline 0 C--N 1.325 -0.461 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.482 178.962 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -48.56 -13.14 0.23 Allowed 'Trans proline' 0 N--CA 1.494 1.542 0 C-N-CA 122.705 2.27 . . . . 0.0 112.296 179.118 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . 0.493 ' NE2' ' OG1' ' A' ' 50' ' ' THR . 3.5 pt20 . . . . . 0 C--N 1.323 -0.544 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.704 -179.908 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 87.1 m . . . . . 0 N--CA 1.458 -0.057 0 CA-C-O 120.798 0.333 . . . . 0.0 110.135 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 90.3 mt-10 49.85 -161.01 0.06 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.17 -179.845 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 108' ' ' GLU . . . . . 0.555 ' OE1' ' N ' ' A' ' 108' ' ' GLU . 56.3 mp0 -112.21 118.82 36.38 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 179.613 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 41.5 pt -48.82 -14.13 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.339 -179.853 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.47 ' N ' ' C ' ' A' ' 108' ' ' GLU . 30.9 mt -64.91 -41.23 95.75 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.395 179.467 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -68.36 -35.82 78.29 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.399 179.818 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 44.7 t -60.81 -47.63 85.49 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.668 -179.508 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 17.0 m120 -65.57 -45.0 84.99 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.548 179.769 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 40.3 t -158.2 139.02 12.99 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.344 179.809 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 87.9 mt-30 -85.42 -4.63 59.22 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.384 179.843 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 15.0 m -62.5 -46.68 87.34 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.706 -179.631 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 . . . . . 0 C--N 1.329 -0.326 0 CA-C-O 120.962 0.41 . . . . 0.0 110.47 179.977 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.725 0 N-CA-C 111.096 -0.802 . . . . 0.0 111.096 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 99.4 mm-40 -62.86 -30.18 71.31 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.899 0.381 . . . . 0.0 110.483 -179.871 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . 0.427 ' O ' ' N ' ' A' ' 7' ' ' GLN . 80.0 mm-40 -56.01 -22.15 25.38 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.542 179.593 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 36.6 tp -41.38 -28.94 0.13 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.031 0.443 . . . . 0.0 110.266 -179.403 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 54.1 m -58.25 -41.27 83.86 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.963 0.411 . . . . 0.0 110.173 179.675 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . 0.427 ' N ' ' O ' ' A' ' 4' ' ' GLU . 88.1 mt-30 -64.26 -31.83 73.18 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.835 179.97 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 86.4 t60 -60.18 -45.67 92.31 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-O 120.913 0.387 . . . . 0.0 110.285 179.95 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 99.3 mt-10 -60.48 -43.96 96.42 Favored 'General case' 0 C--O 1.244 0.772 0 CA-C-O 121.243 0.544 . . . . 0.0 110.126 179.769 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.436 ' O ' ' CB ' ' A' ' 14' ' ' GLN . 92.2 mtt-85 -63.18 -34.09 76.88 Favored 'General case' 0 C--O 1.211 -0.969 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 179.578 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.495 ' CE1' HD23 ' A' ' 15' ' ' LEU . 37.4 t80 -59.11 -38.68 80.15 Favored 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 120.765 -0.374 . . . . 0.0 110.369 -179.636 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 2.2 t -60.55 -51.81 68.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 C-N-CA 119.624 -0.83 . . . . 0.0 110.983 -179.675 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 82.8 tt0 -79.56 -38.31 34.43 Favored 'General case' 0 C--N 1.322 -0.609 0 C-N-CA 120.14 -0.624 . . . . 0.0 112.053 -178.968 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . 0.436 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 69.0 tp60 -64.32 -50.5 67.57 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.847 -179.0 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.568 HD13 ' O ' ' A' ' 15' ' ' LEU . 0.2 OUTLIER -62.98 -46.39 87.94 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.487 -0.485 . . . . 0.0 110.073 -179.648 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 61.0 mttp -58.14 -31.6 67.36 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 120.746 -0.381 . . . . 0.0 110.203 179.482 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 75.5 mt-30 -75.73 -35.19 60.3 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.723 178.889 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -57.14 -35.99 70.16 Favored 'General case' 0 CA--C 1.519 -0.224 0 CA-C-N 115.727 -0.67 . . . . 0.0 110.01 -179.992 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.436 ' O ' ' N ' ' A' ' 22' ' ' ARG . 3.0 mt -84.97 -32.92 22.76 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.131 0.491 . . . . 0.0 110.587 179.172 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -46.02 -42.04 12.76 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.472 -179.121 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . 0.499 ' C ' ' H ' ' A' ' 23' ' ' GLY . 0.1 OUTLIER -74.74 -23.5 58.57 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.693 -179.972 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.436 ' N ' ' O ' ' A' ' 19' ' ' LEU . 27.0 mmt180 -73.44 19.91 0.1 Allowed 'General case' 0 N--CA 1.463 0.224 0 CA-C-O 120.78 0.324 . . . . 0.0 110.4 179.987 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . 0.499 ' H ' ' C ' ' A' ' 21' ' ' THR . . . 87.75 16.84 59.25 Favored Glycine 0 CA--C 1.524 0.633 0 N-CA-C 110.941 -0.863 . . . . 0.0 110.941 -179.976 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.597 HG12 ' N ' ' A' ' 25' ' ' LYS . 21.7 t -106.4 167.97 3.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 120.635 0.255 . . . . 0.0 110.533 -179.873 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.597 ' N ' HG12 ' A' ' 24' ' ' VAL . 88.3 tttt -135.37 128.84 32.4 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 109.881 -0.414 . . . . 0.0 109.881 179.345 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.504 HG23 ' O ' ' A' ' 26' ' ' VAL . 26.5 m -125.48 118.46 52.49 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.16 0 N-CA-C 109.993 -0.373 . . . . 0.0 109.993 -179.925 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.513 ' HD3' ' H ' ' A' ' 29' ' ' ALA . 13.7 tmtt? -110.03 160.07 16.75 Favored 'General case' 0 C--O 1.222 -0.392 0 N-CA-C 109.716 -0.476 . . . . 0.0 109.716 179.614 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 88.7 m-85 -41.94 -28.99 0.19 Allowed 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.028 0.442 . . . . 0.0 110.968 179.841 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.513 ' H ' ' HD3' ' A' ' 27' ' ' LYS . . . -60.27 -24.62 65.07 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.828 -179.849 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.455 ' O ' ' CB ' ' A' ' 34' ' ' PHE . 13.0 m-20 -62.48 -44.73 95.68 Favored 'General case' 0 C--O 1.216 -0.658 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.564 -179.673 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.494 ' H ' HD12 ' A' ' 31' ' ' LEU . 5.7 mp -65.48 -40.89 93.66 Favored 'General case' 0 C--N 1.322 -0.619 0 C-N-CA 120.576 -0.449 . . . . 0.0 110.101 179.449 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 32.1 mt -59.84 -45.23 93.08 Favored 'General case' 0 C--N 1.317 -0.833 0 C-N-CA 119.433 -0.907 . . . . 0.0 111.122 -178.698 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.424 ' O ' ' CB ' ' A' ' 37' ' ' PHE . 48.7 tttp -85.57 -47.37 9.93 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 112.084 0.402 . . . . 0.0 112.084 -179.016 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . 0.844 ' O ' HG22 ' A' ' 38' ' ' VAL . 54.4 t80 -63.42 -50.41 69.91 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.976 -178.833 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.475 ' CB ' ' O ' ' A' ' 31' ' ' LEU . 9.3 t80 -62.69 -45.1 94.34 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.298 -179.673 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 56.7 t0 -73.1 -37.17 66.82 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 120.558 -0.457 . . . . 0.0 111.332 -179.508 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.562 ' CZ ' HG22 ' A' ' 59' ' ' VAL . 5.6 t80 -61.43 -47.87 83.79 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.332 -178.376 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.844 HG22 ' O ' ' A' ' 34' ' ' PHE . 19.6 m -72.26 -35.89 54.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 115.626 -0.716 . . . . 0.0 110.341 -179.869 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 65.1 tttm -58.57 -28.98 66.04 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.475 179.78 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 62.9 t0 -45.05 -59.65 2.49 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 120.58 -0.448 . . . . 0.0 110.606 -179.857 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 11.4 p -113.86 -5.28 13.24 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.744 0.307 . . . . 0.0 110.885 179.945 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . 0.548 ' N ' ' HD3' ' A' ' 43' ' ' PRO . 0.0 OUTLIER 48.65 54.36 15.91 Favored Pre-proline 0 CA--C 1.538 0.493 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.572 -178.738 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . 0.548 ' HD3' ' N ' ' A' ' 42' ' ' CYS . 27.0 Cg_exo -62.16 -38.97 51.95 Favored 'Trans proline' 0 N--CA 1.496 1.649 0 C-N-CA 122.051 1.834 . . . . 0.0 113.034 -179.075 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . 0.873 ' HE1' ' H ' ' A' ' 52' ' ' ASP . 0.0 OUTLIER -71.7 0.75 8.06 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.025 -178.911 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.566 ' O ' ' N ' ' A' ' 47' ' ' GLN . 33.9 m-85 53.37 48.51 5.13 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.664 -179.086 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.535 ' CD ' ' N ' ' A' ' 45' ' ' PHE . 44.7 Cg_exo -39.02 -17.83 0.04 OUTLIER 'Trans proline' 0 C--N 1.312 -1.394 0 C-N-CA 122.845 2.363 . . . . 0.0 112.348 179.11 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.566 ' N ' ' O ' ' A' ' 45' ' ' PHE . 83.6 mt-30 -58.25 -52.84 63.88 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.428 -179.642 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 47.1 tp10 -88.3 -34.22 17.74 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.821 -0.352 . . . . 0.0 110.236 178.975 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 87.29 71.7 1.29 Allowed Glycine 0 CA--C 1.526 0.723 0 N-CA-C 110.171 -1.172 . . . . 0.0 110.171 -178.514 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 12.4 t -129.76 171.78 12.32 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 110.4 -0.222 . . . . 0.0 110.4 -179.377 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.1 mt -102.19 142.59 16.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 120.982 0.42 . . . . 0.0 110.491 179.29 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . 0.873 ' H ' ' HE1' ' A' ' 44' ' ' TRP . 73.6 m-20 -122.41 121.66 37.17 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.46 -0.791 . . . . 0.0 111.465 179.343 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.484 ' CG1' HD12 ' A' ' 90' ' ' ILE . 23.5 mm -95.58 -56.19 5.43 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.352 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.24 178.964 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -74.15 -50.65 18.41 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-O 120.94 0.4 . . . . 0.0 111.438 -179.531 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 91.4 mtt-85 -61.04 -35.62 77.4 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.533 -179.891 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' TRP . . . . . 0.637 ' CE3' ' CH2' ' A' ' 44' ' ' TRP . 24.8 t-105 -59.38 -36.25 75.42 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.191 0.52 . . . . 0.0 110.452 179.102 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 61.4 ttp180 -66.41 -37.95 86.37 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.162 179.852 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 87.5 mtt180 -60.48 -51.85 67.7 Favored 'General case' 0 N--CA 1.466 0.375 0 C-N-CA 120.956 -0.298 . . . . 0.0 111.75 -178.866 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.562 HG22 ' CZ ' ' A' ' 37' ' ' PHE . 2.9 p -62.46 -42.49 95.9 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.459 0 CA-C-O 120.95 0.405 . . . . 0.0 110.153 -179.952 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -68.95 -39.4 85.15 Favored Glycine 0 CA--C 1.527 0.836 0 N-CA-C 111.452 -0.659 . . . . 0.0 111.452 179.865 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 12.7 m-20 -64.97 -42.1 94.85 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.734 0.302 . . . . 0.0 111.075 -179.191 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 5.4 m -60.04 -53.29 59.56 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.619 -179.263 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 13.8 m-85 -67.61 -37.18 82.15 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.785 179.586 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 53.3 tt0 -62.45 -41.09 98.5 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.717 -179.715 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.462 ' O ' HG23 ' A' ' 69' ' ' THR . 46.2 t0 -60.74 -52.51 64.79 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.756 -179.9 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' TYR . . . . . 0.478 ' O ' ' OG1' ' A' ' 69' ' ' THR . 25.5 m-85 -66.17 -30.58 71.08 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.362 179.482 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 76.8 t80 -68.04 -41.77 81.57 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.541 -179.859 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . 0.427 ' O ' ' N ' ' A' ' 71' ' ' GLY . 99.0 m-20 -63.56 -40.24 96.48 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.129 -179.44 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.478 ' OG1' ' O ' ' A' ' 66' ' ' TYR . 74.5 p -49.8 -17.76 0.4 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.515 -179.73 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . 0.401 ' N ' ' C ' ' A' ' 68' ' ' ASN . 59.5 m-85 -93.31 15.72 14.94 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.82 -179.953 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . 0.427 ' N ' ' O ' ' A' ' 68' ' ' ASN . . . 40.58 58.02 2.64 Favored Glycine 0 CA--C 1.53 0.999 0 N-CA-C 110.905 -0.878 . . . . 0.0 110.905 -179.295 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . 0.409 ' HD3' ' N ' ' A' ' 71' ' ' GLY . 56.5 Cg_endo -76.48 132.54 13.6 Favored 'Trans proline' 0 N--CA 1.495 1.606 0 C-N-CA 122.89 2.393 . . . . 0.0 112.13 179.715 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 83.5 tt0 -90.88 -19.94 22.8 Favored 'General case' 0 CA--C 1.507 -0.701 0 CA-C-O 121.408 0.623 . . . . 0.0 110.673 179.813 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.505 ' O ' ' C ' ' A' ' 75' ' ' VAL . 53.9 mmtt -73.01 -47.21 47.14 Favored 'General case' 0 C--N 1.31 -1.134 0 CA-C-N 115.237 -0.892 . . . . 0.0 112.056 -178.134 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.582 ' O ' HG12 ' A' ' 75' ' ' VAL . 53.5 t 25.48 80.56 0.21 Allowed Pre-proline 0 CA--C 1.528 0.099 0 O-C-N 123.765 0.665 . . . . 0.0 111.476 179.874 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_exo -55.76 125.37 18.89 Favored 'Trans proline' 0 C--N 1.307 -1.654 0 C-N-CA 121.663 1.575 . . . . 0.0 111.703 -178.842 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 96.6 t -83.88 -21.09 8.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.788 179.811 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 40.2 p -43.41 -27.57 0.28 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.732 -179.079 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -51.95 -43.28 63.44 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.041 179.777 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . 0.528 ' CE2' ' OD1' ' A' ' 84' ' ' ASN . 60.2 t80 -63.05 -42.39 99.71 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.839 179.388 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 39.3 m -58.22 -44.63 88.28 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.477 -0.329 . . . . 0.0 110.871 -179.103 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 14.4 m-85 -60.67 -48.5 81.5 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 120.79 -0.364 . . . . 0.0 110.702 179.751 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' TRP . . . . . 0.407 ' O ' ' CB ' ' A' ' 87' ' ' LYS . 68.5 t90 -56.09 -39.81 72.68 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.647 179.936 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . 0.528 ' OD1' ' CE2' ' A' ' 80' ' ' PHE . 13.3 m120 -61.96 -45.2 94.69 Favored 'General case' 0 C--N 1.326 -0.429 0 C-N-CA 120.658 -0.417 . . . . 0.0 110.966 -179.496 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 50.8 tp -72.47 -56.88 4.7 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 120.466 -0.494 . . . . 0.0 110.449 179.717 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -54.11 -27.25 16.2 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 C-N-CA 120.671 -0.412 . . . . 0.0 110.123 -179.834 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.407 ' CB ' ' O ' ' A' ' 83' ' ' TRP . 65.0 tttt -65.61 -50.89 63.4 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.218 -179.734 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . 0.466 ' OE1' ' O ' ' A' ' 88' ' ' GLU . 1.0 OUTLIER -79.66 -19.94 47.88 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.72 -179.371 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.514 ' O ' HD13 ' A' ' 89' ' ' LEU . 0.2 OUTLIER -61.51 -46.42 90.04 Favored 'General case' 0 N--CA 1.444 -0.736 0 C-N-CA 120.128 -0.629 . . . . 0.0 110.043 -179.148 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.484 HD12 ' CG1' ' A' ' 53' ' ' ILE . 3.5 mt -64.05 -42.62 96.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 C-N-CA 120.229 -0.588 . . . . 0.0 109.867 -179.908 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 71.3 m-20 -53.24 -44.81 68.41 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.676 -178.028 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . 0.492 ' C ' ' H ' ' A' ' 94' ' ' GLU . 97.5 mttt -71.39 142.76 50.32 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.797 0.332 . . . . 0.0 110.762 179.354 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -71.99 14.95 0.18 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.507 179.841 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . 0.492 ' H ' ' C ' ' A' ' 92' ' ' LYS . 40.4 tp10 -61.99 -35.21 77.85 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.296 -179.895 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 34.9 m -70.89 137.58 23.54 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.45 179.924 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' ASN . . . . . 0.525 ' O ' ' N ' ' A' ' 98' ' ' GLN . 0.9 OUTLIER -82.76 166.2 37.33 Favored Pre-proline 0 C--N 1.325 -0.471 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.743 -179.813 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 67.7 Cg_exo -44.94 -11.36 0.04 OUTLIER 'Trans proline' 0 N--CA 1.492 1.384 0 C-N-CA 122.434 2.089 . . . . 0.0 112.111 178.963 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . 0.525 ' N ' ' O ' ' A' ' 96' ' ' ASN . 6.1 pt20 . . . . . 0 C--N 1.324 -0.516 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.717 -179.597 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 87.9 m . . . . . 0 N--CA 1.461 0.101 0 CA-C-O 120.778 0.323 . . . . 0.0 110.399 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . 0.554 ' CD ' ' H ' ' A' ' 107' ' ' GLU . 30.3 mp0 -68.33 161.58 27.09 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.53 -179.406 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 108' ' ' GLU . . . . . 0.557 ' C ' ' H ' ' A' ' 110' ' ' LEU . 94.7 mt-10 -92.25 140.37 29.68 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.201 -0.454 . . . . 0.0 109.923 179.705 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 33.0 pt -60.74 3.75 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.379 179.848 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.557 ' H ' ' C ' ' A' ' 108' ' ' GLU . 85.3 mt -109.54 32.33 5.1 Favored 'General case' 0 N--CA 1.461 0.082 0 CA-C-O 121.023 0.439 . . . . 0.0 110.37 -179.899 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . 0.43 ' CG ' HE22 ' A' ' 115' ' ' GLN . 43.3 pttt -82.2 -115.41 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.484 179.962 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . 0.499 ' OG ' ' N ' ' A' ' 113' ' ' ASN . 29.1 p -129.59 -132.88 0.21 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.259 179.584 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 113' ' ' ASN . . . . . 0.499 ' N ' ' OG ' ' A' ' 112' ' ' SER . 99.2 m-20 56.41 34.59 24.49 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.597 -179.802 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER 76.26 94.12 0.07 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.141 0.496 . . . . 0.0 110.623 179.962 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 115' ' ' GLN . . . . . 0.43 HE22 ' CG ' ' A' ' 111' ' ' LYS . 82.7 mt-30 -144.12 164.52 30.42 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.819 -179.967 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 8.2 m -60.8 -45.34 94.77 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.916 -0.583 . . . . 0.0 110.463 -179.494 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 117' ' ' ASP . . . . . 0.484 ' OD2' HD22 ' A' ' 110' ' ' LEU . 93.0 m-20 . . . . . 0 C--N 1.33 -0.27 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.542 179.91 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.732 0 N-CA-C 110.991 -0.844 . . . . 0.0 110.991 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 85.7 mt-30 -60.81 -27.06 67.76 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.859 0.361 . . . . 0.0 110.571 -179.937 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -60.6 -23.6 64.83 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.611 179.823 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 37.6 tp -43.53 -32.74 0.97 Allowed 'General case' 0 C--O 1.234 0.271 0 CA-C-O 121.115 0.483 . . . . 0.0 110.362 -179.458 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 78.0 p -57.98 -37.76 74.84 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 120.662 -0.415 . . . . 0.0 110.111 179.952 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 68.5 tp60 -65.43 -32.19 73.69 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.406 179.605 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 75.3 t60 -59.73 -45.35 92.44 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.809 0.338 . . . . 0.0 110.292 -179.941 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -59.79 -46.71 88.36 Favored 'General case' 0 C--O 1.244 0.77 0 CA-C-O 121.177 0.513 . . . . 0.0 110.233 179.713 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.421 ' O ' ' CB ' ' A' ' 14' ' ' GLN . 63.6 mtp85 -64.27 -33.47 75.88 Favored 'General case' 0 C--O 1.209 -1.066 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 179.707 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 29.8 t80 -58.78 -36.74 74.9 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.774 0.321 . . . . 0.0 110.322 -179.547 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 4.2 t -64.15 -50.28 77.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 C-N-CA 120.179 -0.608 . . . . 0.0 111.288 -179.939 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 93.7 mt-10 -80.24 -31.77 38.48 Favored 'General case' 0 C--N 1.325 -0.49 0 C-N-CA 120.485 -0.486 . . . . 0.0 111.767 -179.285 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . 0.421 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 65.1 tp60 -72.58 -53.22 12.54 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.025 -178.936 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.595 HD13 ' O ' ' A' ' 15' ' ' LEU . 0.2 OUTLIER -62.33 -45.51 92.88 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.842 -0.429 . . . . 0.0 109.842 -179.673 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.444 ' HB3' HG11 ' A' ' 26' ' ' VAL . 66.0 mttm -56.28 -34.42 66.42 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 120.49 -0.484 . . . . 0.0 109.977 179.489 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 69.7 mm-40 -72.05 -41.42 67.46 Favored 'General case' 0 C--O 1.241 0.608 0 CA-C-O 121.175 0.512 . . . . 0.0 110.521 178.551 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.544 ' O ' HG22 ' A' ' 21' ' ' THR . . . -53.64 -45.88 70.32 Favored 'General case' 0 C--O 1.223 -0.342 0 N-CA-C 109.693 -0.484 . . . . 0.0 109.693 179.902 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.449 ' O ' ' N ' ' A' ' 22' ' ' ARG . 4.5 mt -65.58 -37.11 85.72 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 120.984 0.421 . . . . 0.0 110.421 178.838 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 78.5 tttt -45.4 -37.22 4.85 Favored 'General case' 0 C--N 1.321 -0.646 0 C-N-CA 120.418 -0.513 . . . . 0.0 109.83 -179.798 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . 0.544 HG22 ' O ' ' A' ' 18' ' ' ALA . 0.9 OUTLIER -63.14 -34.08 76.86 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.11 179.43 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.449 ' N ' ' O ' ' A' ' 19' ' ' LEU . 12.8 mmt180 -70.37 17.59 0.06 Allowed 'General case' 0 C--O 1.233 0.215 0 CA-C-O 120.801 0.334 . . . . 0.0 110.393 -179.721 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . 0.529 ' H ' ' C ' ' A' ' 21' ' ' THR . . . 83.13 13.11 77.94 Favored Glycine 0 CA--C 1.523 0.562 0 N-CA-C 110.356 -1.098 . . . . 0.0 110.356 -179.878 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.546 HG12 ' N ' ' A' ' 25' ' ' LYS . 12.7 t -89.2 167.49 1.68 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 N-CA-C 110.333 -0.247 . . . . 0.0 110.333 -179.907 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.546 ' N ' HG12 ' A' ' 24' ' ' VAL . 58.5 mttp -134.87 127.46 30.75 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.223 179.335 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.444 HG11 ' HB3' ' A' ' 16' ' ' LYS . 3.0 m -121.63 126.31 74.58 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.247 0 C-N-CA 121.018 -0.273 . . . . 0.0 110.393 -179.921 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 20.2 ttmt -110.88 159.38 17.75 Favored 'General case' 0 CA--C 1.528 0.114 0 N-CA-C 110.167 -0.308 . . . . 0.0 110.167 179.496 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 76.5 m-85 -49.67 -32.34 13.01 Favored 'General case' 0 C--O 1.237 0.44 0 CA-C-O 121.159 0.504 . . . . 0.0 110.224 179.414 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -55.21 -23.42 22.02 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.151 179.664 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.437 ' O ' ' CB ' ' A' ' 34' ' ' PHE . 87.5 m-20 -61.83 -46.77 88.03 Favored 'General case' 0 C--O 1.216 -0.66 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.758 -179.38 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.509 ' H ' HD12 ' A' ' 31' ' ' LEU . 5.4 mp -65.65 -40.76 92.83 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 121.106 0.479 . . . . 0.0 109.924 179.736 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 35.6 mt -59.2 -45.36 91.29 Favored 'General case' 0 C--N 1.314 -0.962 0 C-N-CA 119.798 -0.761 . . . . 0.0 110.962 -178.473 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.589 ' NZ ' ' CZ ' ' A' ' 37' ' ' PHE . 63.9 tttm -86.05 -50.25 7.18 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 112.064 0.394 . . . . 0.0 112.064 -179.089 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . 0.437 ' CB ' ' O ' ' A' ' 30' ' ' ASP . 51.4 t80 -60.21 -50.21 74.57 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.707 -0.678 . . . . 0.0 110.758 -178.591 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.486 ' CB ' ' O ' ' A' ' 31' ' ' LEU . 7.5 t80 -62.29 -46.84 86.96 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.354 -179.659 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 96.7 m-20 -63.03 -36.43 83.55 Favored 'General case' 0 C--N 1.344 0.329 0 CA-C-O 120.908 0.385 . . . . 0.0 111.209 -179.533 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.589 ' CZ ' ' NZ ' ' A' ' 33' ' ' LYS . 1.9 m-85 -57.33 -46.34 83.37 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.825 -179.479 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.561 ' O ' ' N ' ' A' ' 42' ' ' CYS . 23.8 m -81.78 -24.84 9.7 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 C-N-CA 120.299 -0.56 . . . . 0.0 110.395 179.694 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 45.8 tttp -58.03 -31.57 67.12 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 120.78 -0.368 . . . . 0.0 110.4 -179.208 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 65.2 t0 -52.94 -61.14 2.48 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 120.587 -0.445 . . . . 0.0 111.232 -179.548 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.409 ' C ' ' SG ' ' A' ' 42' ' ' CYS . 31.5 p -114.43 -32.03 6.05 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-O 121.141 0.496 . . . . 0.0 111.261 -179.531 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . 0.561 ' N ' ' O ' ' A' ' 38' ' ' VAL . 2.4 m 70.57 58.59 0.48 Allowed Pre-proline 0 C--N 1.324 -0.518 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.386 -178.698 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . 0.55 ' C ' ' H ' ' A' ' 45' ' ' PHE . 19.9 Cg_exo -68.08 -25.13 38.04 Favored 'Trans proline' 0 N--CA 1.495 1.591 0 C-N-CA 122.443 2.096 . . . . 0.0 112.319 179.885 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -58.1 0.39 0.07 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.059 -179.34 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.55 ' H ' ' C ' ' A' ' 43' ' ' PRO . 0.1 OUTLIER 63.86 82.11 0.22 Allowed Pre-proline 0 C--N 1.328 -0.369 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.25 -179.987 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_endo -71.89 -9.79 25.27 Favored 'Trans proline' 0 N--CA 1.489 1.219 0 C-N-CA 122.041 1.828 . . . . 0.0 112.24 -179.55 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 88.1 mt-30 -81.02 -54.72 5.31 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 120.525 -0.47 . . . . 0.0 110.516 -179.81 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 63.2 tt0 -88.82 -26.72 21.52 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.48 178.984 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 68.56 61.01 5.0 Favored Glycine 0 CA--C 1.52 0.404 0 N-CA-C 110.086 -1.206 . . . . 0.0 110.086 -179.363 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 13.5 t -118.34 154.19 32.76 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.7 0.286 . . . . 0.0 110.995 -179.274 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.4 mt -80.63 137.06 22.07 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-O 121.259 0.552 . . . . 0.0 110.841 179.494 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . 0.427 ' OD2' ' O ' ' A' ' 43' ' ' PRO . 79.9 m-20 -108.85 121.48 45.18 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.106 -0.952 . . . . 0.0 111.249 179.504 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.486 ' CG1' HD12 ' A' ' 90' ' ' ILE . 27.6 mm -94.81 -56.02 5.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.111 179.145 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -78.66 -50.09 12.05 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-O 121.032 0.444 . . . . 0.0 111.243 -179.609 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 78.1 mtp180 -58.88 -31.94 69.04 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.016 179.756 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 19.1 t-105 -62.41 -39.18 92.44 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.061 0.458 . . . . 0.0 110.616 178.987 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -62.44 -36.27 81.89 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.135 -179.717 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 95.5 mtt-85 -62.14 -55.32 29.94 Favored 'General case' 0 C--N 1.331 -0.224 0 C-N-CA 120.508 -0.477 . . . . 0.0 111.54 -179.655 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.488 HG13 ' N ' ' A' ' 60' ' ' GLY . 5.0 p -65.6 -43.33 94.06 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.441 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.447 179.803 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . 0.488 ' N ' HG13 ' A' ' 59' ' ' VAL . . . -63.67 -41.53 98.99 Favored Glycine 0 C--O 1.22 -0.729 0 N-CA-C 111.33 -0.708 . . . . 0.0 111.33 -179.455 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 76.1 m-20 -61.64 -39.93 93.08 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.82 0.31 . . . . 0.0 110.749 -179.096 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 85.3 m -60.09 -62.98 1.47 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.996 0.427 . . . . 0.0 111.002 -179.694 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 70.7 m-85 -63.35 -42.2 98.9 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.864 -179.917 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . 0.487 ' HG2' HD21 ' A' ' 68' ' ' ASN . 56.5 tt0 -57.31 -40.49 78.0 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.814 0.34 . . . . 0.0 110.776 -179.736 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -58.87 -53.75 54.87 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.986 -179.79 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 71.1 m-85 -67.47 -36.49 81.25 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.681 179.851 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 67.7 t80 -60.69 -43.62 97.52 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.61 -179.469 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . 0.487 HD21 ' HG2' ' A' ' 64' ' ' GLN . 32.8 m-20 -63.79 -41.8 97.85 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.792 -179.203 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 40.5 p -71.64 -17.59 62.25 Favored 'General case' 0 CA--C 1.514 -0.441 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.227 -179.996 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -69.11 -18.59 63.99 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.955 179.881 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 165.24 -62.73 0.23 Allowed Glycine 0 CA--C 1.53 1.019 0 C-N-CA 120.887 -0.673 . . . . 0.0 111.453 -179.237 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -41.39 100.8 0.03 OUTLIER 'Trans proline' 0 C--N 1.313 -1.311 0 C-N-CA 122.691 2.261 . . . . 0.0 112.363 -179.616 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -73.81 -41.69 61.99 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.523 179.282 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.652 ' CD ' ' H ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -95.11 -13.9 24.69 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.243 -179.878 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.447 ' O ' ' O ' ' A' ' 74' ' ' LYS . 28.9 t 58.27 130.14 0.02 OUTLIER Pre-proline 0 CA--C 1.538 0.504 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.192 -178.985 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 48.6 Cg_exo -52.51 126.47 20.92 Favored 'Trans proline' 0 N--CA 1.496 1.636 0 C-N-CA 121.405 1.403 . . . . 0.0 112.283 179.102 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.46 ' O ' ' N ' ' A' ' 80' ' ' PHE . 56.6 t -83.9 -22.57 8.17 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.333 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.848 179.254 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 28.4 p -42.08 -24.65 0.05 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.371 -179.378 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . 0.446 ' N ' ' O ' ' A' ' 77' ' ' VAL . . . -65.76 -38.46 89.14 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.862 179.691 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . 0.46 ' N ' ' O ' ' A' ' 77' ' ' VAL . 3.8 m-85 -57.85 -34.8 70.11 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.435 -179.6 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 35.6 t -60.77 -42.88 98.38 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.269 179.947 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 21.8 m-85 -60.38 -50.15 74.74 Favored 'General case' 0 C--O 1.223 -0.32 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.038 179.905 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' TRP . . . . . . . . . . . . . 55.1 t90 -54.43 -39.14 67.08 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.573 -179.555 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 89.6 m-20 -62.31 -47.07 85.89 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 120.649 -0.42 . . . . 0.0 111.02 -179.584 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 41.0 tp -71.79 -54.35 10.45 Favored 'General case' 0 C--O 1.219 -0.545 0 C-N-CA 120.328 -0.549 . . . . 0.0 110.574 179.86 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -56.84 -25.93 23.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.372 179.643 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 63.9 tttt -65.1 -50.62 65.4 Favored 'General case' 0 C--N 1.321 -0.653 0 C-N-CA 120.177 -0.609 . . . . 0.0 110.16 179.892 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . 0.437 ' OE1' ' O ' ' A' ' 88' ' ' GLU . 0.9 OUTLIER -80.78 -20.07 43.42 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.008 -179.992 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 14.2 tp -61.03 -44.33 97.57 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.629 -178.95 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.486 HD12 ' CG1' ' A' ' 53' ' ' ILE . 3.3 mt -63.99 -43.58 97.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 C-N-CA 120.12 -0.632 . . . . 0.0 109.711 -179.634 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . 0.429 ' O ' ' OD1' ' A' ' 91' ' ' ASP . 64.9 t0 -47.45 -34.98 7.93 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.843 -179.02 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . 0.429 ' O ' ' CG2' ' A' ' 95' ' ' VAL . 72.1 tttt -58.84 143.84 46.23 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.924 -179.965 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 64.5 tttm -74.26 -42.56 59.42 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.087 179.846 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 69.1 tt0 -94.24 54.96 1.95 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.02 0.438 . . . . 0.0 110.47 -178.899 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.514 HG12 ' ND2' ' A' ' 96' ' ' ASN . 5.0 t -61.19 -74.3 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.717 -179.736 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' ASN . . . . . 0.644 ' ND2' ' N ' ' A' ' 96' ' ' ASN . 0.0 OUTLIER -154.04 162.84 25.83 Favored Pre-proline 0 C--N 1.328 -0.352 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.617 179.972 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 14.1 Cg_endo -56.12 -11.01 5.09 Favored 'Trans proline' 0 N--CA 1.496 1.65 0 C-N-CA 122.999 2.466 . . . . 0.0 112.161 179.072 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . 0.598 ' OE1' ' ND2' ' A' ' 96' ' ' ASN . 5.5 pt20 . . . . . 0 C--N 1.323 -0.575 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.614 -179.769 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 87.7 m . . . . . 0 N--CA 1.461 0.116 0 CA-C-O 120.739 0.304 . . . . 0.0 110.451 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 93.7 mt-10 -112.54 146.88 37.73 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.432 -179.895 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 108' ' ' GLU . . . . . 0.559 ' C ' ' H ' ' A' ' 110' ' ' LEU . 99.1 mt-10 -64.61 130.6 44.23 Favored 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 120.699 -0.4 . . . . 0.0 110.216 179.572 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 37.9 pt -58.0 -0.31 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.192 179.313 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.559 ' H ' ' C ' ' A' ' 108' ' ' GLU . 97.8 mt -96.23 -2.72 45.57 Favored 'General case' 0 C--O 1.233 0.185 0 C-N-CA 120.723 -0.391 . . . . 0.0 110.518 -179.725 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -111.15 128.89 56.04 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.314 179.916 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . 0.458 ' OG ' ' N ' ' A' ' 113' ' ' ASN . 86.8 p -136.87 -120.37 0.15 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.883 -0.598 . . . . 0.0 110.33 179.942 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 113' ' ' ASN . . . . . 0.458 ' N ' ' OG ' ' A' ' 112' ' ' SER . 8.2 m120 -63.13 -40.68 98.28 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.437 -179.889 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 45.0 t -140.53 143.66 35.51 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.466 179.85 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 88.3 mt-30 -70.68 90.52 0.77 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.535 -179.966 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 40.1 p -66.83 -34.77 78.53 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.567 179.995 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 64.9 t0 . . . . . 0 C--N 1.328 -0.327 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.643 -179.877 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . 0.425 ' C ' ' N ' ' A' ' 4' ' ' GLU . . . . . . . . 0 CA--C 1.526 0.737 0 N-CA-C 111.009 -0.836 . . . . 0.0 111.009 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 86.9 mt-30 -46.42 -19.78 0.09 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.877 0.37 . . . . 0.0 110.736 -179.965 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . 0.425 ' N ' ' C ' ' A' ' 2' ' ' GLY . 82.6 tt0 -54.37 -24.13 18.33 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.471 179.975 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 41.7 tp -42.26 -28.22 0.18 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.386 -179.736 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 59.7 p -59.95 -40.01 87.51 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.665 -179.88 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 90.0 mm-40 -61.72 -36.04 79.81 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.158 179.569 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 84.4 t60 -61.13 -41.25 96.38 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.361 179.657 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 79.1 tt0 -58.38 -47.36 84.1 Favored 'General case' 0 C--O 1.24 0.597 0 CA-C-O 121.327 0.584 . . . . 0.0 110.122 179.878 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.406 ' O ' ' CB ' ' A' ' 14' ' ' GLN . 61.9 mmt-85 -63.54 -34.76 78.51 Favored 'General case' 0 C--O 1.213 -0.854 0 N-CA-C 109.186 -0.672 . . . . 0.0 109.186 179.562 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 35.9 t80 -58.29 -37.43 75.0 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 120.222 -0.591 . . . . 0.0 110.334 -179.642 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 16.9 t -63.33 -48.5 87.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 C-N-CA 120.24 -0.584 . . . . 0.0 111.898 179.885 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -83.39 -26.92 30.0 Favored 'General case' 0 C--N 1.322 -0.617 0 C-N-CA 120.383 -0.527 . . . . 0.0 111.777 -179.125 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . 0.406 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 68.2 tp60 -77.82 -51.79 9.93 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.823 -179.181 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.6 HD13 ' O ' ' A' ' 15' ' ' LEU . 0.3 OUTLIER -62.98 -45.98 89.87 Favored 'General case' 0 CA--C 1.535 0.38 0 N-CA-C 109.839 -0.43 . . . . 0.0 109.839 179.886 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.581 ' HB3' HG11 ' A' ' 26' ' ' VAL . 96.8 mttt -58.68 -37.64 76.49 Favored 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 120.464 -0.494 . . . . 0.0 110.265 179.514 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 75.4 mt-30 -70.24 -37.35 74.95 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.619 178.644 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -56.35 -33.07 65.3 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.114 -0.494 . . . . 0.0 109.935 179.842 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.8 mt -85.63 -32.16 22.18 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.043 0.449 . . . . 0.0 110.65 178.969 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 66.0 tttm -48.84 -43.02 38.26 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.497 -178.794 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . 0.479 ' C ' ' H ' ' A' ' 23' ' ' GLY . 0.1 OUTLIER -70.32 -25.0 63.1 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.611 179.752 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 29.1 mmt180 -74.14 19.04 0.13 Allowed 'General case' 0 N--CA 1.463 0.178 0 CA-C-O 120.812 0.339 . . . . 0.0 110.393 -179.753 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . 0.479 ' H ' ' C ' ' A' ' 21' ' ' THR . . . 87.66 17.18 58.81 Favored Glycine 0 N--CA 1.468 0.824 0 N-CA-C 111.138 -0.785 . . . . 0.0 111.138 179.957 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.642 HG12 ' N ' ' A' ' 25' ' ' LYS . 24.7 t -105.61 169.37 2.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 120.57 0.224 . . . . 0.0 110.527 179.953 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.642 ' N ' HG12 ' A' ' 24' ' ' VAL . 67.4 mttm -133.23 136.17 45.44 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.366 179.58 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.581 HG11 ' HB3' ' A' ' 16' ' ' LYS . 19.3 m -132.64 111.45 17.31 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.36 0 C-N-CA 121.148 -0.221 . . . . 0.0 110.666 -179.97 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.4 ' O ' ' N ' ' A' ' 30' ' ' ASP . 23.8 pttt -108.74 166.25 10.94 Favored 'General case' 0 CA--C 1.522 -0.122 0 N-CA-C 110.4 -0.222 . . . . 0.0 110.4 179.601 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 90.1 m-85 -46.92 -36.78 8.01 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-O 121.103 0.478 . . . . 0.0 110.019 179.719 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.44 ' HA ' HD12 ' A' ' 32' ' ' LEU . . . -56.73 -23.76 44.8 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.889 -0.596 . . . . 0.0 109.909 179.159 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.4 ' N ' ' O ' ' A' ' 27' ' ' LYS . 50.4 t0 -61.96 -49.78 74.73 Favored 'General case' 0 C--O 1.223 -0.291 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.974 -179.694 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.511 ' H ' HD12 ' A' ' 31' ' ' LEU . 5.8 mp -63.12 -41.13 99.27 Favored 'General case' 0 C--O 1.218 -0.561 0 CA-C-O 120.867 0.365 . . . . 0.0 110.336 179.965 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.44 HD12 ' HA ' ' A' ' 29' ' ' ALA . 51.2 mt -53.34 -46.07 69.36 Favored 'General case' 0 C--N 1.31 -1.109 0 C-N-CA 119.297 -0.961 . . . . 0.0 111.008 -178.985 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.495 ' O ' ' CD1' ' A' ' 37' ' ' PHE . 87.0 tttt -82.22 -53.16 6.29 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 112.151 0.426 . . . . 0.0 112.151 -179.003 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . 0.711 ' O ' HG22 ' A' ' 38' ' ' VAL . 10.2 m-85 -63.09 -50.44 70.53 Favored 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 120.405 -0.518 . . . . 0.0 111.52 -178.866 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.49 ' CB ' ' O ' ' A' ' 31' ' ' LEU . 22.4 t80 -58.21 -47.76 82.46 Favored 'General case' 0 C--N 1.323 -0.56 0 C-N-CA 120.752 -0.379 . . . . 0.0 110.577 -178.584 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 85.2 m-20 -71.33 -21.5 62.04 Favored 'General case' 0 C--N 1.339 0.122 0 C-N-CA 120.11 -0.636 . . . . 0.0 111.052 -179.43 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.635 ' O ' HG23 ' A' ' 41' ' ' THR . 2.7 m-85 -76.36 -63.43 1.33 Allowed 'General case' 0 C--O 1.224 -0.238 0 C-N-CA 120.508 -0.477 . . . . 0.0 111.92 -178.666 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.711 HG22 ' O ' ' A' ' 34' ' ' PHE . 0.3 OUTLIER -63.41 -38.54 82.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-O 120.927 0.394 . . . . 0.0 110.805 -179.24 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 89.0 tttt -63.03 -45.18 93.51 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.36 -179.56 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.428 ' OD1' ' N ' ' A' ' 40' ' ' ASP . 4.4 m-20 -85.06 -33.58 22.44 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 120.951 -0.299 . . . . 0.0 111.46 -179.664 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.635 HG23 ' O ' ' A' ' 37' ' ' PHE . 34.8 p -86.96 -25.83 24.14 Favored 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 120.746 -0.382 . . . . 0.0 111.255 -178.969 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . 0.525 ' N ' ' O ' ' A' ' 38' ' ' VAL . 1.7 m 23.15 67.46 0.36 Allowed Pre-proline 0 N--CA 1.466 0.362 0 O-C-N 123.954 0.784 . . . . 0.0 110.539 -178.378 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 16.8 Cg_exo -64.0 -43.38 15.79 Favored 'Trans proline' 0 C--N 1.306 -1.689 0 C-N-CA 121.814 1.676 . . . . 0.0 115.056 -175.914 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . 0.555 ' HE1' ' C ' ' A' ' 50' ' ' THR . 5.7 p90 -125.97 17.05 7.93 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.685 0.755 . . . . 0.0 110.128 179.89 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.564 ' N ' ' HD3' ' A' ' 46' ' ' PRO . 4.3 t80 74.96 56.91 0.26 Allowed Pre-proline 0 C--N 1.32 -0.711 0 CA-C-N 114.786 -1.097 . . . . 0.0 111.16 -179.233 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.564 ' HD3' ' N ' ' A' ' 45' ' ' PHE . 11.3 Cg_exo -68.66 -19.83 41.29 Favored 'Trans proline' 0 N--CA 1.495 1.614 0 C-N-CA 123.018 2.479 . . . . 0.0 112.491 179.83 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 58.2 tt0 -54.24 -40.49 67.78 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.903 -179.002 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 31.6 tp10 -68.45 -32.25 72.13 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.825 -0.435 . . . . 0.0 109.825 179.637 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . 0.436 ' O ' ' OE1' ' A' ' 98' ' ' GLN . . . 116.62 -17.93 13.45 Favored Glycine 0 CA--C 1.521 0.431 0 N-CA-C 110.448 -1.061 . . . . 0.0 110.448 -179.27 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . 0.555 ' C ' ' HE1' ' A' ' 44' ' ' TRP . 6.2 t -56.38 159.49 3.6 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 109.284 -0.635 . . . . 0.0 109.284 179.411 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.478 ' HA ' ' NE1' ' A' ' 44' ' ' TRP . 0.7 OUTLIER -128.28 132.29 68.39 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.488 0 CA-C-O 120.743 0.306 . . . . 0.0 110.49 -179.977 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 48.3 t0 -123.18 117.69 25.94 Favored 'General case' 0 C--N 1.312 -1.039 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.9 177.88 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 25.3 mm -72.95 -43.4 59.3 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.882 -179.561 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -62.74 -55.62 24.99 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 121.241 0.543 . . . . 0.0 111.168 -178.374 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 91.2 mtt180 -64.48 -34.92 79.35 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.305 179.201 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' TRP . . . . . 0.43 ' HE1' ' HB2' ' A' ' 83' ' ' TRP . 33.6 t-105 -55.85 -37.29 68.54 Favored 'General case' 0 C--N 1.332 -0.18 0 N-CA-C 109.698 -0.482 . . . . 0.0 109.698 179.394 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.62 ' NH2' ' CH2' ' A' ' 83' ' ' TRP . 63.7 ttm-85 -67.12 -36.97 83.05 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.003 179.126 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 44.3 ttm180 -59.65 -46.22 89.68 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 120.766 -0.373 . . . . 0.0 111.427 -179.509 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 3.1 p -69.08 -36.56 74.08 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 CA-C-O 120.774 0.321 . . . . 0.0 110.436 179.266 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -67.15 -50.53 45.04 Favored Glycine 0 CA--C 1.526 0.754 0 N-CA-C 111.296 -0.722 . . . . 0.0 111.296 179.827 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -63.83 -40.65 97.11 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.624 0.25 . . . . 0.0 111.207 -179.744 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 3.1 m -58.68 -51.56 69.43 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.993 0.425 . . . . 0.0 110.694 -179.464 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . 0.494 ' CE2' ' CE2' ' A' ' 37' ' ' PHE . 14.1 m-85 -68.3 -33.79 74.97 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.362 179.386 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 72.2 tp60 -60.1 -45.25 93.58 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.639 -179.755 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 16.3 t0 -60.63 -51.85 67.64 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.025 0.441 . . . . 0.0 110.603 179.971 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 49.3 m-85 -63.71 -33.19 75.08 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.103 179.65 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 76.4 t80 -61.74 -40.43 95.06 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.105 179.703 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 98.5 m-20 -62.64 -38.11 88.97 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.065 -179.705 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 43.5 p -47.23 -32.58 4.64 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 120.458 -0.497 . . . . 0.0 110.472 -179.084 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 60.2 m-85 -67.35 -38.35 84.7 Favored 'General case' 0 C--N 1.32 -0.69 0 C-N-CA 120.211 -0.596 . . . . 0.0 111.209 179.774 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . 0.51 ' H ' ' HD3' ' A' ' 72' ' ' PRO . . . 100.68 58.24 0.85 Allowed Glycine 0 CA--C 1.528 0.866 0 N-CA-C 110.715 -0.954 . . . . 0.0 110.715 -179.37 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . 0.51 ' HD3' ' H ' ' A' ' 71' ' ' GLY . 66.4 Cg_endo -76.36 116.64 4.38 Favored 'Trans proline' 0 C--N 1.31 -1.454 0 C-N-CA 122.781 2.321 . . . . 0.0 111.59 -179.941 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 79.4 tt0 -85.18 -21.23 29.26 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.248 -179.8 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.743 ' CD ' ' H ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -98.44 -29.14 13.29 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.867 -0.606 . . . . 0.0 112.392 -179.765 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.511 ' O ' HG12 ' A' ' 75' ' ' VAL . 24.4 t 39.3 92.68 0.05 OUTLIER Pre-proline 0 C--N 1.331 -0.231 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.736 -178.827 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -58.07 125.52 18.81 Favored 'Trans proline' 0 C--N 1.316 -1.169 0 C-N-CA 121.113 1.209 . . . . 0.0 111.049 179.792 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.443 ' O ' ' N ' ' A' ' 80' ' ' PHE . 96.0 t -84.23 -16.24 10.82 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.618 179.452 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 36.4 p -40.68 -27.07 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.637 -178.688 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . 0.426 ' N ' ' O ' ' A' ' 77' ' ' VAL . . . -59.92 -42.47 94.0 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.031 0.443 . . . . 0.0 110.313 179.648 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . 0.475 ' CZ ' ' OD1' ' A' ' 84' ' ' ASN . 55.4 t80 -61.34 -41.54 97.21 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.54 179.682 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 17.9 m -58.05 -43.53 86.91 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.905 -179.215 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 6.4 m-85 -58.65 -53.63 56.16 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.916 0.389 . . . . 0.0 111.298 -179.504 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' TRP . . . . . 0.62 ' CH2' ' NH2' ' A' ' 57' ' ' ARG . 15.2 t90 -59.58 -38.43 81.15 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.103 179.966 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . 0.475 ' OD1' ' CZ ' ' A' ' 80' ' ' PHE . 5.3 m120 -61.55 -44.46 97.0 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 120.67 -0.412 . . . . 0.0 110.796 -179.611 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.406 HD23 HD11 ' A' ' 15' ' ' LEU . 53.9 tp -71.47 -53.72 13.0 Favored 'General case' 0 C--O 1.218 -0.575 0 C-N-CA 120.343 -0.543 . . . . 0.0 110.119 179.511 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -58.9 -24.85 27.67 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 C-N-CA 120.8 -0.36 . . . . 0.0 110.883 179.763 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 70.0 tttt -67.97 -49.68 60.26 Favored 'General case' 0 C--N 1.313 -1.0 0 C-N-CA 120.351 -0.54 . . . . 0.0 110.144 179.647 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.2 pp20? -79.97 -20.57 45.23 Favored 'General case' 0 C--N 1.32 -0.682 0 C-N-CA 120.321 -0.552 . . . . 0.0 110.366 -179.883 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 14.0 tp -62.19 -44.87 95.63 Favored 'General case' 0 N--CA 1.445 -0.705 0 C-N-CA 120.338 -0.545 . . . . 0.0 109.879 179.918 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -64.16 -43.42 97.38 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.228 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.936 179.57 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 99.4 m-20 -43.74 -37.51 2.72 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.025 -178.545 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . 0.609 ' HB2' HG22 ' A' ' 95' ' ' VAL . 97.5 mttt -47.36 144.09 3.09 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 120.72 -0.392 . . . . 0.0 110.499 179.629 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 89.0 tttt -71.91 -49.16 40.21 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.874 0.369 . . . . 0.0 111.207 -179.662 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -108.31 54.21 0.67 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.583 -179.286 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.609 HG22 ' HB2' ' A' ' 92' ' ' LYS . 11.5 t -45.21 -73.88 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.242 -179.159 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' ASN . . . . . 0.548 ' ND2' HG12 ' A' ' 95' ' ' VAL . 0.0 OUTLIER -153.42 160.5 30.87 Favored Pre-proline 0 C--N 1.325 -0.496 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.598 -179.965 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -59.31 -13.35 19.79 Favored 'Trans proline' 0 C--N 1.306 -1.659 0 C-N-CA 122.672 2.248 . . . . 0.0 111.87 179.063 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . 0.436 ' OE1' ' O ' ' A' ' 49' ' ' GLY . 9.5 pt20 . . . . . 0 C--N 1.324 -0.526 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.89 -179.962 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 65.0 p . . . . . 0 N--CA 1.458 -0.073 0 CA-C-O 120.72 0.295 . . . . 0.0 110.584 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 85.4 mt-10 -137.13 179.4 6.41 Favored 'General case' 0 CA--C 1.52 -0.206 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.29 179.974 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 108' ' ' GLU . . . . . 0.48 ' C ' ' N ' ' A' ' 110' ' ' LEU . 95.4 mt-10 -105.62 128.55 53.7 Favored 'General case' 0 CA--C 1.513 -0.463 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.003 179.198 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 44.8 pt -50.16 -12.18 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-N 115.938 -0.574 . . . . 0.0 109.962 179.805 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.48 ' N ' ' C ' ' A' ' 108' ' ' GLU . 31.2 mt -65.51 -40.45 93.04 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.609 179.606 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . 0.417 ' O ' ' O ' ' A' ' 114' ' ' SER . 86.8 tttt -68.09 -19.35 64.84 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.991 179.828 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 6.3 t -57.25 -44.2 83.64 Favored 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 120.615 -0.434 . . . . 0.0 110.611 -179.263 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 10.1 m120 -64.06 -41.51 97.34 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.88 179.939 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 114' ' ' SER . . . . . 0.417 ' O ' ' O ' ' A' ' 111' ' ' LYS . 29.6 p -157.6 167.46 30.07 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.491 -179.695 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 86.8 mt-30 -40.96 -28.99 0.09 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.846 0.355 . . . . 0.0 110.887 -179.773 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 2.8 t -166.9 176.49 6.98 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.528 -179.759 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 63.4 t0 . . . . . 0 C--N 1.328 -0.329 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.305 -179.912 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . 0.406 ' C ' ' N ' ' A' ' 4' ' ' GLU . . . . . . . . 0 CA--C 1.526 0.765 0 N-CA-C 110.992 -0.843 . . . . 0.0 110.992 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 85.0 mt-30 -44.15 -23.29 0.09 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.977 0.417 . . . . 0.0 110.507 -179.853 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . 0.465 ' O ' ' N ' ' A' ' 7' ' ' GLN . 95.0 mt-10 -53.05 -20.95 4.0 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.77 179.799 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 27.3 tp -40.85 -35.67 0.54 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.413 -178.716 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 78.1 p -54.61 -40.68 69.13 Favored 'General case' 0 C--N 1.325 -0.481 0 C-N-CA 120.432 -0.507 . . . . 0.0 110.011 179.532 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . 0.465 ' N ' ' O ' ' A' ' 4' ' ' GLU . 76.7 mt-30 -64.66 -32.31 73.92 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.612 179.735 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 63.3 t-80 -57.37 -45.32 84.56 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 121.12 0.486 . . . . 0.0 109.851 -179.925 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -61.31 -41.69 97.41 Favored 'General case' 0 C--O 1.24 0.588 0 CA-C-O 121.265 0.555 . . . . 0.0 109.625 179.498 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.463 ' O ' ' N ' ' A' ' 14' ' ' GLN . 93.8 mtt-85 -65.13 -38.8 91.78 Favored 'General case' 0 C--O 1.212 -0.904 0 C-N-CA 119.983 -0.687 . . . . 0.0 109.253 179.632 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -52.59 -40.06 62.25 Favored 'General case' 0 C--N 1.32 -0.692 0 C-N-CA 120.194 -0.603 . . . . 0.0 110.451 -179.848 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 5.6 t -62.32 -53.83 42.3 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 C-N-CA 120.154 -0.618 . . . . 0.0 111.366 -179.808 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 91.4 mt-10 -79.22 -48.13 14.73 Favored 'General case' 0 N--CA 1.466 0.356 0 C-N-CA 120.104 -0.639 . . . . 0.0 111.907 -179.258 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . 0.463 ' N ' ' O ' ' A' ' 10' ' ' ARG . 70.5 tp60 -49.34 -55.74 11.86 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.056 -179.461 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.57 HD13 ' O ' ' A' ' 15' ' ' LEU . 0.2 OUTLIER -62.02 -47.66 83.75 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.85 -0.426 . . . . 0.0 109.85 -179.629 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 92.4 mttt -55.46 -32.06 62.47 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 120.728 -0.389 . . . . 0.0 110.206 179.217 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 83.8 mt-30 -77.98 -36.58 48.78 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.512 178.967 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -56.7 -32.08 65.11 Favored 'General case' 0 C--O 1.226 -0.165 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.019 -179.907 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.463 ' O ' ' N ' ' A' ' 22' ' ' ARG . 3.5 mt -85.49 -37.42 19.72 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.248 0.547 . . . . 0.0 109.939 178.826 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 64.6 tttm -42.88 -45.62 5.01 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.447 -178.944 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . 0.553 ' C ' ' H ' ' A' ' 23' ' ' GLY . 0.5 OUTLIER -68.39 -30.67 69.64 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.708 179.895 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.463 ' N ' ' O ' ' A' ' 19' ' ' LEU . 86.8 mmt-85 -69.81 24.06 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.634 -179.778 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . 0.553 ' H ' ' C ' ' A' ' 21' ' ' THR . . . 82.4 17.09 69.68 Favored Glycine 0 N--CA 1.468 0.83 0 N-CA-C 110.994 -0.842 . . . . 0.0 110.994 179.606 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.647 HG12 ' N ' ' A' ' 25' ' ' LYS . 26.2 t -105.5 169.03 2.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-O 120.742 0.306 . . . . 0.0 110.599 -179.93 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.647 ' N ' HG12 ' A' ' 24' ' ' VAL . 98.7 mttt -137.98 133.56 33.8 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.162 179.167 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 3.7 m -124.19 129.6 74.02 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.349 0 CA-C-O 120.558 0.218 . . . . 0.0 110.666 -179.977 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.444 ' HG2' ' H ' ' A' ' 28' ' ' TYR . 19.0 ttmt -111.35 162.12 15.36 Favored 'General case' 0 CA--C 1.529 0.136 0 N-CA-C 110.253 -0.277 . . . . 0.0 110.253 179.628 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.444 ' H ' ' HG2' ' A' ' 27' ' ' LYS . 97.7 m-85 -51.22 -30.44 17.36 Favored 'General case' 0 C--O 1.238 0.482 0 CA-C-O 121.257 0.551 . . . . 0.0 110.017 179.228 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.4 ' HA ' HD12 ' A' ' 32' ' ' LEU . . . -57.24 -23.25 46.79 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.21 179.434 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.415 ' O ' ' CB ' ' A' ' 34' ' ' PHE . 87.8 m-20 -61.0 -47.43 86.47 Favored 'General case' 0 C--O 1.22 -0.496 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.47 -179.44 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.516 ' H ' HD12 ' A' ' 31' ' ' LEU . 5.6 mp -65.68 -40.35 92.28 Favored 'General case' 0 C--O 1.216 -0.681 0 C-N-CA 120.769 -0.372 . . . . 0.0 110.277 179.373 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.4 HD12 ' HA ' ' A' ' 29' ' ' ALA . 41.5 mt -58.21 -45.39 87.74 Favored 'General case' 0 C--N 1.313 -0.99 0 C-N-CA 119.429 -0.908 . . . . 0.0 111.164 -178.381 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.589 ' NZ ' ' CZ ' ' A' ' 37' ' ' PHE . 64.8 tttm -86.0 -48.49 8.62 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 121.072 0.463 . . . . 0.0 111.802 -179.222 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . 0.415 ' CB ' ' O ' ' A' ' 30' ' ' ASP . 60.2 t80 -61.1 -49.01 79.03 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.844 -179.0 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.486 ' CB ' ' O ' ' A' ' 31' ' ' LEU . 13.8 t80 -63.17 -46.62 86.27 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.576 -179.639 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 99.1 m-20 -64.48 -34.39 78.09 Favored 'General case' 0 C--N 1.341 0.227 0 CA-C-O 120.862 0.363 . . . . 0.0 110.965 -179.668 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.589 ' CZ ' ' NZ ' ' A' ' 33' ' ' LYS . 1.6 m-85 -59.35 -48.02 83.23 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.114 -179.597 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.575 ' O ' ' N ' ' A' ' 42' ' ' CYS . 14.8 m -74.81 -36.35 39.39 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.68 179.878 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -55.54 -27.7 50.5 Favored 'General case' 0 C--N 1.322 -0.606 0 C-N-CA 120.733 -0.387 . . . . 0.0 110.15 -179.792 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 85.0 m-20 -54.1 -62.27 1.76 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.797 -179.719 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.44 ' C ' ' SG ' ' A' ' 42' ' ' CYS . 7.8 p -114.33 -27.37 7.62 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 120.864 0.364 . . . . 0.0 111.392 -179.801 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . 0.575 ' N ' ' O ' ' A' ' 38' ' ' VAL . 2.3 m 71.46 55.57 0.4 Allowed Pre-proline 0 C--N 1.326 -0.436 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.468 -179.151 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . 0.512 ' C ' ' H ' ' A' ' 45' ' ' PHE . 73.0 Cg_endo -77.18 -37.32 1.08 Allowed 'Trans proline' 0 N--CA 1.494 1.512 0 C-N-CA 122.753 2.302 . . . . 0.0 113.054 -179.536 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . 0.652 ' HE1' ' H ' ' A' ' 52' ' ' ASP . 0.0 OUTLIER -62.83 4.68 0.16 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.787 -179.974 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.539 ' N ' ' HD3' ' A' ' 46' ' ' PRO . 0.2 OUTLIER 55.17 53.54 9.19 Favored Pre-proline 0 CA--C 1.539 0.533 0 CA-C-O 121.49 0.662 . . . . 0.0 110.233 -178.85 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.539 ' HD3' ' N ' ' A' ' 45' ' ' PHE . 48.0 Cg_exo -52.46 -28.93 37.73 Favored 'Trans proline' 0 N--CA 1.493 1.453 0 C-N-CA 122.09 1.86 . . . . 0.0 111.84 179.327 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -70.45 -42.87 70.91 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.132 -179.44 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 14.1 tt0 -84.71 -15.22 45.97 Favored 'General case' 0 N--CA 1.465 0.305 0 C-N-CA 120.687 -0.405 . . . . 0.0 109.978 -179.69 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 63.26 56.86 17.74 Favored Glycine 0 C--O 1.229 -0.181 0 N-CA-C 110.142 -1.183 . . . . 0.0 110.142 -179.947 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . 0.537 HG22 ' HB3' ' A' ' 45' ' ' PHE . 6.5 t -121.11 165.88 14.72 Favored 'General case' 0 C--N 1.327 -0.397 0 O-C-N 123.586 0.227 . . . . 0.0 110.785 -179.295 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.611 ' H ' HE22 ' A' ' 98' ' ' GLN . 1.1 mt -101.24 137.95 27.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 N-CA-C 109.688 -0.486 . . . . 0.0 109.688 179.522 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . 0.652 ' H ' ' HE1' ' A' ' 44' ' ' TRP . 20.0 m-20 -115.05 120.43 39.83 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.279 179.836 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.476 ' CG1' HD12 ' A' ' 90' ' ' ILE . 23.2 mm -94.69 -56.39 5.25 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.904 179.147 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 99.8 mttt -78.44 -48.33 15.66 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.226 -179.733 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 83.0 mtp180 -60.19 -32.92 71.54 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.091 -179.844 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' TRP . . . . . 0.525 ' CE3' ' CZ3' ' A' ' 44' ' ' TRP . 17.2 t-105 -62.16 -39.24 91.98 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-O 120.998 0.428 . . . . 0.0 110.536 179.437 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 63.5 ttm-85 -62.43 -38.11 88.47 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.325 179.849 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 61.6 ttt85 -59.69 -56.65 19.14 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 120.63 -0.428 . . . . 0.0 110.909 -179.36 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.478 HG13 ' N ' ' A' ' 60' ' ' GLY . 6.6 p -66.7 -42.79 90.09 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.552 0 CA-C-O 120.803 0.335 . . . . 0.0 111.049 -179.865 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . 0.478 ' N ' HG13 ' A' ' 59' ' ' VAL . . . -63.34 -46.74 92.11 Favored Glycine 0 C--O 1.222 -0.636 0 N-CA-C 111.681 -0.568 . . . . 0.0 111.681 -179.259 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 66.7 t0 -61.0 -36.89 80.66 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.574 0.226 . . . . 0.0 110.948 -179.444 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 71.3 m -61.03 -64.83 0.82 Allowed 'General case' 0 C--N 1.325 -0.468 0 C-N-CA 120.712 -0.395 . . . . 0.0 111.304 -179.674 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 73.3 m-85 -64.77 -43.58 92.79 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.334 -0.393 . . . . 0.0 111.441 -179.666 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . 0.427 ' CB ' ' O ' ' A' ' 60' ' ' GLY . 53.0 tt0 -59.45 -40.7 87.7 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.768 -179.394 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.482 ' O ' HG23 ' A' ' 69' ' ' THR . 18.9 t0 -58.09 -55.4 35.47 Favored 'General case' 0 C--N 1.323 -0.548 0 C-N-CA 120.65 -0.42 . . . . 0.0 110.853 -179.885 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 61.9 m-85 -66.27 -38.89 88.85 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 120.617 -0.433 . . . . 0.0 110.868 179.89 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . 0.442 ' O ' ' N ' ' A' ' 71' ' ' GLY . 59.9 t80 -58.99 -42.34 89.8 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.533 -179.496 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . 0.411 HD21 ' HG2' ' A' ' 64' ' ' GLN . 23.5 m-20 -62.99 -42.74 99.93 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.225 -179.015 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.482 HG23 ' O ' ' A' ' 65' ' ' ASP . 10.1 p -77.33 -18.92 57.06 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 120.609 -0.436 . . . . 0.0 109.958 -179.575 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 40.5 m-85 -113.41 16.47 18.89 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.797 179.715 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . 0.442 ' N ' ' O ' ' A' ' 67' ' ' TYR . . . -154.16 -109.76 0.36 Allowed Glycine 0 CA--C 1.535 1.329 0 C-N-CA 120.594 -0.813 . . . . 0.0 111.133 -179.875 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -74.34 144.82 33.34 Favored 'Trans proline' 0 N--CA 1.492 1.386 0 C-N-CA 121.906 1.738 . . . . 0.0 113.296 -179.432 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 84.7 tt0 -85.43 -43.92 13.2 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.718 -0.673 . . . . 0.0 110.659 179.773 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.655 ' CD ' ' H ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -87.21 -18.13 31.03 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.984 -179.83 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.411 ' H ' ' HD3' ' A' ' 74' ' ' LYS . 99.6 t 57.22 114.46 0.02 OUTLIER Pre-proline 0 N--CA 1.448 -0.571 0 CA-C-N 115.846 -0.616 . . . . 0.0 111.5 -179.465 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_exo -53.23 128.8 30.59 Favored 'Trans proline' 0 N--CA 1.491 1.337 0 C-N-CA 121.312 1.342 . . . . 0.0 111.58 179.847 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.428 ' O ' HG12 ' A' ' 77' ' ' VAL . 42.5 t -82.53 -7.81 10.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.59 179.483 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 75.4 p -48.21 -23.57 0.91 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.957 0.408 . . . . 0.0 110.172 -179.916 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.72 -36.57 84.73 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.797 179.461 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 -58.33 -34.59 70.78 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.119 179.934 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 49.5 m -59.32 -40.59 86.76 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.352 179.573 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 11.8 m-85 -60.97 -49.58 76.85 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 120.793 -0.363 . . . . 0.0 111.022 179.826 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' TRP . . . . . 0.491 ' N ' ' CD1' ' A' ' 83' ' ' TRP . 21.9 m0 -58.6 -35.34 72.28 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.508 -179.756 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 77.5 m-20 -63.49 -46.52 85.74 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 120.618 -0.433 . . . . 0.0 110.758 179.727 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 35.1 tp -71.24 -53.32 14.77 Favored 'General case' 0 C--O 1.219 -0.501 0 C-N-CA 120.486 -0.486 . . . . 0.0 110.274 179.344 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -56.85 -27.51 26.43 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-O 120.863 0.363 . . . . 0.0 110.466 -179.988 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 34.8 tttm -65.8 -49.68 67.41 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.72 -179.599 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . 0.536 ' OE1' ' NZ ' ' A' ' 92' ' ' LYS . 1.1 pp20? -80.08 -20.1 45.91 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.794 -179.64 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.524 ' O ' HD13 ' A' ' 89' ' ' LEU . 0.2 OUTLIER -62.48 -45.06 94.77 Favored 'General case' 0 N--CA 1.444 -0.753 0 C-N-CA 120.263 -0.575 . . . . 0.0 110.427 -179.104 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.476 HD12 ' CG1' ' A' ' 53' ' ' ILE . 3.4 mt -64.79 -43.19 96.46 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.153 0 C-N-CA 120.504 -0.478 . . . . 0.0 109.955 -179.831 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 88.7 m-20 -44.31 -42.05 6.45 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.604 -178.487 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . 0.742 ' O ' HG23 ' A' ' 95' ' ' VAL . 51.2 mttp -57.14 124.96 20.58 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.025 0.441 . . . . 0.0 110.773 179.923 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -71.43 -38.28 71.37 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.436 179.187 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 93.0 mt-10 -81.72 50.25 1.48 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.915 -179.395 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.742 HG23 ' O ' ' A' ' 92' ' ' LYS . 13.1 t -80.61 162.35 3.67 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.057 179.719 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' ASN . . . . . 0.602 ' O ' ' N ' ' A' ' 98' ' ' GLN . 0.0 OUTLIER -40.87 166.35 0.06 OUTLIER Pre-proline 0 C--N 1.328 -0.362 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.324 179.95 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 77.3 Cg_exo -40.19 -14.05 0.03 OUTLIER 'Trans proline' 0 C--N 1.313 -1.335 0 C-N-CA 122.864 2.376 . . . . 0.0 112.695 179.327 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . 0.611 HE22 ' H ' ' A' ' 51' ' ' ILE . 4.8 tt0 . . . . . 0 C--N 1.321 -0.632 0 C-N-CA 120.742 -0.383 . . . . 0.0 110.056 179.281 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 30.7 p . . . . . 0 N--CA 1.461 0.121 0 CA-C-O 120.753 0.311 . . . . 0.0 110.325 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -99.43 147.0 25.72 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.538 -179.846 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 108' ' ' GLU . . . . . 0.427 ' C ' ' N ' ' A' ' 110' ' ' LEU . 79.6 mm-40 -79.57 129.69 34.7 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.15 -0.477 . . . . 0.0 109.978 179.499 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . 0.442 ' O ' ' OG ' ' A' ' 112' ' ' SER . 39.1 pt -54.29 -12.1 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 115.922 -0.581 . . . . 0.0 109.846 -179.887 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.427 ' N ' ' C ' ' A' ' 108' ' ' GLU . 79.1 mt -73.47 -39.08 65.19 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.429 179.278 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -65.64 -33.73 76.56 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.424 -179.884 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . 0.442 ' OG ' ' O ' ' A' ' 109' ' ' ILE . 94.0 p -59.74 -44.5 93.76 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.968 -179.304 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 40.6 t30 -64.77 -41.74 95.64 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.192 179.944 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 17.1 p -167.81 157.24 9.92 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.514 179.498 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 86.7 mt-30 -99.75 10.34 41.49 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.835 0.35 . . . . 0.0 110.495 179.764 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 43.7 p -65.02 -36.75 85.39 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.471 -179.901 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 91.0 m-20 . . . . . 0 C--N 1.329 -0.323 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.528 179.962 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.743 0 N-CA-C 111.2 -0.76 . . . . 0.0 111.2 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 97.2 mm-40 -60.01 -21.58 61.49 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.911 0.386 . . . . 0.0 110.315 -179.87 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.569 ' OE2' ' H61' ' A' ' 201' ' ' MYR . 82.8 tt0 -56.23 -22.62 30.68 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.468 179.705 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 34.2 tp -41.63 -28.54 0.14 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.373 -179.681 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 78.2 p -57.73 -36.97 72.76 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 120.662 -0.415 . . . . 0.0 110.112 -179.762 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 88.0 mt-30 -64.28 -33.04 74.92 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.573 179.431 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 58.5 t-80 -61.85 -45.62 92.99 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.596 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 98.1 mt-10 -59.84 -44.84 93.88 Favored 'General case' 0 C--O 1.243 0.718 0 CA-C-O 121.243 0.544 . . . . 0.0 110.111 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 77.9 mmt-85 -62.27 -33.47 74.69 Favored 'General case' 0 C--O 1.214 -0.813 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 179.235 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.722 ' CD2' H122 ' A' ' 201' ' ' MYR . 40.7 t80 -59.96 -37.29 79.14 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 120.548 -0.461 . . . . 0.0 110.353 -179.762 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 3.4 t -61.62 -48.28 89.45 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 C-N-CA 119.75 -0.78 . . . . 0.0 110.888 179.885 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 98.4 mt-10 -82.02 -46.85 13.38 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 120.038 -0.665 . . . . 0.0 111.66 -179.554 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 71.2 tp60 -58.3 -51.38 70.04 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.89 -0.595 . . . . 0.0 111.201 -179.131 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.647 HD13 ' O ' ' A' ' 15' ' ' LEU . 0.4 OUTLIER -63.48 -46.12 87.65 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-O 120.991 0.424 . . . . 0.0 109.933 179.875 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.544 ' HB3' HG11 ' A' ' 26' ' ' VAL . 91.8 mttt -58.32 -35.54 72.02 Favored 'General case' 0 C--N 1.329 -0.284 0 O-C-N 121.962 -0.461 . . . . 0.0 110.478 179.359 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 93.2 mt-30 -71.91 -36.25 69.94 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.369 178.967 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.16 -38.68 80.31 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.087 179.87 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.5 mt -79.88 -28.01 39.96 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.965 0.412 . . . . 0.0 110.581 179.293 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 65.1 tttm -55.29 -39.81 70.31 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.243 -179.337 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.434 HG23 HH11 ' A' ' 22' ' ' ARG . 1.5 t -74.13 -18.18 60.83 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.877 -179.821 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.434 HH11 HG23 ' A' ' 21' ' ' THR . 62.8 mmt-85 -77.22 -0.19 24.28 Favored 'General case' 0 C--N 1.331 -0.2 0 C-N-CA 120.672 -0.411 . . . . 0.0 110.202 179.544 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 106.67 13.57 21.84 Favored Glycine 0 N--CA 1.466 0.7 0 N-CA-C 110.884 -0.886 . . . . 0.0 110.884 -179.554 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.589 HG12 ' N ' ' A' ' 25' ' ' LYS . 17.9 t -100.86 168.74 1.83 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 N-CA-C 110.441 -0.207 . . . . 0.0 110.441 -179.838 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.589 ' N ' HG12 ' A' ' 24' ' ' VAL . 68.6 mttm -125.54 137.9 53.95 Favored 'General case' 0 C--O 1.233 0.209 0 N-CA-C 110.175 -0.306 . . . . 0.0 110.175 179.591 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.544 HG11 ' HB3' ' A' ' 16' ' ' LYS . 3.2 m -135.63 107.12 6.9 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.374 0 CA-C-O 120.761 0.315 . . . . 0.0 110.801 -179.651 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 27.8 pttt -108.55 165.83 11.23 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-O 120.75 0.309 . . . . 0.0 110.527 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.605 ' CE2' HD11 ' A' ' 32' ' ' LEU . 81.6 t80 -47.97 -38.52 17.02 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-O 121.04 0.447 . . . . 0.0 109.884 179.442 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.444 ' HA ' HD12 ' A' ' 32' ' ' LEU . . . -56.98 -23.08 43.26 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.021 -0.536 . . . . 0.0 109.984 179.041 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 58.2 t0 -62.26 -44.36 96.72 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.559 -179.594 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.518 ' O ' ' CB ' ' A' ' 35' ' ' PHE . 5.6 mp -67.47 -41.29 84.87 Favored 'General case' 0 C--O 1.213 -0.828 0 CA-C-O 121.164 0.507 . . . . 0.0 109.694 179.184 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.605 HD11 ' CE2' ' A' ' 28' ' ' TYR . 49.4 mt -56.97 -44.57 82.77 Favored 'General case' 0 C--N 1.313 -0.987 0 C-N-CA 119.715 -0.794 . . . . 0.0 111.26 -178.605 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -84.31 -50.86 7.45 Favored 'General case' 0 C--N 1.32 -0.702 0 C-N-CA 120.666 -0.413 . . . . 0.0 111.617 -179.013 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . 0.794 ' O ' HG22 ' A' ' 38' ' ' VAL . 59.7 t80 -63.48 -48.27 78.35 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.47 -178.916 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.518 ' CB ' ' O ' ' A' ' 31' ' ' LEU . 17.4 t80 -61.97 -44.47 96.68 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 110.009 -0.367 . . . . 0.0 110.009 -179.442 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 92.4 m-20 -70.39 -37.96 74.6 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 120.717 -0.393 . . . . 0.0 111.683 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.472 ' CE2' ' CE2' ' A' ' 63' ' ' PHE . 2.7 m-85 -62.34 -50.46 71.52 Favored 'General case' 0 N--CA 1.464 0.253 0 N-CA-C 112.116 0.413 . . . . 0.0 112.116 -178.629 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.794 HG22 ' O ' ' A' ' 34' ' ' PHE . 13.9 m -68.17 -42.58 84.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 C-N-CA 120.541 -0.463 . . . . 0.0 110.493 -179.599 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 43.3 mmtt -64.24 -28.5 69.77 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.069 179.872 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 67.3 t0 -54.2 -49.24 69.84 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 120.725 -0.39 . . . . 0.0 110.542 -179.309 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.465 ' O ' ' SG ' ' A' ' 42' ' ' CYS . 12.1 p -113.38 -2.77 13.89 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.026 179.766 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . 0.533 ' N ' ' O ' ' A' ' 38' ' ' VAL . 29.8 p 37.72 57.6 4.48 Favored Pre-proline 0 N--CA 1.465 0.3 0 CA-C-N 116.484 -0.325 . . . . 0.0 110.553 -179.223 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 69.7 Cg_endo -76.54 -33.23 3.26 Favored 'Trans proline' 0 C--N 1.31 -1.461 0 C-N-CA 122.538 2.159 . . . . 0.0 112.806 -179.062 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . 0.639 ' HE1' ' H ' ' A' ' 52' ' ' ASP . 0.0 OUTLIER -75.94 2.36 12.78 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.711 -179.775 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.489 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 16.7 m-85 50.14 51.41 10.64 Favored Pre-proline 0 C--N 1.327 -0.397 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.02 -179.786 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.489 ' CD ' ' N ' ' A' ' 45' ' ' PHE . 10.1 Cg_endo -51.14 -7.24 0.14 Allowed 'Trans proline' 0 C--N 1.308 -1.587 0 C-N-CA 122.805 2.337 . . . . 0.0 111.973 -179.783 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.47 ' H ' ' C ' ' A' ' 45' ' ' PHE . 99.5 mm-40 -62.21 -52.8 62.31 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.627 -179.576 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.498 ' O ' ' H51' ' A' ' 201' ' ' MYR . 55.1 tt0 -88.3 -12.86 42.31 Favored 'General case' 0 N--CA 1.466 0.326 0 C-N-CA 120.569 -0.452 . . . . 0.0 110.387 179.713 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . 0.711 ' O ' ' H71' ' A' ' 201' ' ' MYR . . . 71.73 69.05 1.46 Allowed Glycine 0 CA--C 1.524 0.651 0 N-CA-C 110.486 -1.045 . . . . 0.0 110.486 -179.504 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 3.0 t -136.39 161.31 36.16 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.712 0.291 . . . . 0.0 110.945 -179.249 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.1 mt -99.92 139.75 20.75 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.248 0 CA-C-O 120.98 0.419 . . . . 0.0 110.29 179.428 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . 0.639 ' H ' ' HE1' ' A' ' 44' ' ' TRP . 4.9 t70 -125.44 120.83 32.08 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.588 -0.733 . . . . 0.0 109.648 179.405 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 20.1 mm -88.04 -44.74 15.87 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.834 -179.26 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 65.4 tttm -66.92 -51.45 55.15 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-O 121.077 0.465 . . . . 0.0 111.618 -179.718 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 79.3 mmt-85 -62.09 -32.52 73.08 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.807 -0.442 . . . . 0.0 109.807 -179.665 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' TRP . . . . . 0.594 ' CE3' ' CH2' ' A' ' 44' ' ' TRP . 29.9 t-105 -57.59 -39.72 77.42 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 120.564 -0.454 . . . . 0.0 110.097 -179.897 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -65.22 -37.81 88.44 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.981 -0.554 . . . . 0.0 109.944 179.544 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 68.6 ttt180 -61.24 -53.35 58.02 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 120.67 -0.412 . . . . 0.0 111.144 -179.723 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.432 HG13 ' N ' ' A' ' 60' ' ' GLY . 3.5 p -64.46 -43.87 96.97 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.507 0 CA-C-O 120.721 0.296 . . . . 0.0 110.274 179.695 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . 0.432 ' N ' HG13 ' A' ' 59' ' ' VAL . . . -62.65 -40.4 99.12 Favored Glycine 0 CA--C 1.524 0.645 0 N-CA-C 111.047 -0.821 . . . . 0.0 111.047 179.741 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . 0.43 ' O ' ' OD1' ' A' ' 61' ' ' ASP . 67.9 t0 -64.17 -37.8 88.76 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.742 0.306 . . . . 0.0 110.929 -179.688 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 67.5 m -60.55 -53.08 61.77 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.911 -179.367 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . 0.472 ' CE2' ' CE2' ' A' ' 37' ' ' PHE . 44.3 m-85 -68.97 -37.03 78.55 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.725 179.457 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 69.5 tp60 -59.71 -43.34 94.16 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.867 0.365 . . . . 0.0 110.358 -179.805 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 18.4 t0 -60.56 -50.77 72.21 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.568 179.707 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' TYR . . . . . 0.465 ' O ' ' OG1' ' A' ' 69' ' ' THR . 70.9 t80 -66.36 -26.16 67.14 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.113 179.749 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 59.2 t80 -73.36 -42.08 62.65 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.612 179.882 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . 0.473 ' O ' ' N ' ' A' ' 71' ' ' GLY . 94.0 m-20 -63.35 -37.1 85.97 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.025 -179.14 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.465 ' OG1' ' O ' ' A' ' 66' ' ' TYR . 40.5 p -48.35 -17.08 0.12 Allowed 'General case' 0 N--CA 1.464 0.256 0 C-N-CA 120.786 -0.366 . . . . 0.0 110.664 -179.593 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . 0.418 ' N ' ' C ' ' A' ' 68' ' ' ASN . 90.3 m-85 -95.59 15.47 19.77 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 120.806 -0.358 . . . . 0.0 111.047 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . 0.473 ' N ' ' O ' ' A' ' 68' ' ' ASN . . . 38.0 59.18 1.46 Allowed Glycine 0 N--CA 1.471 1.018 0 N-CA-C 110.976 -0.85 . . . . 0.0 110.976 -179.451 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . 0.5 ' O ' HG23 ' A' ' 75' ' ' VAL . 69.4 Cg_endo -80.62 125.42 5.57 Favored 'Trans proline' 0 C--N 1.309 -1.5 0 C-N-CA 122.431 2.087 . . . . 0.0 112.223 -179.962 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 77.5 mm-40 -85.73 -39.2 17.43 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.885 179.771 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.724 ' CD ' ' H ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -62.58 -41.29 98.84 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.424 -0.807 . . . . 0.0 111.646 -179.752 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.516 ' O ' HG12 ' A' ' 75' ' ' VAL . 29.0 t 31.77 93.05 0.05 OUTLIER Pre-proline 0 N--CA 1.463 0.212 0 O-C-N 123.296 0.373 . . . . 0.0 111.194 179.633 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 34.6 Cg_exo -55.63 125.62 19.73 Favored 'Trans proline' 0 C--N 1.311 -1.441 0 C-N-CA 121.442 1.428 . . . . 0.0 111.645 -179.073 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.448 ' O ' ' N ' ' A' ' 80' ' ' PHE . 60.5 t -82.8 -19.61 10.09 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.452 179.576 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . 0.416 ' H ' HG23 ' A' ' 78' ' ' THR . 10.3 p -41.56 -28.26 0.12 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.328 -179.187 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . 0.407 ' N ' ' C ' ' A' ' 77' ' ' VAL . . . -59.78 -41.48 91.22 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.371 179.724 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . 0.448 ' N ' ' O ' ' A' ' 77' ' ' VAL . 3.2 m-85 -63.21 -40.27 97.01 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.672 179.701 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 43.5 m -59.1 -42.12 89.75 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.866 -179.77 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 5.6 m-85 -60.05 -51.23 70.55 Favored 'General case' 0 C--N 1.331 -0.22 0 C-N-CA 120.813 -0.355 . . . . 0.0 110.74 -179.736 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' TRP . . . . . . . . . . . . . 32.9 t90 -58.48 -38.52 77.78 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.536 179.565 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 92.8 m-20 -61.51 -44.18 97.52 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 120.652 -0.419 . . . . 0.0 110.529 -179.475 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.405 HD11 HD23 ' A' ' 89' ' ' LEU . 23.7 tp -72.98 -56.06 5.68 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 120.328 -0.549 . . . . 0.0 110.242 179.403 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -54.88 -25.56 15.85 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 CA-C-O 120.9 0.381 . . . . 0.0 110.364 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 64.4 tttt -67.19 -50.64 60.21 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.576 179.83 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . 0.442 ' OE1' ' O ' ' A' ' 88' ' ' GLU . 1.0 OUTLIER -80.42 -19.89 45.15 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.917 -179.473 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.532 ' O ' HD13 ' A' ' 89' ' ' LEU . 0.2 OUTLIER -62.31 -44.82 95.63 Favored 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 120.549 -0.461 . . . . 0.0 110.327 -179.346 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 3.4 mt -64.28 -43.27 97.18 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 C-N-CA 120.007 -0.677 . . . . 0.0 109.991 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -47.94 -40.24 21.57 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.405 -0.362 . . . . 0.0 110.445 -179.09 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 43.1 mttm -60.02 136.29 57.97 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.991 0.424 . . . . 0.0 110.841 179.821 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -90.27 -8.96 49.63 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.192 -179.811 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 42.2 tp10 -66.45 -31.62 72.49 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.894 -0.593 . . . . 0.0 110.442 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.408 HG23 ' H ' ' A' ' 95' ' ' VAL . 21.2 t -41.7 135.48 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.298 -0.41 . . . . 0.0 109.902 -179.66 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' ASN . . . . . 0.491 ' O ' ' N ' ' A' ' 98' ' ' GLN . 0.9 OUTLIER -40.48 157.22 0.17 Allowed Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.07 -178.833 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 40.9 Cg_exo -45.62 -13.0 0.07 OUTLIER 'Trans proline' 0 N--CA 1.492 1.414 0 C-N-CA 122.432 2.088 . . . . 0.0 112.209 179.23 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . 0.491 ' N ' ' O ' ' A' ' 96' ' ' ASN . 1.9 pt20 -46.72 -23.74 0.46 Allowed 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.742 -179.436 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 72.5 t -63.61 -50.3 78.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.761 -179.399 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 95.8 mtp -78.78 -39.02 37.04 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.775 179.725 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . 0.403 ' O ' ' OE2' ' A' ' 48' ' ' GLU . . . -65.18 -33.46 76.07 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.781 -179.68 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . 0.439 ' HB2' ' O ' ' A' ' 98' ' ' GLN . . . -59.35 -15.73 18.21 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.555 -179.93 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 90.8 t -63.79 -19.91 25.38 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.186 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.359 179.591 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -57.74 -37.7 74.07 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.43 -179.807 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 88.8 mt-30 -64.36 -40.31 95.59 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.474 179.882 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 98.7 m -62.79 -45.42 92.72 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.577 179.865 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 67.3 mm-40 -66.27 -163.38 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.139 -179.908 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . 0.483 ' C ' ' N ' ' A' ' 110' ' ' LEU . 97.4 mt-10 -106.73 129.12 54.66 Favored 'General case' 0 CA--C 1.516 -0.346 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.009 179.073 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 38.9 pt -50.42 -11.84 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-N 116.075 -0.511 . . . . 0.0 109.928 179.645 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.483 ' N ' ' C ' ' A' ' 108' ' ' GLU . 26.3 mt -64.41 -40.59 96.07 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.577 179.649 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -94.6 87.18 5.01 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.956 -179.895 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 50.2 m -63.24 -41.63 99.11 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.679 179.441 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 96.3 m-20 -137.18 -166.26 1.89 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.644 -179.565 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 77.8 p -64.02 -17.27 63.17 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.441 -179.832 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 84.4 mt-30 -56.13 -165.98 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.375 -179.915 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 77.0 p -83.34 -171.73 3.74 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.53 179.872 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . 0.424 ' N ' ' OD1' ' A' ' 117' ' ' ASP . 33.9 p-10 -63.34 -28.32 69.92 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.763 -179.894 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 95.6 mt -101.5 129.82 47.65 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.613 -179.847 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 17.0 pt-20 -88.33 139.3 30.63 Favored 'General case' 0 C--N 1.334 -0.075 0 CA-C-O 120.625 0.25 . . . . 0.0 110.502 179.95 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 98.0 m-70 -113.2 143.68 43.99 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.653 -179.901 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 99.5 m-70 -135.02 145.57 48.18 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.544 179.897 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 90.9 m-70 -62.17 -36.82 83.04 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.457 -179.938 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 62.5 m80 -64.4 -43.9 92.98 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.682 -179.872 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' HIS . . . . . . . . . . . . . 24.9 m170 -66.94 -40.75 87.65 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.567 179.915 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 82.0 t60 . . . . . 0 C--O 1.22 -0.481 0 CA-C-O 117.985 -1.007 . . . . 0.0 110.608 -179.931 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 201' ' ' MYR . . . . . 0.722 H122 ' CD2' ' A' ' 11' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.67 0 N-CA-C 110.972 -0.851 . . . . 0.0 110.972 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 99.4 mt-30 -64.97 -38.74 91.95 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.856 0.36 . . . . 0.0 110.601 179.857 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.716 ' OE1' ' H52' ' A' ' 201' ' ' MYR . 83.7 tt0 -52.88 -22.88 6.03 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.523 179.995 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.491 ' HB2' ' H21' ' A' ' 201' ' ' MYR . 40.0 tp -42.12 -31.42 0.37 Allowed 'General case' 0 C--O 1.237 0.426 0 CA-C-O 121.016 0.436 . . . . 0.0 110.349 -179.625 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 70.4 m -56.34 -36.74 69.1 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.112 -0.495 . . . . 0.0 109.954 179.743 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . 0.456 ' HA ' ' HE ' ' A' ' 10' ' ' ARG . 57.6 tt0 -63.38 -34.82 78.56 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.586 179.537 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 73.6 t60 -60.29 -46.08 91.1 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.813 0.34 . . . . 0.0 110.277 -179.672 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 77.1 tt0 -61.17 -48.77 80.01 Favored 'General case' 0 C--O 1.244 0.804 0 CA-C-O 121.391 0.615 . . . . 0.0 110.288 179.552 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.456 ' HE ' ' HA ' ' A' ' 7' ' ' GLN . 85.9 mtm180 -62.47 -32.6 73.52 Favored 'General case' 0 C--O 1.213 -0.844 0 N-CA-C 108.624 -0.88 . . . . 0.0 108.624 179.462 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.433 ' CE1' HD23 ' A' ' 15' ' ' LEU . 26.4 t80 -58.68 -37.17 75.46 Favored 'General case' 0 C--N 1.324 -0.51 0 C-N-CA 120.41 -0.516 . . . . 0.0 110.186 -179.839 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 2.3 t -61.26 -50.69 79.41 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 C-N-CA 119.601 -0.84 . . . . 0.0 110.658 179.904 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 78.1 tt0 -81.66 -46.92 13.66 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 119.989 -0.684 . . . . 0.0 112.108 -179.215 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 66.4 tp60 -57.61 -52.47 65.28 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.428 -179.018 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.603 HD13 ' O ' ' A' ' 15' ' ' LEU . 0.3 OUTLIER -63.31 -45.64 90.42 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 109.619 -0.512 . . . . 0.0 109.619 -179.693 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.535 ' HB3' HG11 ' A' ' 26' ' ' VAL . 87.7 mttt -57.25 -35.2 69.43 Favored 'General case' 0 C--N 1.332 -0.182 0 C-N-CA 120.511 -0.475 . . . . 0.0 110.365 179.36 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 81.6 mm-40 -71.07 -41.89 70.11 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.071 0.462 . . . . 0.0 110.616 178.988 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.567 ' O ' HG22 ' A' ' 21' ' ' THR . . . -54.21 -45.64 72.26 Favored 'General case' 0 C--O 1.223 -0.294 0 CA-C-N 116.02 -0.536 . . . . 0.0 109.641 179.931 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.444 ' O ' ' N ' ' A' ' 22' ' ' ARG . 4.7 mt -68.03 -35.23 77.92 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.888 0.375 . . . . 0.0 110.851 178.849 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 56.1 tttm -47.37 -37.57 11.45 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 -179.424 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.567 HG22 ' O ' ' A' ' 18' ' ' ALA . 0.7 OUTLIER -64.56 -31.55 72.82 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.947 -0.569 . . . . 0.0 111.149 179.019 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.444 ' N ' ' O ' ' A' ' 19' ' ' LEU . 30.9 mmt-85 -73.16 21.3 0.08 Allowed 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 120.921 0.391 . . . . 0.0 110.761 -179.615 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . 0.484 ' H ' ' C ' ' A' ' 21' ' ' THR . . . 81.58 13.24 80.51 Favored Glycine 0 N--CA 1.466 0.652 0 N-CA-C 110.487 -1.045 . . . . 0.0 110.487 179.972 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.464 HG12 ' N ' ' A' ' 25' ' ' LYS . 4.3 t -92.12 167.33 1.66 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 N-CA-C 110.082 -0.34 . . . . 0.0 110.082 179.959 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.464 ' N ' HG12 ' A' ' 24' ' ' VAL . 99.1 mttt -129.52 134.49 47.8 Favored 'General case' 0 N--CA 1.455 -0.219 0 N-CA-C 110.149 -0.315 . . . . 0.0 110.149 179.64 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.535 HG11 ' HB3' ' A' ' 16' ' ' LYS . 2.6 m -132.03 105.7 10.04 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.371 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.141 179.927 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.455 ' O ' ' OD1' ' A' ' 30' ' ' ASP . 11.6 ttmt -107.99 162.08 14.35 Favored 'General case' 0 C--O 1.224 -0.276 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 179.822 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.439 ' H ' ' HG2' ' A' ' 27' ' ' LYS . 93.6 m-85 -38.83 -33.33 0.11 Allowed 'General case' 0 C--O 1.235 0.334 0 CA-C-O 121.118 0.485 . . . . 0.0 110.823 179.837 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.532 ' HA ' HD12 ' A' ' 32' ' ' LEU . . . -52.62 -23.13 5.93 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.196 179.836 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.488 ' CG ' ' N ' ' A' ' 31' ' ' LEU . 21.6 p-10 -59.03 -54.19 49.87 Favored 'General case' 0 C--O 1.217 -0.646 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.763 -179.33 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.488 ' N ' ' CG ' ' A' ' 30' ' ' ASP . 0.5 OUTLIER -63.49 -40.07 96.12 Favored 'General case' 0 C--O 1.217 -0.619 0 C-N-CA 120.439 -0.504 . . . . 0.0 109.814 -179.724 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.532 HD12 ' HA ' ' A' ' 29' ' ' ALA . 45.7 mt -56.74 -50.21 72.93 Favored 'General case' 0 C--N 1.314 -0.959 0 C-N-CA 119.267 -0.973 . . . . 0.0 111.021 -178.76 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.415 ' O ' ' N ' ' A' ' 37' ' ' PHE . 88.1 tttt -85.54 -52.77 5.61 Favored 'General case' 0 C--N 1.32 -0.68 0 C-N-CA 120.317 -0.553 . . . . 0.0 112.031 -179.295 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . 0.462 ' CB ' ' O ' ' A' ' 30' ' ' ASP . 45.1 t80 -55.2 -47.8 74.76 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.027 -178.121 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.47 ' CB ' ' O ' ' A' ' 31' ' ' LEU . 14.7 t80 -61.2 -46.62 89.69 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 120.083 -0.647 . . . . 0.0 109.513 -179.794 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 98.1 m-20 -71.22 -23.65 62.05 Favored 'General case' 0 C--N 1.345 0.401 0 C-N-CA 120.511 -0.476 . . . . 0.0 111.404 179.949 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.415 ' N ' ' O ' ' A' ' 33' ' ' LYS . 7.5 t80 -61.28 -48.06 83.14 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.849 0.357 . . . . 0.0 110.403 -178.934 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.555 ' O ' ' N ' ' A' ' 42' ' ' CYS . 6.6 m -77.85 -30.68 16.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.387 179.343 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -55.96 -30.1 61.21 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.44 -0.504 . . . . 0.0 110.545 -179.41 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 65.0 t0 -55.37 -63.97 0.99 Allowed 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 120.699 -0.4 . . . . 0.0 111.805 -179.208 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.428 ' C ' ' SG ' ' A' ' 42' ' ' CYS . 17.0 p -116.27 -19.77 10.06 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-O 120.98 0.419 . . . . 0.0 111.481 -179.559 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . 0.555 ' N ' ' O ' ' A' ' 38' ' ' VAL . 1.7 m 65.84 58.48 1.14 Allowed Pre-proline 0 CA--C 1.537 0.443 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.625 -178.461 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.51 ' HD3' ' N ' ' A' ' 42' ' ' CYS . 11.8 Cg_exo -70.23 -37.35 8.17 Favored 'Trans proline' 0 N--CA 1.498 1.783 0 C-N-CA 122.891 2.394 . . . . 0.0 112.889 -179.409 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . 0.762 ' HE1' ' H ' ' A' ' 52' ' ' ASP . 0.0 OUTLIER -75.91 15.29 0.55 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.455 -179.387 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.484 ' CE1' ' NE2' ' A' ' 105' ' ' GLN . 62.1 m-85 41.57 53.65 7.47 Favored Pre-proline 0 C--N 1.332 -0.188 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.027 -179.879 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.439 ' CD ' ' N ' ' A' ' 45' ' ' PHE . 9.8 Cg_endo -52.39 -9.62 0.61 Allowed 'Trans proline' 0 C--N 1.308 -1.569 0 C-N-CA 122.803 2.335 . . . . 0.0 112.077 -179.883 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 98.3 mm-40 -64.99 -52.81 54.11 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.255 179.729 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.415 ' O ' ' H62' ' A' ' 201' ' ' MYR . 46.7 tp10 -87.02 -51.26 6.12 Favored 'General case' 0 N--CA 1.466 0.357 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 178.983 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . 0.581 ' O ' ' H91' ' A' ' 201' ' ' MYR . . . 108.25 77.89 1.05 Allowed Glycine 0 CA--C 1.526 0.719 0 N-CA-C 109.619 -1.392 . . . . 0.0 109.619 -178.714 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . 0.443 ' O ' H132 ' A' ' 201' ' ' MYR . 13.0 t -134.49 170.87 15.12 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 110.179 -0.304 . . . . 0.0 110.179 -179.106 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.1 mt -101.95 137.63 29.08 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.283 0 CA-C-O 121.027 0.441 . . . . 0.0 109.952 178.977 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . 0.762 ' H ' ' HE1' ' A' ' 44' ' ' TRP . 11.7 m-20 -117.15 121.21 40.64 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.646 -0.706 . . . . 0.0 111.377 179.807 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.497 ' CG1' HD12 ' A' ' 90' ' ' ILE . 22.9 mm -94.86 -56.14 5.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.756 179.045 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 67.7 mttm -75.86 -48.37 21.73 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-O 121.105 0.479 . . . . 0.0 111.364 -179.856 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 74.6 mtp85 -60.27 -32.46 71.2 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.253 179.898 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' TRP . . . . . 0.454 ' CE3' ' CZ3' ' A' ' 44' ' ' TRP . 22.8 t-105 -59.8 -38.8 82.94 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.133 178.727 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 85.7 mtp180 -65.22 -36.18 83.35 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 120.51 -0.476 . . . . 0.0 110.406 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 94.5 mtt180 -59.82 -50.15 74.94 Favored 'General case' 0 N--CA 1.466 0.359 0 C-N-CA 120.25 -0.58 . . . . 0.0 111.579 -179.175 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 3.2 p -64.4 -43.74 97.05 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.508 0 CA-C-O 120.809 0.337 . . . . 0.0 110.141 179.717 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -64.0 -35.51 92.09 Favored Glycine 0 CA--C 1.524 0.65 0 N-CA-C 111.072 -0.811 . . . . 0.0 111.072 179.611 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 97.3 m-20 -63.6 -36.53 84.1 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.659 0.266 . . . . 0.0 110.802 -179.694 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 63.4 m -65.58 -56.21 13.5 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 120.845 -0.342 . . . . 0.0 110.945 -179.713 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 59.4 m-85 -65.51 -37.22 86.14 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.721 179.819 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 55.8 tt0 -63.1 -40.14 96.76 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.675 -179.719 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.592 ' O ' HG23 ' A' ' 69' ' ' THR . 37.7 t0 -59.75 -51.03 71.53 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.449 -179.959 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' TYR . . . . . 0.469 ' O ' ' OG1' ' A' ' 69' ' ' THR . 53.8 m-85 -69.08 -33.13 73.06 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.681 179.585 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 56.2 t80 -66.69 -44.09 82.7 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.983 0.42 . . . . 0.0 110.415 -179.641 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 94.1 m-20 -64.2 -39.09 93.26 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.425 -179.237 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.592 HG23 ' O ' ' A' ' 65' ' ' ASP . 44.8 p -48.24 -28.53 3.11 Favored 'General case' 0 CA--C 1.516 -0.342 0 C-N-CA 120.766 -0.374 . . . . 0.0 110.676 -179.125 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 67.5 m-85 -69.77 -35.82 75.24 Favored 'General case' 0 C--N 1.32 -0.686 0 C-N-CA 120.283 -0.567 . . . . 0.0 111.31 179.263 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . 0.51 ' N ' ' CD ' ' A' ' 72' ' ' PRO . . . 90.65 46.4 4.0 Favored Glycine 0 CA--C 1.533 1.185 0 N-CA-C 110.64 -0.984 . . . . 0.0 110.64 -178.457 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . 0.531 ' O ' HG23 ' A' ' 75' ' ' VAL . 66.8 Cg_endo -75.0 128.26 11.34 Favored 'Trans proline' 0 N--CA 1.49 1.285 0 C-N-CA 122.744 2.296 . . . . 0.0 111.861 -179.671 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 80.4 mm-40 -86.77 -38.63 16.71 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.342 0.591 . . . . 0.0 111.089 -179.92 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.716 ' CD ' ' H ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -59.12 -39.52 82.55 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 115.261 -0.882 . . . . 0.0 111.559 -179.436 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.531 HG23 ' O ' ' A' ' 72' ' ' PRO . 41.6 t 20.87 90.0 0.05 OUTLIER Pre-proline 0 N--CA 1.466 0.349 0 O-C-N 124.074 0.859 . . . . 0.0 111.287 -179.972 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_exo -55.53 125.44 19.13 Favored 'Trans proline' 0 C--N 1.313 -1.307 0 C-N-CA 121.131 1.221 . . . . 0.0 111.613 -178.725 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.475 ' O ' ' N ' ' A' ' 79' ' ' ALA . 89.4 t -83.8 -18.98 9.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 115.301 -0.863 . . . . 0.0 110.638 179.663 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 71.5 p -41.94 -22.55 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.707 -178.901 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . 0.475 ' N ' ' O ' ' A' ' 77' ' ' VAL . . . -61.94 -39.0 90.6 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.251 179.711 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 38.6 t80 -61.41 -40.39 94.22 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.464 179.956 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 82.8 p -58.36 -40.33 81.94 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.709 0.29 . . . . 0.0 110.727 -179.489 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 7.5 m-85 -60.46 -50.63 72.79 Favored 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 120.745 -0.382 . . . . 0.0 110.716 179.915 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' TRP . . . . . . . . . . . . . 55.6 t90 -58.34 -38.34 76.96 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.604 179.938 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 87.6 m-20 -61.29 -44.86 96.51 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 120.594 -0.442 . . . . 0.0 110.838 -179.364 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 29.1 tp -73.67 -57.15 4.19 Favored 'General case' 0 N--CA 1.449 -0.478 0 C-N-CA 120.262 -0.575 . . . . 0.0 110.194 179.552 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -52.59 -26.8 10.61 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 C-N-CA 120.531 -0.468 . . . . 0.0 110.454 179.667 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 63.7 tttt -66.81 -50.32 63.0 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.976 -0.557 . . . . 0.0 110.78 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . 0.413 ' OE1' ' O ' ' A' ' 88' ' ' GLU . 1.2 pp20? -80.02 -20.24 45.83 Favored 'General case' 0 C--N 1.319 -0.738 0 C-N-CA 120.302 -0.559 . . . . 0.0 110.899 -179.396 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.533 ' O ' HD13 ' A' ' 89' ' ' LEU . 0.2 OUTLIER -62.16 -46.94 86.73 Favored 'General case' 0 N--CA 1.447 -0.613 0 C-N-CA 120.72 -0.392 . . . . 0.0 110.324 -178.865 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.497 HD12 ' CG1' ' A' ' 53' ' ' ILE . 3.3 mt -63.79 -43.43 97.93 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.141 0 C-N-CA 120.121 -0.632 . . . . 0.0 109.695 -179.821 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 96.2 m-20 -48.92 -44.86 40.73 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.56 -178.817 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 95.0 mttt -64.35 147.9 51.56 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.933 0.397 . . . . 0.0 110.759 179.599 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 69.8 mmtt -81.63 8.0 10.89 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.261 -179.83 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 80.5 tt0 -61.11 -33.81 73.97 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.128 179.801 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.46 ' H ' HG22 ' A' ' 95' ' ' VAL . 2.9 m -67.89 137.39 24.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.284 -0.417 . . . . 0.0 110.184 179.872 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' ASN . . . . . 0.532 ' ND2' ' OE2' ' A' ' 4' ' ' GLU . 0.0 OUTLIER -81.07 176.23 4.04 Favored Pre-proline 0 C--N 1.328 -0.354 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.93 -179.369 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . 0.401 ' C ' ' N ' ' A' ' 99' ' ' VAL . 34.7 Cg_exo -57.95 -13.32 14.76 Favored 'Trans proline' 0 N--CA 1.495 1.606 0 C-N-CA 122.551 2.168 . . . . 0.0 112.268 179.428 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . 0.482 ' OE1' ' H71' ' A' ' 201' ' ' MYR . 6.0 pt20 -46.67 -21.09 0.16 Allowed 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.785 -179.577 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . 0.401 ' N ' ' C ' ' A' ' 97' ' ' PRO . 94.4 t -63.28 -48.09 89.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 C-N-CA 120.725 -0.39 . . . . 0.0 110.801 179.927 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . 0.456 ' O ' HG23 ' A' ' 103' ' ' VAL . 62.6 ttp -77.65 -36.98 50.88 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.445 179.844 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -61.98 -23.64 66.52 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.772 -179.741 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -60.59 -16.46 38.35 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.623 -179.831 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.456 HG23 ' O ' ' A' ' 100' ' ' MET . 95.5 t -62.46 -22.61 30.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.385 -0.371 . . . . 0.0 110.413 179.919 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -62.01 -38.88 90.33 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.712 179.94 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . 0.484 ' NE2' ' CE1' ' A' ' 45' ' ' PHE . 86.8 mt-30 47.92 -116.5 0.77 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.565 -179.976 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 89.7 m -115.4 126.22 54.11 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.248 179.878 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 86.3 mt-10 -77.98 172.64 13.19 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.244 -179.557 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . 0.481 ' O ' ' N ' ' A' ' 110' ' ' LEU . 94.8 mt-10 -106.2 124.42 49.56 Favored 'General case' 0 CA--C 1.513 -0.451 0 N-CA-C 109.85 -0.426 . . . . 0.0 109.85 179.129 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 45.7 pt -48.66 -13.16 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.971 179.76 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.481 ' N ' ' O ' ' A' ' 108' ' ' GLU . 33.0 mt -65.25 -42.22 93.5 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.596 179.778 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . 0.472 ' HZ1' ' CE1' ' A' ' 121' ' ' HIS . 88.6 tttt -69.01 -38.64 79.34 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.929 -179.988 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 60.2 m -58.86 -43.63 90.88 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.835 -179.369 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 24.4 t-20 -66.76 -43.4 84.17 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.473 179.848 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 99.7 p -165.73 156.37 13.34 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.42 179.686 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 87.3 mt-30 -100.96 11.81 38.89 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.767 0.318 . . . . 0.0 110.567 179.81 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 41.0 p -65.58 -35.87 82.11 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.803 -179.797 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 55.2 m-20 -62.2 -47.28 85.16 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.467 -0.333 . . . . 0.0 110.281 -179.714 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.502 HD11 ' O ' ' A' ' 120' ' ' HIS . 48.2 tp -139.33 94.64 2.82 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.4 179.41 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 56.3 mp0 -69.79 -40.49 75.96 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.303 179.904 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . 0.502 ' O ' HD11 ' A' ' 118' ' ' LEU . 90.2 m-70 -119.65 144.54 47.1 Favored 'General case' 0 C--O 1.231 0.125 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.954 179.977 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 121' ' ' HIS . . . . . 0.472 ' CE1' ' HZ1' ' A' ' 111' ' ' LYS . 92.2 m-70 -82.11 137.76 34.93 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.737 -179.92 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 17.8 t-80 -83.94 130.88 34.89 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.594 179.678 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 98.2 m-70 -125.07 137.58 54.2 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.455 179.941 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 124' ' ' HIS . . . . . . . . . . . . . 70.2 m80 -58.18 -44.23 87.91 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.564 -179.919 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 97.5 m-70 . . . . . 0 C--O 1.22 -0.493 0 CA-C-O 117.967 -1.016 . . . . 0.0 110.442 179.889 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 201' ' ' MYR . . . . . 0.716 ' H52' ' OE1' ' A' ' 4' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.653 0 N-CA-C 110.912 -0.875 . . . . 0.0 110.912 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 84.5 mt-30 -64.03 -38.73 92.14 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.791 0.329 . . . . 0.0 110.559 -179.998 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.5 ' HB2' ' H31' ' A' ' 201' ' ' MYR . 92.8 mt-10 -55.79 -21.29 18.55 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.567 -179.852 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.445 ' HB2' ' H21' ' A' ' 201' ' ' MYR . 46.5 tp -40.63 -37.22 0.7 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.546 179.951 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 82.5 p -55.72 -38.0 69.18 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.578 179.366 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . 0.492 ' N ' ' O ' ' A' ' 4' ' ' GLU . 85.6 mt-30 -65.96 -30.58 71.18 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.523 179.798 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 59.3 t-80 -61.1 -43.69 98.49 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.557 179.695 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -62.11 -43.27 99.21 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.614 179.251 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.502 ' O ' ' CB ' ' A' ' 14' ' ' GLN . 89.1 mtt-85 -65.93 -33.89 76.87 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.54 178.889 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.565 ' CZ ' H143 ' A' ' 201' ' ' MYR . 0.1 OUTLIER -57.69 -43.2 84.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.609 -179.488 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 2.2 t -60.43 -52.31 62.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.546 -178.649 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 80.9 tt0 -78.16 -46.54 20.31 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.545 -178.683 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . 0.502 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 65.1 tp60 -59.29 -46.73 87.75 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.594 -178.423 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.793 ' C ' HD13 ' A' ' 15' ' ' LEU . 3.4 tm? -62.37 -51.25 68.33 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.562 -179.159 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -61.19 -37.15 81.95 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.558 -179.522 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 76.0 mt-30 -66.51 -40.3 89.13 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.557 177.832 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.512 ' O ' HG23 ' A' ' 21' ' ' THR . . . -63.04 -19.28 64.23 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.591 178.676 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.484 ' CD1' ' CE2' ' A' ' 82' ' ' TYR . 9.1 mt -86.59 -35.66 19.32 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.597 178.229 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 96.6 mttt -55.03 -42.26 72.4 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.543 -179.702 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.512 HG23 ' O ' ' A' ' 18' ' ' ALA . 0.5 OUTLIER -63.09 -29.2 70.62 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.597 -179.73 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 75.0 mmt-85 -71.91 -7.33 47.86 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.582 179.462 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 105.82 23.96 7.21 Favored Glycine 0 CA--C 1.524 0.641 0 N-CA-C 110.92 -0.872 . . . . 0.0 110.92 179.854 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.643 HG12 ' N ' ' A' ' 25' ' ' LYS . 34.7 t -103.4 168.61 2.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 120.809 0.337 . . . . 0.0 110.579 179.839 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.643 ' N ' HG12 ' A' ' 24' ' ' VAL . 49.1 tttp -130.46 110.56 11.55 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.541 178.807 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.423 ' CG1' ' OD2' ' A' ' 30' ' ' ASP . 2.1 t -128.3 90.56 1.52 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.603 -179.391 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 19.2 pttt -78.56 166.55 22.43 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.555 179.416 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 87.7 m-85 -47.84 -35.69 10.68 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.588 179.812 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -48.98 -22.16 0.81 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.577 179.057 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.465 ' O ' ' CB ' ' A' ' 34' ' ' PHE . 20.3 t0 -66.62 -41.5 88.25 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.511 -179.56 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.541 ' O ' ' CB ' ' A' ' 35' ' ' PHE . 4.0 mp -61.45 -40.82 95.89 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.556 179.217 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 32.5 mt -62.28 -48.01 81.78 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.557 -179.014 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 82.0 tttt -84.82 -53.97 4.99 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.608 -177.469 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . 0.465 ' CB ' ' O ' ' A' ' 30' ' ' ASP . 35.4 t80 -56.94 -52.03 66.83 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.597 -177.434 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.541 ' CB ' ' O ' ' A' ' 31' ' ' LEU . 5.5 t80 -61.55 -45.79 92.69 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.534 -177.85 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 91.1 m-20 -65.72 -32.81 74.56 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.585 -179.08 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -65.85 -49.81 66.81 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.533 -178.831 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.605 ' O ' ' N ' ' A' ' 42' ' ' CYS . 26.9 m -72.08 -36.28 56.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.532 -179.037 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -61.97 -29.2 70.09 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.541 -179.354 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 97.5 m-20 -57.99 -47.49 82.85 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.55 -179.148 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.474 ' O ' ' C ' ' A' ' 42' ' ' CYS . 82.7 p -113.9 0.1 14.32 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.59 -178.91 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . 0.605 ' N ' ' O ' ' A' ' 38' ' ' VAL . 26.0 p 33.78 61.02 1.86 Allowed Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.595 -179.494 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.404 ' HD3' ' N ' ' A' ' 42' ' ' CYS . 58.0 Cg_endo -78.43 -36.61 0.89 Allowed 'Trans proline' 0 C--N 1.305 -1.721 0 C-N-CA 122.816 2.344 . . . . 0.0 112.133 -179.256 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . 0.791 ' HE1' ' H ' ' A' ' 52' ' ' ASP . 0.0 OUTLIER -71.73 -2.01 15.94 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.565 -179.755 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.576 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 69.0 m-85 58.1 47.5 2.22 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.58 -179.677 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.576 ' CD ' ' N ' ' A' ' 45' ' ' PHE . 46.9 Cg_exo -38.48 -19.0 0.04 OUTLIER 'Trans proline' 0 C--N 1.305 -1.725 0 C-N-CA 122.837 2.358 . . . . 0.0 112.112 178.248 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.564 ' N ' ' O ' ' A' ' 45' ' ' PHE . 86.5 mt-30 -65.85 -53.64 37.21 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.601 -178.468 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.575 ' O ' ' H51' ' A' ' 201' ' ' MYR . 1.2 tt0 -86.09 -15.77 40.15 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.544 -179.861 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 64.76 84.24 0.08 OUTLIER Glycine 0 CA--C 1.525 0.661 0 N-CA-C 110.97 -0.852 . . . . 0.0 110.97 -179.746 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . 0.708 ' O ' H132 ' A' ' 201' ' ' MYR . 14.8 t -145.33 171.29 14.8 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.816 0.341 . . . . 0.0 110.537 -179.284 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.2 mt -104.85 134.3 46.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.57 179.277 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . 0.791 ' H ' ' HE1' ' A' ' 44' ' ' TRP . 1.7 m-20 -111.93 121.94 46.39 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.536 -179.764 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.439 ' CG1' HD12 ' A' ' 90' ' ' ILE . 33.4 mm -94.6 -56.17 5.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.591 179.578 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -74.99 -51.56 13.34 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.566 -179.391 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.432 ' HA ' ' HE ' ' A' ' 58' ' ' ARG . 84.5 mtt85 -59.26 -29.75 67.78 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.553 -179.042 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' TRP . . . . . 0.585 ' CE3' ' CH2' ' A' ' 44' ' ' TRP . 24.9 t-105 -63.44 -36.96 85.46 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.529 178.923 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 79.3 mtp85 -64.96 -35.37 80.96 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.565 179.217 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . 0.432 ' HE ' ' HA ' ' A' ' 55' ' ' ARG . 69.8 mtm180 -60.11 -52.59 64.67 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.621 -179.466 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 2.8 p -65.44 -33.35 63.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.612 -179.86 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -71.22 -38.97 62.94 Favored Glycine 0 CA--C 1.525 0.689 0 N-CA-C 110.944 -0.862 . . . . 0.0 110.944 179.932 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 56.0 t0 -63.36 -48.75 76.65 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.792 0.329 . . . . 0.0 110.554 -179.627 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 99.8 m -64.06 -46.59 83.68 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.553 -179.863 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 6.3 m-85 -63.79 -31.65 72.9 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.6 179.767 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 70.8 tp60 -61.57 -40.22 93.95 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.514 179.647 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 20.6 t0 -63.19 -52.03 63.97 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.561 179.583 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' TYR . . . . . 0.461 ' O ' ' OG1' ' A' ' 69' ' ' THR . 68.8 m-85 -66.81 -32.06 73.1 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.579 179.743 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 63.9 t80 -60.41 -43.37 96.76 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.525 179.388 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 99.0 m-20 -65.65 -38.68 90.03 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.526 -179.863 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.461 ' OG1' ' O ' ' A' ' 66' ' ' TYR . 62.0 p -64.91 -22.59 67.02 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.568 -179.571 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -72.21 -42.58 65.61 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.561 179.938 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . 0.531 ' H ' ' HD3' ' A' ' 72' ' ' PRO . . . 110.24 72.34 0.69 Allowed Glycine 0 CA--C 1.525 0.715 0 N-CA-C 110.925 -0.87 . . . . 0.0 110.925 179.139 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . 0.531 ' HD3' ' H ' ' A' ' 71' ' ' GLY . 16.4 Cg_exo -67.4 147.28 77.33 Favored 'Trans proline' 0 C--N 1.305 -1.728 0 C-N-CA 122.746 2.297 . . . . 0.0 112.124 178.108 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 99.1 mt-10 -76.92 -51.13 11.74 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.546 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.527 ' HD3' ' H ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -140.44 5.59 2.05 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.547 -179.609 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 55.5 t 56.46 91.69 0.07 OUTLIER Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.57 -179.808 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_exo -55.26 122.64 12.08 Favored 'Trans proline' 0 C--N 1.305 -1.732 0 C-N-CA 122.845 2.363 . . . . 0.0 112.146 -179.011 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.44 ' O ' HG12 ' A' ' 77' ' ' VAL . 98.0 t -86.25 -13.49 10.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.539 -179.536 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 81.0 p -44.01 -23.74 0.11 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.601 -179.587 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . 0.401 ' N ' ' O ' ' A' ' 77' ' ' VAL . . . -55.41 -40.61 71.65 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.61 179.794 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 41.1 t80 -63.02 -38.35 90.83 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.604 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 19.6 m -59.05 -41.86 88.93 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.6 -179.511 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' TYR . . . . . 0.484 ' CE2' ' CD1' ' A' ' 19' ' ' LEU . 13.0 m-85 -59.66 -51.65 68.89 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.533 -179.952 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' TRP . . . . . 0.431 ' O ' ' CB ' ' A' ' 87' ' ' LYS . 80.9 t90 -56.66 -40.25 75.16 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.522 -179.69 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 71.8 m-20 -59.92 -46.37 89.58 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.542 -179.883 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.407 ' O ' ' HG3' ' A' ' 88' ' ' GLU . 26.1 tp -71.8 -63.34 1.15 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.57 179.674 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -47.57 -26.77 1.06 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.584 179.11 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.431 ' CB ' ' O ' ' A' ' 83' ' ' TRP . 59.6 tttt -68.03 -49.97 58.22 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.564 -179.536 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . 0.488 ' OE1' ' O ' ' A' ' 88' ' ' GLU . 1.0 OUTLIER -79.74 -19.59 48.39 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.565 -179.924 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.586 ' O ' HD13 ' A' ' 89' ' ' LEU . 0.2 OUTLIER -60.92 -49.15 78.61 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.573 -179.509 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.439 HD12 ' CG1' ' A' ' 53' ' ' ILE . 3.1 mt -63.66 -42.6 96.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.53 179.726 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 65.0 t0 -57.16 -45.87 83.24 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.555 -178.931 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 78.8 mttt -57.12 136.79 56.39 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.568 -179.546 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 58.6 mttp -69.81 -4.34 19.64 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.582 179.857 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -73.4 47.65 0.23 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.573 -179.871 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 21.4 m -121.82 163.98 19.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.581 179.81 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' ASN . . . . . 0.742 ' H ' ' ND2' ' A' ' 96' ' ' ASN . 0.0 OUTLIER -97.31 176.75 1.92 Allowed Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.58 -179.896 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . 0.459 ' CD ' ' CB ' ' A' ' 96' ' ' ASN . 37.9 Cg_exo -59.55 -22.49 66.9 Favored 'Trans proline' 0 C--N 1.305 -1.744 0 C-N-CA 122.839 2.359 . . . . 0.0 112.109 179.688 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . 0.549 ' NE2' ' H91' ' A' ' 201' ' ' MYR . 5.7 pt20 -45.64 -26.54 0.63 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.579 -179.766 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 69.4 t -62.63 -48.62 87.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.569 179.917 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 98.7 mtp -76.77 -40.29 48.78 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.546 179.588 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -65.26 -25.42 67.65 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.574 -179.088 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -64.62 -14.36 57.63 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.565 -179.689 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 49.9 t -62.67 -21.64 28.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.528 179.752 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -54.65 -26.72 34.93 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.57 -179.953 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 81.9 mt-30 -109.35 49.79 0.81 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.579 179.781 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 98.0 m -63.78 -44.79 92.31 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.573 179.895 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . 0.436 ' OE2' ' O ' ' A' ' 113' ' ' ASN . 90.2 mt-10 -74.95 -178.27 3.69 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.547 -179.813 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . 0.553 ' C ' ' H ' ' A' ' 110' ' ' LEU . 80.7 mm-40 -102.87 128.56 49.6 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.571 179.256 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 40.7 pt -56.37 -0.78 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.613 -179.803 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.553 ' H ' ' C ' ' A' ' 108' ' ' GLU . 94.9 mt -89.33 -2.33 58.4 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.592 179.969 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 84.6 tttt -141.8 154.44 45.21 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.555 -179.747 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 5.5 p -60.69 173.3 0.76 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.546 -179.791 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' ASN . . . . . 0.436 ' O ' ' OE2' ' A' ' 107' ' ' GLU . 70.6 m-20 -62.45 -38.5 90.01 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.566 -179.628 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . 0.483 ' O ' ' O ' ' A' ' 115' ' ' GLN . 11.6 m -68.77 138.82 55.14 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.599 -179.705 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' GLN . . . . . 0.483 ' O ' ' O ' ' A' ' 114' ' ' SER . 82.7 mt-30 56.95 148.57 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.556 -179.624 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . 0.508 ' O ' ' N ' ' A' ' 118' ' ' LEU . 21.5 p -84.17 170.59 13.63 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.581 179.472 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . 0.481 ' C ' ' O ' ' A' ' 116' ' ' THR . 58.6 t0 -33.75 -33.94 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.588 179.894 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.508 ' N ' ' O ' ' A' ' 116' ' ' THR . 67.1 mt -102.53 128.46 49.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.555 179.476 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 82.6 tt0 -67.75 -35.83 79.45 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.594 -179.933 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 80.7 m80 -112.67 145.39 40.53 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.566 -179.846 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 69.9 m80 -111.81 142.33 44.31 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.561 179.924 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 94.9 m-70 -63.95 -39.1 93.37 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.551 179.9 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 80.5 m80 -62.52 -45.75 91.56 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.571 179.769 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 124' ' ' HIS . . . . . . . . . . . . . 73.0 m80 -126.15 126.18 43.7 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.571 179.849 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 72.5 m80 . . . . . 0 C--O 1.221 -0.432 0 CA-C-O 117.995 -1.002 . . . . 0.0 110.612 179.994 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 201' ' ' MYR . . . . . 0.708 H132 ' O ' ' A' ' 50' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.632 0 N-CA-C 111.104 -0.798 . . . . 0.0 111.104 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 88.6 mt-30 -58.94 -31.39 68.65 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.874 0.368 . . . . 0.0 110.407 -179.723 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 69.7 mm-40 -65.32 -24.53 67.3 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.681 179.545 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.499 ' N ' ' H21' ' A' ' 201' ' ' MYR . 37.4 tp -43.06 -33.08 0.77 Allowed 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.245 0.545 . . . . 0.0 110.307 -179.553 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 68.1 m -53.67 -41.27 66.69 Favored 'General case' 0 C--N 1.324 -0.526 0 C-N-CA 120.486 -0.486 . . . . 0.0 110.123 179.912 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . 0.467 ' OE1' ' CG ' ' A' ' 97' ' ' PRO . 86.6 mt-30 -61.93 -34.16 75.58 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.827 179.703 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . 0.438 ' ND1' ' H91' ' A' ' 201' ' ' MYR . 73.9 t60 -57.1 -41.81 79.6 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.974 0.416 . . . . 0.0 109.952 -179.982 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 96.2 mt-10 -62.5 -43.38 98.95 Favored 'General case' 0 C--O 1.238 0.482 0 C-N-CA 120.357 -0.537 . . . . 0.0 110.026 179.566 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.446 ' O ' ' CB ' ' A' ' 14' ' ' GLN . 62.6 mtp180 -65.16 -33.18 75.39 Favored 'General case' 0 C--O 1.208 -1.096 0 CA-C-N 116.038 -0.528 . . . . 0.0 109.58 179.668 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.638 ' CE1' H143 ' A' ' 201' ' ' MYR . 0.0 OUTLIER -58.4 -44.6 89.04 Favored 'General case' 0 C--N 1.322 -0.588 0 C-N-CA 120.77 -0.372 . . . . 0.0 110.62 -179.54 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 13.4 t -61.62 -48.83 86.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 C-N-CA 120.433 -0.507 . . . . 0.0 111.892 -179.863 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.414 ' OE2' HD11 ' A' ' 31' ' ' LEU . 70.0 mm-40 -76.02 -41.79 49.89 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.291 0.567 . . . . 0.0 111.428 -179.649 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . 0.446 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 66.6 tp60 -62.07 -50.4 72.11 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.498 -179.189 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.57 HD13 ' O ' ' A' ' 15' ' ' LEU . 0.3 OUTLIER -63.97 -49.17 73.58 Favored 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 120.303 -0.559 . . . . 0.0 109.99 179.828 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 94.9 mttt -58.93 -34.44 71.74 Favored 'General case' 0 C--N 1.324 -0.525 0 C-N-CA 120.707 -0.397 . . . . 0.0 110.729 -179.683 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 91.1 mt-30 -78.58 -36.2 44.79 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.864 179.633 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -56.39 -34.63 66.89 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.932 -0.576 . . . . 0.0 109.929 -179.749 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.472 ' O ' ' N ' ' A' ' 22' ' ' ARG . 3.7 mt -85.16 -35.06 21.96 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.156 0.503 . . . . 0.0 110.461 179.231 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 65.1 tttm -45.95 -41.68 11.94 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.478 -178.642 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.404 ' H ' HG22 ' A' ' 21' ' ' THR . 0.2 OUTLIER -75.71 -16.06 60.21 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.747 -179.942 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.472 ' N ' ' O ' ' A' ' 19' ' ' LEU . 86.2 mmt-85 -83.56 13.21 4.74 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 120.828 0.347 . . . . 0.0 110.28 -179.881 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 97.32 4.94 58.24 Favored Glycine 0 CA--C 1.522 0.512 0 N-CA-C 110.915 -0.874 . . . . 0.0 110.915 179.671 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.599 HG12 ' N ' ' A' ' 25' ' ' LYS . 15.7 t -93.5 169.33 1.38 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 C-N-CA 121.094 -0.242 . . . . 0.0 110.469 -179.798 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.599 ' N ' HG12 ' A' ' 24' ' ' VAL . 99.4 mttt -134.41 134.46 41.66 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.24 179.654 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 8.9 m -131.03 129.86 63.53 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.288 0 CA-C-N 116.601 -0.272 . . . . 0.0 110.268 179.812 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.4 ' HD2' ' HB3' ' A' ' 29' ' ' ALA . 16.0 pttp -110.13 163.59 13.45 Favored 'General case' 0 C--O 1.226 -0.134 0 CA-C-O 120.652 0.263 . . . . 0.0 110.585 179.771 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 98.0 m-85 -56.51 -34.75 67.3 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.021 0.439 . . . . 0.0 110.267 179.858 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.512 ' HA ' HD12 ' A' ' 32' ' ' LEU . . . -51.93 -23.32 4.8 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.236 179.708 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.487 ' O ' ' CB ' ' A' ' 34' ' ' PHE . 97.3 m-20 -62.2 -49.99 73.59 Favored 'General case' 0 C--O 1.219 -0.531 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.311 -179.547 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.433 ' O ' ' CB ' ' A' ' 35' ' ' PHE . 3.7 mp -63.32 -38.3 90.63 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 121.224 0.535 . . . . 0.0 109.837 179.565 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.512 HD12 ' HA ' ' A' ' 29' ' ' ALA . 42.9 mt -61.1 -51.32 69.63 Favored 'General case' 0 C--N 1.308 -1.199 0 C-N-CA 119.106 -1.038 . . . . 0.0 111.435 -179.068 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.408 ' O ' ' OD1' ' A' ' 36' ' ' ASP . 87.1 tttt -88.07 -54.18 4.35 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 112.864 0.691 . . . . 0.0 112.864 -178.287 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . 0.487 ' CB ' ' O ' ' A' ' 30' ' ' ASP . 9.7 t80 -53.48 -47.75 69.52 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.427 -178.093 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.433 ' CB ' ' O ' ' A' ' 31' ' ' LEU . 1.1 t80 -62.89 -48.88 77.07 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 120.348 -0.541 . . . . 0.0 110.341 179.978 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . 0.408 ' OD1' ' O ' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -62.94 -34.3 77.19 Favored 'General case' 0 C--O 1.234 0.282 0 C-N-CA 119.554 -0.858 . . . . 0.0 111.816 -179.052 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.439 ' O ' ' OG1' ' A' ' 41' ' ' THR . 3.2 t80 -62.15 -47.12 85.94 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.226 -178.734 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.505 ' O ' ' N ' ' A' ' 42' ' ' CYS . 29.8 m -71.17 -26.27 26.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.528 -179.47 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 24.4 mttt -61.22 -45.55 94.11 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 120.465 -0.494 . . . . 0.0 110.89 -179.584 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 89.3 m-20 -75.88 -50.55 14.74 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 120.549 -0.46 . . . . 0.0 111.41 -179.835 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.439 ' OG1' ' O ' ' A' ' 37' ' ' PHE . 1.6 p -70.27 -34.74 73.16 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.443 -179.501 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . 0.505 ' N ' ' O ' ' A' ' 38' ' ' VAL . 48.6 m 47.09 53.14 13.36 Favored Pre-proline 0 C--N 1.331 -0.219 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.416 -178.45 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.464 ' HD3' ' N ' ' A' ' 42' ' ' CYS . 68.6 Cg_endo -79.22 -33.21 1.48 Allowed 'Trans proline' 0 N--CA 1.488 1.165 0 C-N-CA 122.507 2.138 . . . . 0.0 112.463 -179.608 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . 0.882 ' CE2' H141 ' A' ' 201' ' ' MYR . 0.0 OUTLIER -87.86 20.12 3.21 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.971 -179.27 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.428 ' C ' ' H ' ' A' ' 47' ' ' GLN . 59.4 m-85 48.21 59.61 16.58 Favored Pre-proline 0 C--N 1.33 -0.277 0 C-N-CA 120.455 -0.498 . . . . 0.0 109.972 179.917 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo -51.82 -7.76 0.25 Allowed 'Trans proline' 0 C--N 1.312 -1.371 0 C-N-CA 122.893 2.395 . . . . 0.0 112.333 179.867 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.428 ' H ' ' C ' ' A' ' 45' ' ' PHE . 87.8 mt-30 -71.32 -54.37 11.04 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.635 -179.849 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.724 ' O ' ' H51' ' A' ' 201' ' ' MYR . 12.5 pt-20 -88.76 -28.59 20.39 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.576 179.254 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . 0.594 ' CA ' ' H92' ' A' ' 201' ' ' MYR . . . 79.12 66.8 1.66 Allowed Glycine 0 CA--C 1.525 0.696 0 N-CA-C 110.661 -0.976 . . . . 0.0 110.661 -179.615 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . 0.542 ' OG1' ' NE2' ' A' ' 98' ' ' GLN . 15.3 t -127.93 169.13 14.32 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.827 0.346 . . . . 0.0 111.012 -179.361 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.2 mt -98.88 132.08 44.85 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.253 0 CA-C-N 116.094 -0.503 . . . . 0.0 109.901 179.418 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . 0.676 ' H ' ' HE1' ' A' ' 44' ' ' TRP . 5.6 t0 -116.54 119.08 34.46 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.008 179.012 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 17.8 mm -82.98 -25.41 8.13 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.035 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -85.81 -57.18 3.15 Favored 'General case' 0 C--O 1.239 0.523 0 CA-C-O 121.471 0.653 . . . . 0.0 111.442 -179.116 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 95.7 mtt-85 -60.72 -33.27 72.64 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.396 -179.342 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' TRP . . . . . 0.629 ' CE3' ' CH2' ' A' ' 44' ' ' TRP . 34.2 t-105 -57.85 -37.7 74.35 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.114 0.483 . . . . 0.0 110.265 179.96 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 85.0 mtp180 -64.58 -37.94 89.3 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.183 179.79 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 41.2 ttm180 -60.95 -51.62 68.51 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 120.447 -0.501 . . . . 0.0 111.049 -179.551 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 6.9 p -68.85 -38.43 78.69 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.425 0 CA-C-O 120.896 0.379 . . . . 0.0 110.218 179.404 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -64.5 -39.05 96.53 Favored Glycine 0 CA--C 1.525 0.68 0 N-CA-C 111.135 -0.786 . . . . 0.0 111.135 179.689 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . 0.422 ' O ' ' OD1' ' A' ' 61' ' ' ASP . 64.0 t0 -62.64 -38.29 89.69 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.876 0.369 . . . . 0.0 110.326 -179.962 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 75.8 m -61.95 -38.42 88.44 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.447 -179.893 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 5.5 m-85 -62.71 -37.75 87.73 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.358 179.89 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 57.6 tt0 -63.11 -42.1 99.5 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.963 -179.898 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 62.2 t0 -60.22 -52.0 67.17 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.055 0.455 . . . . 0.0 110.456 -179.925 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 55.0 m-85 -62.2 -39.52 93.02 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.414 179.811 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 9.8 t80 -62.1 -40.53 96.18 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.291 179.818 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 88.3 m-20 -57.33 -32.72 67.0 Favored 'General case' 0 CA--C 1.518 -0.269 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.046 -179.27 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 25.0 p -65.64 -20.47 66.31 Favored 'General case' 0 C--N 1.317 -0.816 0 C-N-CA 119.748 -0.781 . . . . 0.0 110.034 179.281 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 69.7 m-85 -107.34 -51.45 2.91 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 116.024 -0.534 . . . . 0.0 112.399 -179.738 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -142.46 78.11 0.28 Allowed Glycine 0 CA--C 1.539 1.54 0 N-CA-C 111.074 -0.811 . . . . 0.0 111.074 -179.292 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . 0.412 ' O ' HG23 ' A' ' 75' ' ' VAL . 56.8 Cg_endo -75.98 -16.14 18.26 Favored 'Trans proline' 0 C--N 1.298 -2.093 0 C-N-CA 122.831 2.354 . . . . 0.0 111.735 -179.672 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 77.4 mm-40 -89.47 -38.39 14.09 Favored 'General case' 0 CA--C 1.505 -0.774 0 CA-C-O 121.567 0.699 . . . . 0.0 110.585 179.798 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 51.5 mmtt -65.48 -46.09 81.1 Favored 'General case' 0 C--N 1.308 -1.213 0 CA-C-N 114.82 -1.082 . . . . 0.0 111.123 -178.199 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.555 ' O ' HG12 ' A' ' 75' ' ' VAL . 54.6 t 38.51 84.06 0.19 Allowed Pre-proline 0 N--CA 1.451 -0.406 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.115 179.492 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_exo -55.41 126.86 23.92 Favored 'Trans proline' 0 C--N 1.311 -1.436 0 C-N-CA 121.925 1.75 . . . . 0.0 111.373 -179.629 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 58.0 t -82.08 -17.17 11.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.513 -179.936 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 22.6 p -48.19 -26.46 1.93 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.176 -179.35 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.27 -41.24 98.3 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.179 0.514 . . . . 0.0 110.583 179.661 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 8.4 m-85 -62.69 -37.31 85.96 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.346 179.829 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 59.9 m -58.58 -40.62 83.68 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.309 179.745 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 5.1 m-85 -59.67 -50.83 72.34 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.722 -179.675 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' TRP . . . . . 0.539 ' N ' ' CD1' ' A' ' 83' ' ' TRP . 6.1 m0 -59.8 -38.26 81.41 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.595 -179.881 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 92.9 m-20 -62.09 -45.28 94.18 Favored 'General case' 0 C--N 1.325 -0.457 0 C-N-CA 120.581 -0.447 . . . . 0.0 110.79 -179.339 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 56.7 tp -71.91 -53.99 11.42 Favored 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 120.341 -0.544 . . . . 0.0 110.5 179.87 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -58.54 -25.16 27.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 C-N-CA 120.766 -0.374 . . . . 0.0 110.483 179.884 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.401 ' CB ' ' O ' ' A' ' 83' ' ' TRP . 67.1 tttt -65.39 -50.24 66.25 Favored 'General case' 0 C--N 1.321 -0.672 0 C-N-CA 120.348 -0.541 . . . . 0.0 110.306 -179.79 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . 0.415 ' OE1' ' O ' ' A' ' 88' ' ' GLU . 1.0 OUTLIER -80.54 -20.84 42.59 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.782 -179.912 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.412 HD12 ' HA ' ' A' ' 89' ' ' LEU . 12.4 tp -62.15 -45.16 94.64 Favored 'General case' 0 N--CA 1.448 -0.57 0 C-N-CA 120.316 -0.554 . . . . 0.0 110.438 -178.686 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.482 ' O ' ' N ' ' A' ' 92' ' ' LYS . 2.9 mt -65.02 -43.63 96.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 C-N-CA 120.334 -0.547 . . . . 0.0 109.955 179.943 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 98.0 m-20 -47.03 -14.06 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.791 -178.199 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . 0.482 ' N ' ' O ' ' A' ' 90' ' ' ILE . 86.4 tttt -68.58 133.9 49.2 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.371 179.92 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -64.46 -41.41 96.53 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.942 -179.939 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 99.1 mt-10 -105.79 55.17 0.68 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.053 -179.664 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.515 ' O ' ' ND2' ' A' ' 96' ' ' ASN . 6.9 t -45.27 -75.48 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.497 -179.476 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' ASN . . . . . 0.515 ' ND2' ' O ' ' A' ' 95' ' ' VAL . 0.9 OUTLIER -153.74 160.54 30.82 Favored Pre-proline 0 C--N 1.326 -0.431 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.738 179.979 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . 0.467 ' CG ' ' OE1' ' A' ' 7' ' ' GLN . 16.3 Cg_endo -56.83 -11.89 8.07 Favored 'Trans proline' 0 N--CA 1.495 1.602 0 C-N-CA 122.959 2.439 . . . . 0.0 112.059 178.751 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . 0.542 ' NE2' ' OG1' ' A' ' 50' ' ' THR . 4.6 pt20 -45.88 -18.63 0.05 OUTLIER 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.999 -179.758 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . 0.445 ' N ' ' C ' ' A' ' 97' ' ' PRO . 64.3 t -61.6 -47.69 92.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 C-N-CA 120.617 -0.433 . . . . 0.0 110.655 -179.904 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 97.6 mmm -80.31 -42.66 22.61 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.809 179.948 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -60.86 -26.1 67.14 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.401 -179.652 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -64.55 -15.46 61.0 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.423 179.934 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 74.9 t -62.03 -41.21 90.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.37 179.81 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -53.96 -51.38 64.03 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.851 -179.662 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 85.9 mt-30 -133.6 134.76 43.67 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.324 179.877 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . 0.415 ' O ' ' O ' ' A' ' 107' ' ' GLU . 4.9 t -146.45 157.48 43.76 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.634 -179.86 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . 0.415 ' O ' ' O ' ' A' ' 106' ' ' THR . 75.4 mm-40 44.39 -169.37 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.343 179.856 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . 0.513 ' O ' ' N ' ' A' ' 110' ' ' LEU . 93.0 mt-10 -109.07 122.16 46.67 Favored 'General case' 0 CA--C 1.515 -0.393 0 N-CA-C 109.697 -0.483 . . . . 0.0 109.697 179.387 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 44.0 pt -47.69 -12.43 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.14 179.573 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.513 ' N ' ' O ' ' A' ' 108' ' ' GLU . 31.5 mt -66.25 -41.95 89.25 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.812 179.615 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -66.12 -36.0 81.98 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.479 -179.899 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 45.9 m -57.7 -45.44 85.68 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.684 -179.289 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 29.6 t30 -65.56 -43.33 90.2 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.637 179.676 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 20.8 m -166.06 150.94 8.28 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.559 179.663 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 87.4 mt-30 -91.09 18.8 6.35 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.487 179.715 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 15.3 p -60.16 -47.42 85.99 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.495 -179.809 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 94.8 m-20 -63.86 -42.83 97.46 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.539 179.684 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 36.4 tp -132.95 117.03 17.17 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.27 179.836 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -107.82 142.73 37.42 Favored 'General case' 0 C--N 1.333 -0.114 0 CA-C-O 120.771 0.32 . . . . 0.0 110.329 179.589 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 85.5 t60 -100.13 129.15 46.13 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.431 -179.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 73.0 m80 -108.32 151.4 26.04 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.368 -179.944 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 52.3 m-70 -113.6 138.48 50.11 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.325 -179.826 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 78.2 m80 -117.29 146.51 43.28 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.304 -179.91 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 124' ' ' HIS . . . . . . . . . . . . . 79.9 t60 -111.93 117.42 32.69 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.498 -179.946 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 77.6 m80 . . . . . 0 C--O 1.22 -0.456 0 CA-C-O 117.985 -1.007 . . . . 0.0 110.49 -179.861 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 201' ' ' MYR . . . . . 0.882 H141 ' CE2' ' A' ' 44' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.875 0 N-CA-C 111.142 -0.783 . . . . 0.0 111.142 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 87.1 mt-30 -59.3 -27.05 65.51 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.952 0.406 . . . . 0.0 110.389 -179.925 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.534 ' OE1' ' H52' ' A' ' 201' ' ' MYR . 82.2 tt0 -53.9 -21.48 7.9 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.613 179.862 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 34.5 tp -40.19 -29.59 0.08 Allowed 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 120.959 0.409 . . . . 0.0 110.418 -179.321 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 78.3 p -55.38 -38.6 69.07 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 120.586 -0.446 . . . . 0.0 110.078 179.947 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 99.7 mm-40 -62.28 -37.23 84.71 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.585 179.64 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 75.1 t60 -57.24 -42.29 81.21 Favored 'General case' 0 C--N 1.332 -0.169 0 N-CA-C 109.91 -0.404 . . . . 0.0 109.91 -179.854 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 81.2 mm-40 -60.11 -45.63 92.32 Favored 'General case' 0 C--O 1.243 0.726 0 CA-C-O 121.208 0.528 . . . . 0.0 109.873 179.318 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.415 ' O ' ' CB ' ' A' ' 14' ' ' GLN . 70.3 mtp180 -64.87 -33.34 75.78 Favored 'General case' 0 C--O 1.212 -0.912 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 179.327 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.574 ' CE1' HD23 ' A' ' 15' ' ' LEU . 49.0 t80 -59.37 -38.17 79.78 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 120.217 -0.593 . . . . 0.0 110.3 -179.295 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 3.4 t -62.07 -50.01 81.8 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 C-N-CA 119.774 -0.77 . . . . 0.0 111.37 179.974 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 97.3 mt-10 -79.38 -35.86 40.12 Favored 'General case' 0 C--N 1.322 -0.587 0 C-N-CA 120.232 -0.587 . . . . 0.0 112.061 -179.082 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . 0.415 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 66.2 tp60 -68.71 -51.68 39.04 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.527 -179.005 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.574 HD23 ' CE1' ' A' ' 11' ' ' TYR . 0.2 OUTLIER -63.35 -46.43 86.62 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.343 -179.518 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -57.76 -31.95 67.0 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 178.838 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 49.2 tt0 -75.24 -39.45 59.92 Favored 'General case' 0 C--O 1.239 0.552 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.198 178.879 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.417 ' O ' HG23 ' A' ' 21' ' ' THR . . . -58.07 -25.06 60.79 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-N 115.933 -0.576 . . . . 0.0 109.725 179.536 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.448 ' O ' ' N ' ' A' ' 22' ' ' ARG . 3.7 mt -85.36 -40.73 16.17 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.199 178.581 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 92.9 mttt -43.24 -45.69 5.86 Favored 'General case' 0 N--CA 1.464 0.273 0 C-N-CA 120.353 -0.539 . . . . 0.0 111.035 -179.2 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.49 ' C ' ' H ' ' A' ' 23' ' ' GLY . 0.2 OUTLIER -63.62 -31.38 72.53 Favored 'General case' 0 C--N 1.324 -0.535 0 C-N-CA 120.467 -0.493 . . . . 0.0 110.758 -179.812 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.448 ' N ' ' O ' ' A' ' 19' ' ' LEU . 80.1 mmt-85 -69.05 10.24 0.32 Allowed 'General case' 0 C--O 1.232 0.18 0 C-N-CA 120.795 -0.362 . . . . 0.0 110.457 -179.745 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . 0.49 ' H ' ' C ' ' A' ' 21' ' ' THR . . . 91.52 22.49 31.4 Favored Glycine 0 N--CA 1.467 0.736 0 N-CA-C 111.162 -0.775 . . . . 0.0 111.162 179.738 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.642 HG12 ' N ' ' A' ' 25' ' ' LYS . 39.8 t -105.27 168.27 2.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-O 120.63 0.253 . . . . 0.0 110.575 -179.882 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.642 ' N ' HG12 ' A' ' 24' ' ' VAL . 98.9 mttt -134.96 105.15 6.25 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.171 179.356 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.491 ' CG1' ' OD2' ' A' ' 30' ' ' ASP . 1.7 t -117.92 93.66 2.67 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.443 0 C-N-CA 120.895 -0.322 . . . . 0.0 110.765 -179.656 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 25.5 pttt -81.43 165.22 21.47 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.711 179.619 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 98.0 m-85 -48.21 -31.83 6.33 Favored 'General case' 0 C--O 1.241 0.614 0 CA-C-O 121.254 0.55 . . . . 0.0 110.647 179.895 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -54.43 -23.22 15.05 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.012 179.552 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.491 ' OD2' ' CG1' ' A' ' 26' ' ' VAL . 21.4 t0 -65.11 -42.0 94.4 Favored 'General case' 0 C--O 1.218 -0.567 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.894 -179.54 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.482 ' O ' ' CB ' ' A' ' 35' ' ' PHE . 4.7 mp -65.16 -40.58 94.55 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-O 121.029 0.443 . . . . 0.0 109.856 -179.866 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 40.7 mt -58.91 -46.35 88.11 Favored 'General case' 0 C--N 1.312 -1.064 0 C-N-CA 119.34 -0.944 . . . . 0.0 111.086 -178.216 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.411 ' O ' ' CD1' ' A' ' 37' ' ' PHE . 83.3 tttt -85.67 -49.99 7.54 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.896 -178.889 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . 0.44 ' CB ' ' O ' ' A' ' 30' ' ' ASP . 49.7 t80 -61.51 -50.75 71.44 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.206 -178.742 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.482 ' CB ' ' O ' ' A' ' 31' ' ' LEU . 5.4 t80 -61.6 -46.79 88.33 Favored 'General case' 0 C--N 1.33 -0.264 0 O-C-N 123.325 0.391 . . . . 0.0 110.241 -179.152 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 93.1 m-20 -63.44 -38.31 90.64 Favored 'General case' 0 C--N 1.34 0.167 0 C-N-CA 120.597 -0.441 . . . . 0.0 111.224 -179.431 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.411 ' CD1' ' O ' ' A' ' 33' ' ' LYS . 2.8 m-85 -61.09 -46.49 90.41 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.487 -178.929 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.524 ' O ' ' N ' ' A' ' 42' ' ' CYS . 27.6 m -76.87 -37.29 27.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 C-N-CA 120.307 -0.557 . . . . 0.0 110.425 -179.779 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 61.5 tttm -56.49 -29.25 61.57 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.763 -179.627 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 66.4 t0 -49.73 -62.43 1.56 Allowed 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.748 -0.381 . . . . 0.0 111.138 -179.446 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 17.2 p -115.21 1.1 13.74 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 116.529 -0.305 . . . . 0.0 111.562 -179.84 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . 0.524 ' N ' ' O ' ' A' ' 38' ' ' VAL . 2.2 m 40.49 59.25 7.72 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.434 -178.479 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.483 ' HD3' ' N ' ' A' ' 42' ' ' CYS . 9.1 Cg_exo -67.75 -29.65 35.31 Favored 'Trans proline' 0 N--CA 1.496 1.668 0 C-N-CA 122.442 2.094 . . . . 0.0 112.568 -179.415 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . 0.535 ' HE1' ' H ' ' A' ' 52' ' ' ASP . 0.0 OUTLIER -64.75 0.47 1.14 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.827 -179.272 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.487 ' N ' ' CD ' ' A' ' 46' ' ' PRO . 45.9 t80 45.25 52.25 10.29 Favored Pre-proline 0 C--N 1.327 -0.395 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.078 -179.789 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.487 ' CD ' ' N ' ' A' ' 45' ' ' PHE . 19.8 Cg_endo -59.23 -7.17 4.64 Favored 'Trans proline' 0 C--N 1.307 -1.627 0 C-N-CA 122.965 2.443 . . . . 0.0 112.176 179.804 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 99.3 mm-40 -51.22 -54.38 26.2 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 120.534 -0.466 . . . . 0.0 110.167 -179.491 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.504 ' O ' ' H51' ' A' ' 201' ' ' MYR . 40.6 tt0 -89.65 -13.36 37.21 Favored 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 120.737 -0.385 . . . . 0.0 110.697 179.028 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . 0.685 ' O ' ' H71' ' A' ' 201' ' ' MYR . . . 77.32 71.58 1.19 Allowed Glycine 0 CA--C 1.522 0.53 0 N-CA-C 110.474 -1.051 . . . . 0.0 110.474 -179.318 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 1.7 t -137.22 162.99 31.97 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 121.052 -0.259 . . . . 0.0 110.719 -179.383 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.443 ' CD1' HD23 ' A' ' 89' ' ' LEU . 1.5 mt -91.6 141.97 13.71 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.101 179.445 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . 0.535 ' H ' ' HE1' ' A' ' 44' ' ' TRP . 9.3 m-20 -113.77 119.21 36.56 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.987 -0.552 . . . . 0.0 111.503 179.835 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.503 ' CG1' HD12 ' A' ' 90' ' ' ILE . 27.8 mm -95.21 -57.01 4.69 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 C-N-CA 120.768 -0.373 . . . . 0.0 110.963 178.694 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 99.7 mttt -75.81 -46.73 28.98 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-O 121.137 0.494 . . . . 0.0 111.52 -179.784 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 79.7 mtp180 -60.56 -32.4 71.47 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 116.031 -0.531 . . . . 0.0 109.897 -179.668 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 26.9 t-105 -59.67 -36.86 77.3 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 116.039 -0.528 . . . . 0.0 109.759 178.691 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 63.3 ttm-85 -66.75 -38.22 86.19 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.498 179.505 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 82.7 mtp180 -57.22 -48.09 79.69 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 120.577 -0.449 . . . . 0.0 111.318 -179.122 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 4.3 p -66.14 -34.25 68.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 C-N-CA 120.602 -0.439 . . . . 0.0 110.059 179.461 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -66.22 -38.85 94.17 Favored Glycine 0 CA--C 1.526 0.772 0 N-CA-C 111.197 -0.761 . . . . 0.0 111.197 179.545 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 99.9 m-20 -62.46 -46.02 90.41 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.758 0.313 . . . . 0.0 111.07 -179.524 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 88.6 m -65.74 -42.48 90.95 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.173 0.511 . . . . 0.0 110.305 179.941 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 6.8 m-85 -67.47 -30.05 69.66 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.289 179.572 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 59.7 tt0 -62.33 -43.75 98.09 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.228 -179.888 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 31.3 t0 -61.28 -50.74 71.81 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.11 0.481 . . . . 0.0 110.422 179.232 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 34.0 m-85 -62.88 -34.91 78.37 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.075 -0.512 . . . . 0.0 109.947 179.318 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.548 ' CE2' ' O ' ' A' ' 71' ' ' GLY . 76.2 t80 -62.43 -36.85 83.68 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.005 -0.543 . . . . 0.0 109.96 179.679 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 23.5 m-20 -62.63 -37.77 87.63 Favored 'General case' 0 CA--C 1.519 -0.217 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.334 179.801 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 66.5 p -61.27 -19.45 61.73 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 119.812 -0.755 . . . . 0.0 109.16 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 60.0 m-85 -99.27 -49.99 4.28 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 112.752 0.649 . . . . 0.0 112.752 179.731 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . 0.548 ' O ' ' CE2' ' A' ' 67' ' ' TYR . . . 173.02 92.73 0.08 OUTLIER Glycine 0 CA--C 1.537 1.429 0 N-CA-C 111.024 -0.83 . . . . 0.0 111.024 -178.874 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . 0.514 ' O ' HG23 ' A' ' 75' ' ' VAL . 52.9 Cg_endo -84.23 16.06 2.02 Favored 'Trans proline' 0 N--CA 1.487 1.103 0 C-N-CA 124.12 3.214 . . . . 0.0 111.182 179.458 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 92.4 mt-10 -88.24 -49.65 6.85 Favored 'General case' 0 CA--C 1.51 -0.583 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.248 -178.896 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.423 ' O ' ' O ' ' A' ' 75' ' ' VAL . 0.5 OUTLIER -62.14 -44.31 96.9 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.015 -0.993 . . . . 0.0 110.614 179.671 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.514 HG23 ' O ' ' A' ' 72' ' ' PRO . 78.8 t 36.31 94.16 0.04 OUTLIER Pre-proline 0 N--CA 1.467 0.408 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.395 -179.52 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_exo -57.63 126.21 21.14 Favored 'Trans proline' 0 N--CA 1.493 1.473 0 C-N-CA 121.377 1.385 . . . . 0.0 112.283 -179.672 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 60.6 t -83.83 -25.9 7.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.905 179.144 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . 0.43 ' H ' HG23 ' A' ' 78' ' ' THR . 22.0 p -44.73 -24.25 0.19 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.499 -179.112 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -59.86 -40.67 89.41 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.348 179.635 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 35.9 t80 -64.61 -39.47 93.78 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.717 179.872 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 11.6 t -58.66 -46.67 86.66 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.028 -179.409 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 14.6 m-85 -62.7 -49.07 76.55 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.731 -0.388 . . . . 0.0 110.942 179.622 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' TRP . . . . . . . . . . . . . 53.1 t90 -53.82 -39.17 65.29 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.579 -179.576 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 92.8 m-20 -61.64 -47.02 87.27 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 120.473 -0.491 . . . . 0.0 111.167 -179.431 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 36.5 tp -72.63 -54.58 8.68 Favored 'General case' 0 C--O 1.221 -0.444 0 C-N-CA 120.186 -0.606 . . . . 0.0 110.496 179.717 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -55.56 -26.09 18.99 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-O 120.765 0.317 . . . . 0.0 110.507 179.575 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 70.8 tttt -65.66 -51.46 59.33 Favored 'General case' 0 C--N 1.322 -0.613 0 C-N-CA 119.966 -0.693 . . . . 0.0 110.224 179.952 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . 0.401 ' O ' ' OE1' ' A' ' 88' ' ' GLU . 1.1 pp20? -80.07 -19.77 46.74 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.009 -179.498 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.443 HD23 ' CD1' ' A' ' 51' ' ' ILE . 14.6 tp -61.68 -44.37 97.08 Favored 'General case' 0 N--CA 1.446 -0.639 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.901 -179.142 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.503 HD12 ' CG1' ' A' ' 53' ' ' ILE . 3.4 mt -64.02 -43.78 97.65 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.109 0 C-N-CA 120.174 -0.611 . . . . 0.0 109.833 -179.406 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 95.8 m-20 -64.14 -14.84 57.76 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.65 -179.345 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 21.1 tttt -79.48 153.54 29.53 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.519 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -92.74 -9.44 40.65 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.777 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -63.2 -18.26 63.3 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.427 179.961 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 10.9 t -69.3 134.17 30.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.144 -179.732 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' ASN . . . . . 0.564 ' O ' ' N ' ' A' ' 98' ' ' GLN . 0.7 OUTLIER -55.42 161.23 3.04 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.889 -179.579 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_exo -42.61 -12.93 0.04 OUTLIER 'Trans proline' 0 N--CA 1.491 1.346 0 C-N-CA 123.006 2.471 . . . . 0.0 112.23 178.995 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . 0.564 ' N ' ' O ' ' A' ' 96' ' ' ASN . 2.2 pt20 -46.87 -25.29 0.74 Allowed 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.425 -179.672 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 93.5 t -63.05 -50.23 80.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.019 -179.524 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 97.5 mmm -77.19 -38.1 52.22 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.694 179.708 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . 0.453 ' O ' ' OE2' ' A' ' 48' ' ' GLU . . . -65.58 -34.61 78.65 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.662 -179.934 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -56.86 -16.19 6.23 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.732 -179.901 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 76.3 t -64.08 -24.5 35.89 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 CA-C-N 116.51 -0.313 . . . . 0.0 110.579 179.509 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . 0.525 ' O ' ' N ' ' A' ' 106' ' ' THR . . . -62.38 -39.13 92.2 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.455 -0.339 . . . . 0.0 110.582 -179.958 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 87.4 mt-30 52.08 -85.35 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.616 179.865 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . 0.525 ' N ' ' O ' ' A' ' 104' ' ' ALA . 58.6 p -83.07 167.55 17.75 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.619 179.984 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 85.1 mt-10 -132.71 167.95 19.2 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.044 -179.741 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . 0.497 ' OE1' ' N ' ' A' ' 108' ' ' GLU . 57.1 mp0 -101.39 121.38 41.81 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.77 -0.456 . . . . 0.0 109.77 179.096 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 45.0 pt -46.34 -17.06 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.202 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.463 ' N ' ' C ' ' A' ' 108' ' ' GLU . 34.1 mt -63.82 -42.12 97.72 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.297 179.685 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . 0.433 ' O ' ' O ' ' A' ' 114' ' ' SER . 88.6 tttt -63.84 -44.28 93.67 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.527 179.437 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . 0.423 ' O ' ' O ' ' A' ' 111' ' ' LYS . 1.2 p 38.66 -161.44 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.877 179.921 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' ASN . . . . . 0.42 ' N ' ' OG ' ' A' ' 112' ' ' SER . 94.2 m-20 -63.62 -43.12 97.78 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.745 -179.52 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . 0.433 ' O ' ' O ' ' A' ' 111' ' ' LYS . 6.4 m -93.9 129.05 40.49 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.277 179.96 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 84.9 mt-30 -86.92 34.58 0.67 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.838 0.351 . . . . 0.0 110.309 -179.776 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 64.1 p -65.75 -31.14 71.96 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.409 -179.858 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 97.0 m-20 -84.08 -53.99 5.15 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.527 179.777 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 54.2 tp -63.56 -42.47 98.35 Favored 'General case' 0 N--CA 1.461 0.122 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.801 -179.818 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 63.0 mm-40 56.75 60.16 3.19 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.511 -0.313 . . . . 0.0 110.649 -179.617 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 60.9 t-80 -80.13 139.0 37.02 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.57 179.962 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 75.3 m80 -116.22 143.26 45.75 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.772 179.859 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 97.3 m-70 -110.3 139.27 45.65 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.507 -179.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 74.8 m80 -112.06 141.25 45.96 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.391 179.799 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 124' ' ' HIS . . . . . . . . . . . . . 91.1 m-70 -117.22 146.14 43.45 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.458 -179.92 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 73.9 m-70 . . . . . 0 C--O 1.22 -0.478 0 CA-C-O 117.992 -1.004 . . . . 0.0 110.504 -179.875 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 201' ' ' MYR . . . . . 0.685 ' H71' ' O ' ' A' ' 49' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.675 0 N-CA-C 110.873 -0.891 . . . . 0.0 110.873 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 86.7 mt-30 -63.72 -34.1 77.13 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.807 0.337 . . . . 0.0 110.709 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.416 ' OE1' ' H32' ' A' ' 201' ' ' MYR . 98.9 mt-10 -46.96 -24.34 0.59 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.677 179.926 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 34.6 tp -48.99 -34.19 12.57 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-O 121.103 0.478 . . . . 0.0 110.232 -179.55 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 46.5 m -54.66 -37.78 66.13 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.115 179.871 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 97.5 mm-40 -62.79 -32.06 73.16 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.375 179.804 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 59.8 t-80 -60.63 -43.89 96.99 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.933 0.397 . . . . 0.0 110.376 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 81.2 tt0 -60.59 -51.28 70.1 Favored 'General case' 0 C--O 1.244 0.808 0 CA-C-O 121.335 0.588 . . . . 0.0 110.105 179.729 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.413 ' O ' ' CB ' ' A' ' 14' ' ' GLN . 76.3 mtt-85 -62.56 -31.52 72.33 Favored 'General case' 0 C--O 1.211 -0.938 0 CA-C-N 115.897 -0.592 . . . . 0.0 109.458 179.513 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.461 ' OH ' ' CD2' ' A' ' 89' ' ' LEU . 36.5 t80 -60.23 -37.59 80.81 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 120.936 -0.306 . . . . 0.0 110.326 -179.52 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 2.4 t -62.75 -49.69 82.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 C-N-CA 120.056 -0.657 . . . . 0.0 110.914 -179.803 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 95.6 mt-10 -79.25 -35.9 40.77 Favored 'General case' 0 C--N 1.326 -0.436 0 C-N-CA 120.398 -0.521 . . . . 0.0 111.682 -179.302 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . 0.413 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 70.9 tp60 -69.15 -52.39 28.58 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.199 -178.941 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.613 HD13 ' O ' ' A' ' 15' ' ' LEU . 0.3 OUTLIER -61.73 -45.64 93.05 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 -179.406 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.486 ' HB3' HG11 ' A' ' 26' ' ' VAL . 63.9 mttm -55.51 -35.94 66.15 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 120.482 -0.487 . . . . 0.0 110.156 179.486 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 77.3 mt-30 -71.87 -42.0 67.36 Favored 'General case' 0 C--O 1.241 0.641 0 CA-C-O 121.264 0.554 . . . . 0.0 110.552 178.64 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.59 ' O ' HG22 ' A' ' 21' ' ' THR . . . -54.23 -45.18 72.25 Favored 'General case' 0 C--O 1.223 -0.31 0 CA-C-N 115.788 -0.642 . . . . 0.0 109.599 179.93 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.503 ' O ' ' N ' ' A' ' 22' ' ' ARG . 4.4 mt -65.62 -37.9 87.88 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.856 0.36 . . . . 0.0 110.511 178.666 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 77.0 tttt -44.07 -36.74 2.69 Favored 'General case' 0 C--N 1.321 -0.637 0 C-N-CA 120.537 -0.465 . . . . 0.0 109.848 -179.44 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.59 HG22 ' O ' ' A' ' 18' ' ' ALA . 1.2 t -63.27 -32.06 73.37 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.215 179.318 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.503 ' N ' ' O ' ' A' ' 19' ' ' LEU . 26.3 mmt-85 -73.46 19.53 0.1 Allowed 'General case' 0 N--CA 1.462 0.162 0 CA-C-O 120.959 0.409 . . . . 0.0 110.546 -179.715 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . 0.488 ' H ' ' C ' ' A' ' 21' ' ' THR . . . 81.45 15.34 76.49 Favored Glycine 0 CA--C 1.524 0.609 0 N-CA-C 110.625 -0.99 . . . . 0.0 110.625 179.974 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.451 HG12 ' H ' ' A' ' 25' ' ' LYS . 3.4 t -92.61 167.53 1.62 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 N-CA-C 110.097 -0.334 . . . . 0.0 110.097 -179.795 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.451 ' H ' HG12 ' A' ' 24' ' ' VAL . 55.5 mtmt -128.56 133.21 48.31 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 110.143 -0.317 . . . . 0.0 110.143 179.71 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.486 HG11 ' HB3' ' A' ' 16' ' ' LYS . 2.1 m -133.37 110.54 14.98 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.333 0 CA-C-N 116.62 -0.264 . . . . 0.0 110.512 179.854 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 25.7 pttt -108.92 165.15 11.79 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-O 120.615 0.245 . . . . 0.0 110.459 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 76.3 m-85 -48.52 -39.57 23.78 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.043 0.449 . . . . 0.0 110.318 179.941 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.421 ' HA ' HD12 ' A' ' 32' ' ' LEU . . . -55.69 -23.17 27.07 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.073 179.516 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.428 ' O ' ' CB ' ' A' ' 34' ' ' PHE . 44.7 t0 -62.14 -44.41 96.69 Favored 'General case' 0 C--O 1.221 -0.395 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.641 -179.719 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.483 ' O ' ' CB ' ' A' ' 35' ' ' PHE . 5.2 mp -68.08 -40.06 82.75 Favored 'General case' 0 C--O 1.218 -0.558 0 CA-C-O 121.099 0.476 . . . . 0.0 110.11 179.24 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.421 HD12 ' HA ' ' A' ' 29' ' ' ALA . 46.0 mt -58.84 -44.61 90.98 Favored 'General case' 0 C--N 1.317 -0.84 0 C-N-CA 119.856 -0.738 . . . . 0.0 110.862 -178.634 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.619 ' NZ ' ' CE2' ' A' ' 67' ' ' TYR . 88.3 tttt -85.61 -49.09 8.29 Favored 'General case' 0 C--N 1.321 -0.631 0 C-N-CA 120.741 -0.384 . . . . 0.0 111.704 -179.325 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . 0.428 ' CB ' ' O ' ' A' ' 30' ' ' ASP . 54.1 t80 -61.34 -50.52 72.6 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.927 -178.682 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.483 ' CB ' ' O ' ' A' ' 31' ' ' LEU . 6.1 t80 -61.83 -46.95 87.26 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.339 -179.685 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 90.8 m-20 -64.37 -36.18 83.31 Favored 'General case' 0 C--N 1.341 0.202 0 CA-C-O 120.747 0.308 . . . . 0.0 111.478 -179.617 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 1.8 m-85 -58.33 -45.47 88.02 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.854 -179.176 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.542 ' O ' ' N ' ' A' ' 42' ' ' CYS . 19.7 m -79.48 -39.05 20.26 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.871 179.97 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 85.9 tttt -55.21 -28.45 53.2 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.775 -179.229 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 96.5 m-20 -50.41 -63.28 1.17 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.389 -0.368 . . . . 0.0 111.134 -179.43 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.445 ' O ' ' SG ' ' A' ' 42' ' ' CYS . 22.9 p -114.51 4.48 15.23 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.983 -179.87 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . 0.542 ' N ' ' O ' ' A' ' 38' ' ' VAL . 19.5 p 41.29 54.68 7.9 Favored Pre-proline 0 C--N 1.331 -0.214 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.679 -179.109 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.461 ' C ' ' H ' ' A' ' 45' ' ' PHE . 57.8 Cg_endo -72.93 -25.16 16.78 Favored 'Trans proline' 0 N--CA 1.491 1.352 0 C-N-CA 122.469 2.113 . . . . 0.0 112.142 -179.996 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . 0.63 ' NE1' H132 ' A' ' 201' ' ' MYR . 1.2 t-105 -61.53 -1.41 0.56 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.526 -179.52 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.461 ' H ' ' C ' ' A' ' 43' ' ' PRO . 4.8 t80 50.02 54.36 15.61 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-O 121.021 0.438 . . . . 0.0 110.087 -179.856 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.461 ' CD ' ' N ' ' A' ' 45' ' ' PHE . 29.5 Cg_endo -65.21 -10.55 26.24 Favored 'Trans proline' 0 C--N 1.308 -1.584 0 C-N-CA 122.863 2.375 . . . . 0.0 112.117 179.948 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 86.9 mt-30 -58.44 -52.39 65.84 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.248 -179.613 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.615 ' O ' ' H42' ' A' ' 201' ' ' MYR . 50.2 tt0 -88.81 -13.76 38.61 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.172 179.472 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . 0.54 ' C ' ' H91' ' A' ' 201' ' ' MYR . . . 72.53 65.58 2.29 Favored Glycine 0 CA--C 1.522 0.528 0 N-CA-C 110.494 -1.042 . . . . 0.0 110.494 -179.3 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . 0.543 ' OG1' ' NE2' ' A' ' 98' ' ' GLN . 2.4 t -136.76 155.88 49.25 Favored 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 120.998 -0.281 . . . . 0.0 110.775 -179.536 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.5 mt -85.24 140.74 15.53 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-O 121.074 0.464 . . . . 0.0 110.537 179.308 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -110.78 121.47 45.43 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.474 -0.785 . . . . 0.0 110.995 179.378 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.473 ' CG1' HD12 ' A' ' 90' ' ' ILE . 32.6 mm -94.81 -56.53 5.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.203 179.324 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 68.6 mmtt -74.07 -49.04 25.82 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.359 -179.522 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 78.1 mtp85 -61.07 -35.17 76.23 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.212 -179.742 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 22.8 t-105 -61.94 -38.54 88.83 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.791 179.407 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 61.7 ttt85 -62.86 -39.05 93.23 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.276 -179.901 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -59.23 -50.75 72.82 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 120.89 -0.324 . . . . 0.0 111.103 -179.345 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 6.4 p -73.54 -36.85 48.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-O 120.84 0.352 . . . . 0.0 110.825 179.748 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . 0.428 ' O ' ' CB ' ' A' ' 64' ' ' GLN . . . -64.06 -54.85 27.66 Favored Glycine 0 C--O 1.223 -0.59 0 N-CA-C 111.438 -0.665 . . . . 0.0 111.438 -179.104 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 62.5 m-20 -63.35 -35.86 81.8 Favored 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 120.828 -0.349 . . . . 0.0 110.581 -179.536 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 3.8 m -64.01 -62.57 1.55 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.841 0.353 . . . . 0.0 111.355 -179.509 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 21.1 m-85 -63.5 -41.97 98.52 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.972 -179.701 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . 0.511 ' O ' ' ND2' ' A' ' 68' ' ' ASN . 56.7 tt0 -62.92 -42.21 99.72 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.877 -179.582 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 24.5 t0 -54.7 -56.75 15.85 Favored 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 120.476 -0.49 . . . . 0.0 110.944 -179.61 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 65.2 m-85 -64.46 -41.47 96.49 Favored 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 120.678 -0.409 . . . . 0.0 110.787 179.846 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.619 ' CE2' ' NZ ' ' A' ' 33' ' ' LYS . 65.6 t80 -57.61 -41.0 80.4 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.618 -179.403 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . 0.526 ' CG ' HG21 ' A' ' 75' ' ' VAL . 3.1 m120 -62.15 -43.82 97.99 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.122 -179.075 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 81.1 p -77.69 -18.64 56.42 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.238 -179.812 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 34.9 m-85 -109.73 16.09 22.32 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.381 179.933 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -160.41 -108.32 0.23 Allowed Glycine 0 CA--C 1.532 1.147 0 C-N-CA 120.539 -0.838 . . . . 0.0 111.213 -179.947 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 65.3 Cg_endo -73.71 141.49 30.84 Favored 'Trans proline' 0 N--CA 1.497 1.715 0 C-N-CA 121.98 1.787 . . . . 0.0 113.211 -179.487 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 81.5 tt0 -86.44 -43.38 12.84 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.548 179.343 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.664 ' CD ' ' H ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -82.75 -26.67 31.67 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 115.892 -0.595 . . . . 0.0 111.326 -179.46 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.535 ' H ' ' HD3' ' A' ' 74' ' ' LYS . 87.5 t 57.38 115.57 0.02 OUTLIER Pre-proline 0 N--CA 1.45 -0.436 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.683 -179.554 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_exo -53.73 127.84 27.1 Favored 'Trans proline' 0 N--CA 1.495 1.576 0 C-N-CA 121.473 1.449 . . . . 0.0 111.697 179.74 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.523 ' O ' HG12 ' A' ' 77' ' ' VAL . 61.1 t -82.65 -7.42 10.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.98 179.827 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 68.2 p -48.95 -22.02 0.77 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.549 -179.455 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.06 -27.06 68.63 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.532 179.722 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 34.6 t80 -60.95 -40.44 93.34 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.147 -179.815 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 20.9 m -57.98 -42.08 84.35 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.527 -179.687 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 13.5 m-85 -57.35 -53.8 54.03 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.772 -0.371 . . . . 0.0 110.621 -179.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' TRP . . . . . 0.484 ' C ' ' CD1' ' A' ' 83' ' ' TRP . 9.0 t-105 -56.39 -40.55 74.81 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.499 -179.983 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 83.8 m-20 -61.27 -45.41 94.61 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 120.484 -0.486 . . . . 0.0 111.111 -179.01 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 42.4 tp -72.83 -57.62 3.94 Favored 'General case' 0 C--O 1.218 -0.567 0 C-N-CA 120.337 -0.545 . . . . 0.0 110.574 179.84 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -53.75 -26.41 13.68 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 C-N-CA 120.733 -0.387 . . . . 0.0 110.379 179.452 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.415 ' CB ' ' O ' ' A' ' 83' ' ' TRP . 64.2 tttt -65.44 -50.93 63.56 Favored 'General case' 0 C--N 1.322 -0.608 0 C-N-CA 120.404 -0.519 . . . . 0.0 110.393 179.938 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . 0.434 ' O ' ' OD1' ' A' ' 91' ' ' ASP . 1.1 pp20? -80.75 -19.71 44.33 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.774 179.954 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.461 ' CD2' ' OH ' ' A' ' 11' ' ' TYR . 12.6 tp -62.17 -43.76 98.12 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.322 -178.746 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.473 HD12 ' CG1' ' A' ' 53' ' ' ILE . 3.1 mt -63.69 -45.47 97.33 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 C-N-CA 120.271 -0.572 . . . . 0.0 110.847 -178.783 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . 0.434 ' OD1' ' O ' ' A' ' 88' ' ' GLU . 4.4 p30 -81.64 -4.92 57.45 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.433 -0.348 . . . . 0.0 111.075 -178.757 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . 0.471 ' O ' ' CB ' ' A' ' 93' ' ' LYS . 86.4 tttt -57.24 -15.71 6.59 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.633 -179.904 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . 0.471 ' CB ' ' O ' ' A' ' 92' ' ' LYS . 59.4 tttt 79.63 -68.11 0.13 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.731 179.805 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 70.3 tt0 -73.94 54.7 0.52 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.057 0.456 . . . . 0.0 110.005 -179.741 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.441 ' O ' ' O ' ' A' ' 96' ' ' ASN . 1.9 t -87.46 164.76 2.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.4 -179.636 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' ASN . . . . . 0.641 ' H ' ' ND2' ' A' ' 96' ' ' ASN . 0.0 OUTLIER -42.19 167.04 0.07 OUTLIER Pre-proline 0 C--N 1.327 -0.395 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.353 179.731 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 77.0 Cg_exo -40.38 -14.01 0.03 OUTLIER 'Trans proline' 0 C--N 1.312 -1.386 0 C-N-CA 122.844 2.363 . . . . 0.0 112.485 179.174 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . 0.601 ' N ' ' O ' ' A' ' 96' ' ' ASN . 12.1 tt0 -46.14 -33.19 3.38 Favored 'General case' 0 C--N 1.322 -0.629 0 C-N-CA 120.799 -0.361 . . . . 0.0 110.174 179.17 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 96.7 t -62.16 -49.72 82.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 C-N-CA 120.453 -0.499 . . . . 0.0 110.927 -178.877 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 98.6 mtp -80.41 -43.57 20.78 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.279 -0.418 . . . . 0.0 111.049 179.845 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -61.85 -27.25 68.65 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.406 -179.572 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . 0.565 ' HB2' ' O ' ' A' ' 98' ' ' GLN . . . -63.5 -15.54 58.15 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.379 -179.991 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 71.5 t -63.73 -18.43 22.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.781 -179.925 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . 0.527 ' HB3' ' OE2' ' A' ' 48' ' ' GLU . . . -54.42 -41.59 69.51 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.66 -179.632 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 99.4 mm-40 -40.43 114.97 0.5 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.559 179.84 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 45.3 p -67.37 -32.76 73.89 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.698 179.945 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 46.4 mm-40 -74.93 155.02 37.88 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.605 -179.836 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . 0.553 ' C ' ' H ' ' A' ' 110' ' ' LEU . 99.3 mt-10 -89.85 135.11 33.83 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.177 179.536 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 47.3 pt -59.14 0.77 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 115.965 -0.562 . . . . 0.0 110.201 179.564 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.553 ' H ' ' C ' ' A' ' 108' ' ' GLU . 96.6 mt -100.73 -9.43 21.8 Favored 'General case' 0 C--N 1.334 -0.097 0 C-N-CA 120.592 -0.443 . . . . 0.0 110.507 -179.857 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . 0.454 ' O ' ' O ' ' A' ' 114' ' ' SER . 86.3 tttt -71.3 -13.38 61.87 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.676 179.927 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 11.7 t -58.93 -45.38 90.53 Favored 'General case' 0 C--N 1.326 -0.45 0 C-N-CA 120.724 -0.391 . . . . 0.0 110.613 -179.895 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 13.4 m120 -64.54 -41.89 96.07 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.867 -179.785 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . 0.454 ' O ' ' O ' ' A' ' 111' ' ' LYS . 35.5 t -158.5 177.99 10.63 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.468 -179.815 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 95.5 mt-30 -53.5 -41.52 66.37 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.945 0.402 . . . . 0.0 110.467 -179.812 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 62.8 p -146.75 162.88 37.63 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.571 179.749 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -62.05 -45.08 95.1 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 120.92 -0.312 . . . . 0.0 110.517 179.452 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.431 ' O ' ' O ' ' A' ' 119' ' ' GLU . 58.9 tp -64.07 -43.37 95.66 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.35 -0.387 . . . . 0.0 110.247 179.739 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . 0.431 ' O ' ' O ' ' A' ' 118' ' ' LEU . 78.8 tt0 58.94 148.76 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.19 -179.63 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 58.1 m80 -125.24 140.41 52.87 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.54 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 95.4 m-70 -107.71 130.6 54.92 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.424 -179.938 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 96.5 m-70 -116.41 145.88 42.93 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.971 -0.558 . . . . 0.0 110.548 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 88.8 m-70 -109.02 131.73 54.79 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.539 179.924 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 124' ' ' HIS . . . . . . . . . . . . . 89.0 m-70 -126.85 138.28 53.3 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.523 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 93.5 m-70 . . . . . 0 C--O 1.22 -0.449 0 CA-C-O 117.936 -1.031 . . . . 0.0 110.606 179.942 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 201' ' ' MYR . . . . . 0.63 H132 ' NE1' ' A' ' 44' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.695 0 N-CA-C 111.134 -0.787 . . . . 0.0 111.134 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 99.3 mm-40 -56.92 -28.43 62.01 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.819 0.342 . . . . 0.0 110.34 -179.799 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.602 ' HB2' ' H21' ' A' ' 201' ' ' MYR . 91.0 mt-10 -57.67 -21.54 40.74 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.563 179.853 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 49.9 tp -40.46 -30.3 0.11 Allowed 'General case' 0 C--O 1.234 0.279 0 CA-C-O 121.004 0.431 . . . . 0.0 110.358 -179.31 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 16.3 t -59.88 -42.43 93.74 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 120.693 -0.403 . . . . 0.0 109.924 179.42 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . 0.499 ' N ' ' O ' ' A' ' 4' ' ' GLU . 87.0 mt-30 -61.39 -35.42 77.43 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.666 179.689 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 63.3 t60 -57.33 -44.1 83.95 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.059 -179.822 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 81.0 mm-40 -61.33 -45.22 95.35 Favored 'General case' 0 C--O 1.241 0.651 0 CA-C-O 121.061 0.457 . . . . 0.0 110.007 179.648 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.427 ' O ' ' CB ' ' A' ' 14' ' ' GLN . 64.5 mtp85 -64.41 -33.25 75.43 Favored 'General case' 0 C--O 1.212 -0.871 0 N-CA-C 109.22 -0.659 . . . . 0.0 109.22 179.636 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.478 ' CE1' HD23 ' A' ' 15' ' ' LEU . 53.4 t80 -60.09 -37.77 80.93 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 120.554 -0.458 . . . . 0.0 110.365 -179.52 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 4.5 t -61.62 -49.44 84.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 C-N-CA 120.056 -0.658 . . . . 0.0 111.048 179.935 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 80.9 mm-40 -80.72 -43.05 20.89 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 120.33 -0.548 . . . . 0.0 111.659 -179.33 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . 0.427 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 69.1 tp60 -61.36 -52.75 63.34 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.881 -0.6 . . . . 0.0 111.325 -178.977 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.595 HD13 ' O ' ' A' ' 15' ' ' LEU . 0.2 OUTLIER -63.21 -45.27 92.45 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 120.649 -0.42 . . . . 0.0 110.086 -179.613 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.532 ' HB3' HG11 ' A' ' 26' ' ' VAL . 92.0 mttt -58.16 -33.57 69.36 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 120.674 -0.411 . . . . 0.0 110.527 179.236 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 76.8 mt-30 -71.95 -41.68 67.48 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.178 0.513 . . . . 0.0 110.446 178.664 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.543 ' O ' HG22 ' A' ' 21' ' ' THR . . . -55.12 -42.98 73.68 Favored 'General case' 0 C--O 1.222 -0.368 0 CA-C-N 116.074 -0.512 . . . . 0.0 109.69 179.843 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.453 ' O ' ' N ' ' A' ' 22' ' ' ARG . 5.0 mt -66.62 -37.96 85.94 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.995 0.426 . . . . 0.0 110.703 178.579 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 61.6 tttm -45.61 -37.36 5.52 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 -179.62 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.543 HG22 ' O ' ' A' ' 18' ' ' ALA . 1.0 OUTLIER -61.14 -33.18 73.0 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.01 179.392 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.453 ' N ' ' O ' ' A' ' 19' ' ' LEU . 10.3 mmm180 -72.93 15.63 0.19 Allowed 'General case' 0 N--CA 1.464 0.266 0 CA-C-O 120.868 0.366 . . . . 0.0 110.41 -179.633 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . 0.471 ' H ' ' C ' ' A' ' 21' ' ' THR . . . 84.41 13.67 72.94 Favored Glycine 0 CA--C 1.525 0.696 0 N-CA-C 110.561 -1.016 . . . . 0.0 110.561 -179.872 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.549 HG12 ' N ' ' A' ' 25' ' ' LYS . 11.7 t -88.01 167.65 1.69 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 N-CA-C 110.314 -0.254 . . . . 0.0 110.314 179.993 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.549 ' N ' HG12 ' A' ' 24' ' ' VAL . 88.8 tttt -130.0 129.85 44.25 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.214 179.616 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.532 HG11 ' HB3' ' A' ' 16' ' ' LYS . 3.6 m -128.15 108.56 17.99 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.307 0 CA-C-N 116.503 -0.317 . . . . 0.0 110.543 -179.884 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.564 ' HD3' ' H ' ' A' ' 29' ' ' ALA . 12.5 tmtt? -109.49 165.22 11.82 Favored 'General case' 0 CA--C 1.527 0.074 0 N-CA-C 109.959 -0.385 . . . . 0.0 109.959 -179.824 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 89.8 m-85 -47.06 -35.94 7.5 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.923 0.392 . . . . 0.0 110.246 -179.973 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.564 ' H ' ' HD3' ' A' ' 27' ' ' LYS . . . -57.95 -24.03 56.25 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 121.185 0.517 . . . . 0.0 110.042 179.452 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 65.9 t0 -60.66 -48.36 82.14 Favored 'General case' 0 C--O 1.222 -0.367 0 CA-C-N 115.606 -0.724 . . . . 0.0 110.594 -179.697 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.539 ' H ' HD12 ' A' ' 31' ' ' LEU . 5.4 mp -63.72 -42.09 97.98 Favored 'General case' 0 C--O 1.217 -0.631 0 CA-C-O 121.048 0.452 . . . . 0.0 110.155 179.448 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.418 ' H ' ' HG ' ' A' ' 32' ' ' LEU . 30.4 mt -59.29 -44.95 92.45 Favored 'General case' 0 C--N 1.31 -1.119 0 C-N-CA 119.332 -0.947 . . . . 0.0 110.423 -178.892 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.465 ' O ' ' CD1' ' A' ' 37' ' ' PHE . 99.7 mttt -73.96 -41.68 61.62 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.075 -0.511 . . . . 0.0 112.366 -179.189 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . 0.863 ' O ' HG22 ' A' ' 38' ' ' VAL . 5.1 m-85 -83.07 -61.59 1.82 Allowed 'General case' 0 CA--C 1.511 -0.534 0 C-N-CA 120.738 -0.385 . . . . 0.0 111.214 -178.664 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.504 ' CB ' ' O ' ' A' ' 31' ' ' LEU . 17.1 t80 -41.98 -45.91 3.97 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.198 -179.322 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 80.1 m-20 -72.74 -41.49 65.08 Favored 'General case' 0 CA--C 1.529 0.164 0 C-N-CA 120.291 -0.564 . . . . 0.0 111.809 -179.44 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.465 ' CD1' ' O ' ' A' ' 33' ' ' LYS . 3.5 m-30 -63.34 -51.13 67.26 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 111.975 0.361 . . . . 0.0 111.975 -178.037 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.863 HG22 ' O ' ' A' ' 34' ' ' PHE . 6.5 m -67.68 -42.65 86.64 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.716 -179.563 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -65.47 -30.57 71.37 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.137 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 57.2 t0 -54.21 -49.23 69.88 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 120.84 -0.344 . . . . 0.0 110.544 -179.233 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 9.5 p -109.2 -8.67 15.09 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.037 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . 0.536 ' N ' ' O ' ' A' ' 38' ' ' VAL . 16.9 m 42.43 55.9 10.3 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.498 -179.526 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.53 ' C ' ' H ' ' A' ' 45' ' ' PHE . 74.3 Cg_endo -78.33 -26.63 5.99 Favored 'Trans proline' 0 N--CA 1.491 1.361 0 C-N-CA 122.491 2.127 . . . . 0.0 112.997 -179.358 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . 0.413 ' CH2' ' CE3' ' A' ' 56' ' ' TRP . 0.0 OUTLIER -71.78 22.49 0.05 OUTLIER 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.968 -179.624 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.53 ' H ' ' C ' ' A' ' 43' ' ' PRO . 33.6 t80 40.03 61.63 6.16 Favored Pre-proline 0 C--N 1.326 -0.423 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.214 -179.091 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.468 ' HD3' ' N ' ' A' ' 45' ' ' PHE . 32.4 Cg_exo -60.39 -12.1 19.11 Favored 'Trans proline' 0 N--CA 1.496 1.657 0 C-N-CA 122.654 2.236 . . . . 0.0 112.257 -179.68 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 88.6 mt-30 -53.31 -53.96 43.32 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 120.534 -0.466 . . . . 0.0 110.45 -179.01 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.434 ' O ' ' H51' ' A' ' 201' ' ' MYR . 34.0 tp10 -88.93 -29.46 19.55 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.886 -0.413 . . . . 0.0 109.886 178.819 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . 0.5 ' HA3' ' H82' ' A' ' 201' ' ' MYR . . . 83.9 61.77 1.82 Allowed Glycine 0 CA--C 1.528 0.847 0 N-CA-C 110.01 -1.236 . . . . 0.0 110.01 -178.33 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 13.8 t -131.2 169.91 15.29 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-O 120.664 0.269 . . . . 0.0 110.524 -179.115 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.1 mt -87.02 132.14 33.21 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.314 0 C-N-CA 120.709 -0.397 . . . . 0.0 110.228 178.939 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -118.37 121.0 39.29 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.221 179.54 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 16.8 mm -91.74 -47.07 14.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.195 -179.578 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.449 ' HA ' ' HE ' ' A' ' 57' ' ' ARG . 88.3 tttt -64.11 -48.93 74.22 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-O 121.01 0.433 . . . . 0.0 111.152 -179.398 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 78.6 mmt-85 -64.7 -33.58 76.29 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.116 -179.745 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' TRP . . . . . 0.413 ' CE3' ' CH2' ' A' ' 44' ' ' TRP . 37.5 t-105 -59.81 -39.87 86.46 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-O 120.955 0.407 . . . . 0.0 110.269 -179.803 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.449 ' HE ' ' HA ' ' A' ' 54' ' ' LYS . 87.7 mtm180 -64.67 -38.34 90.67 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.453 -179.922 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 68.4 mmt-85 -60.59 -51.69 68.34 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.824 -0.35 . . . . 0.0 111.218 -179.643 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 3.5 p -66.16 -35.52 75.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.329 179.707 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -66.96 -45.03 87.07 Favored Glycine 0 CA--C 1.526 0.733 0 N-CA-C 111.246 -0.742 . . . . 0.0 111.246 179.867 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 99.8 m-20 -63.34 -43.84 96.57 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.718 0.294 . . . . 0.0 111.28 -179.577 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 74.8 m -64.14 -47.42 80.01 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.012 0.434 . . . . 0.0 110.557 -179.738 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 8.0 m-85 -66.4 -33.85 76.63 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.534 179.55 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 70.4 tp60 -57.69 -43.07 84.84 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.843 0.354 . . . . 0.0 110.295 -179.831 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -62.92 -52.8 61.65 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.922 0.391 . . . . 0.0 110.542 179.612 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' TYR . . . . . 0.413 ' O ' ' OG1' ' A' ' 69' ' ' THR . 38.7 m-85 -65.03 -25.23 67.75 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.476 179.399 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 61.5 t80 -65.5 -45.13 84.78 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.424 -179.912 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 88.6 m-20 -64.4 -39.45 93.87 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.592 -179.523 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.413 ' OG1' ' O ' ' A' ' 66' ' ' TYR . 82.2 p -49.77 -35.62 23.06 Favored 'General case' 0 C--N 1.324 -0.53 0 C-N-CA 120.578 -0.449 . . . . 0.0 111.159 -179.039 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 14.9 m-85 -67.36 -46.56 73.01 Favored 'General case' 0 C--N 1.321 -0.653 0 C-N-CA 119.888 -0.725 . . . . 0.0 111.056 -179.09 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . 0.509 ' H ' ' HD3' ' A' ' 72' ' ' PRO . . . 112.6 71.91 0.6 Allowed Glycine 0 N--CA 1.471 1.003 0 N-CA-C 110.952 -0.859 . . . . 0.0 110.952 -179.933 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . 0.509 ' HD3' ' H ' ' A' ' 71' ' ' GLY . 25.1 Cg_exo -62.02 143.69 95.36 Favored 'Trans proline' 0 N--CA 1.498 1.766 0 C-N-CA 123.247 2.631 . . . . 0.0 111.379 179.809 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 83.5 tt0 -74.93 -49.79 18.99 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-O 120.874 0.368 . . . . 0.0 110.544 -179.728 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.513 ' HD3' ' H ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -138.46 4.42 2.4 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.594 -179.547 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 63.8 t 57.42 92.97 0.06 OUTLIER Pre-proline 0 CA--C 1.534 0.331 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.068 -178.632 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_exo -54.15 125.71 19.71 Favored 'Trans proline' 0 N--CA 1.491 1.348 0 C-N-CA 121.722 1.615 . . . . 0.0 112.303 -178.982 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.456 ' O ' ' N ' ' A' ' 80' ' ' PHE . 43.6 t -84.67 -20.22 8.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.773 179.313 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 57.9 p -41.54 -27.49 0.1 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.585 -179.031 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . 0.409 ' N ' ' O ' ' A' ' 77' ' ' VAL . . . -62.39 -39.91 94.78 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.12 0.486 . . . . 0.0 110.64 179.839 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . 0.456 ' N ' ' O ' ' A' ' 77' ' ' VAL . 3.3 m-85 -62.19 -35.89 80.22 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.428 179.907 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 54.2 p -60.22 -40.04 88.74 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.244 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 13.7 m-85 -60.6 -53.4 57.95 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 120.696 -0.402 . . . . 0.0 110.707 179.816 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' TRP . . . . . . . . . . . . . 31.0 t90 -58.25 -38.68 77.4 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.738 179.806 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 82.3 m-20 -62.01 -45.7 92.43 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 120.684 -0.406 . . . . 0.0 110.957 -179.536 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 43.5 tp -71.45 -54.0 12.11 Favored 'General case' 0 C--O 1.218 -0.561 0 C-N-CA 120.439 -0.505 . . . . 0.0 110.466 179.606 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -57.23 -26.36 25.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-O 120.794 0.33 . . . . 0.0 110.61 179.622 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 66.4 tttt -65.59 -50.84 63.59 Favored 'General case' 0 C--N 1.32 -0.692 0 C-N-CA 120.32 -0.552 . . . . 0.0 110.107 -179.839 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . 0.438 ' OE1' ' O ' ' A' ' 88' ' ' GLU . 1.0 OUTLIER -80.38 -20.03 45.0 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.84 -179.815 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.419 HD12 ' HA ' ' A' ' 89' ' ' LEU . 14.1 tp -61.42 -44.42 97.17 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.47 -179.245 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 3.2 mt -63.52 -43.47 98.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 C-N-CA 120.25 -0.58 . . . . 0.0 109.841 -179.66 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 68.0 t0 -53.0 -43.46 66.49 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.751 -178.739 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 68.2 mmtt -62.5 134.91 57.07 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.954 0.406 . . . . 0.0 110.413 -179.779 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . 0.443 ' C ' ' H ' ' A' ' 95' ' ' VAL . 98.6 mttt -72.52 -9.87 59.09 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.539 -179.921 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 80.3 mm-40 -72.34 43.56 0.11 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.561 179.904 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.443 ' H ' ' C ' ' A' ' 93' ' ' LYS . 5.7 m -120.03 132.43 69.73 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.19 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.42 179.874 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' ASN . . . . . 0.432 HD22 ' HD2' ' A' ' 97' ' ' PRO . 0.7 OUTLIER -49.21 158.82 0.68 Allowed Pre-proline 0 C--N 1.327 -0.389 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.493 -179.628 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . 0.432 ' HD2' HD22 ' A' ' 96' ' ' ASN . 19.2 Cg_endo -60.55 -12.64 21.79 Favored 'Trans proline' 0 N--CA 1.495 1.59 0 C-N-CA 122.829 2.353 . . . . 0.0 112.061 179.543 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . 0.697 ' OE1' ' H71' ' A' ' 201' ' ' MYR . 8.6 pt20 -47.79 -31.49 4.95 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.785 -179.711 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 81.0 t -62.52 -48.59 87.52 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.928 -179.579 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 91.7 mmm -67.84 -40.38 83.72 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.854 -179.87 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -62.42 -25.31 67.88 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.69 -179.732 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -65.18 -15.8 62.83 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.189 179.798 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.445 ' O ' ' O ' ' A' ' 106' ' ' THR . 71.0 t -63.39 -20.25 25.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.132 179.534 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -49.93 -23.11 1.79 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.654 -179.859 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 69.1 tp60 -63.1 -39.62 95.23 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.411 -179.985 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . 0.445 ' O ' ' O ' ' A' ' 103' ' ' VAL . 75.2 p -130.78 152.35 50.23 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.905 0.383 . . . . 0.0 110.762 -179.999 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . 0.525 ' OE1' ' N ' ' A' ' 107' ' ' GLU . 44.3 mp0 -139.71 167.26 22.5 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.349 -179.752 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . 0.461 ' C ' ' N ' ' A' ' 110' ' ' LEU . 81.2 mm-40 -94.21 128.86 40.91 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.071 179.49 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 45.4 pt -47.23 -15.85 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.187 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.461 ' N ' ' C ' ' A' ' 108' ' ' GLU . 34.8 mt -64.01 -42.86 97.01 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.367 179.767 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -70.52 -32.33 69.75 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.542 179.692 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 14.2 t -58.91 -45.77 89.51 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.908 -178.973 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 32.0 t30 -66.37 -46.59 76.17 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.871 0.367 . . . . 0.0 110.858 179.801 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 31.2 p -162.28 158.81 24.78 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.61 179.785 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' GLN . . . . . 0.406 ' O ' ' O ' ' A' ' 118' ' ' LEU . 84.4 mt-30 -99.06 13.04 34.22 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.79 0.329 . . . . 0.0 110.382 179.769 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 14.8 m -59.23 -47.59 84.8 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.147 -179.751 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 99.4 m-20 -65.06 -43.75 91.22 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.568 179.543 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.406 ' O ' ' O ' ' A' ' 115' ' ' GLN . 94.5 mt -128.65 129.95 46.56 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.5 -179.939 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 99.3 mt-10 -118.7 137.22 53.48 Favored 'General case' 0 C--O 1.231 0.094 0 CA-C-N 116.632 -0.258 . . . . 0.0 110.354 179.925 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 79.4 m80 -124.42 139.73 53.62 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.43 -179.932 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 96.1 m-70 -125.49 153.76 43.09 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.471 -179.873 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 42.3 m170 -59.32 -42.88 92.44 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.537 -179.892 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 95.7 m-70 -101.92 130.59 48.46 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.546 179.998 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 124' ' ' HIS . . . . . . . . . . . . . 69.7 m80 -66.3 -39.08 89.1 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.501 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 85.1 t60 . . . . . 0 C--O 1.22 -0.46 0 CA-C-O 117.97 -1.014 . . . . 0.0 110.611 -179.896 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 201' ' ' MYR . . . . . 0.697 ' H71' ' OE1' ' A' ' 98' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.682 0 N-CA-C 111.033 -0.827 . . . . 0.0 111.033 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 87.6 mt-30 -61.78 -23.22 66.05 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.902 0.382 . . . . 0.0 110.315 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.409 ' HG2' ' H61' ' A' ' 201' ' ' MYR . 34.1 tp10 -51.92 -21.68 3.21 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.519 179.898 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.48 ' O ' ' OE1' ' A' ' 9' ' ' GLU . 33.6 tp -41.07 -39.59 1.27 Allowed 'General case' 0 C--O 1.235 0.312 0 CA-C-O 121.026 0.441 . . . . 0.0 110.284 -179.348 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 89.9 p -47.53 -36.76 10.9 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 120.758 -0.377 . . . . 0.0 110.244 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 72.3 tp60 -63.77 -32.46 73.97 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.467 179.608 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 53.9 t60 -59.24 -44.8 92.35 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 120.664 -0.414 . . . . 0.0 110.235 -179.932 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.48 ' OE1' ' O ' ' A' ' 5' ' ' LEU . 56.5 mp0 -61.73 -49.19 77.44 Favored 'General case' 0 C--O 1.244 0.77 0 C-N-CA 120.36 -0.536 . . . . 0.0 110.342 179.707 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.442 ' O ' ' CB ' ' A' ' 14' ' ' GLN . 75.3 mtm-85 -63.8 -31.73 73.0 Favored 'General case' 0 C--O 1.211 -0.968 0 C-N-CA 120.19 -0.604 . . . . 0.0 109.429 179.485 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.555 ' CE1' H142 ' A' ' 201' ' ' MYR . 31.5 t80 -59.86 -36.69 77.4 Favored 'General case' 0 C--N 1.323 -0.575 0 C-N-CA 120.889 -0.324 . . . . 0.0 110.315 -179.664 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 4.0 t -63.78 -49.34 82.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 C-N-CA 120.077 -0.649 . . . . 0.0 111.196 179.924 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -81.22 -34.28 32.3 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 120.438 -0.505 . . . . 0.0 111.874 -179.265 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . 0.442 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 70.5 tp60 -70.39 -52.98 18.51 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.049 -178.93 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.573 HD13 ' O ' ' A' ' 15' ' ' LEU . 0.2 OUTLIER -62.7 -47.01 85.49 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 109.988 -0.375 . . . . 0.0 109.988 -179.501 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.431 ' HB3' HG11 ' A' ' 26' ' ' VAL . 97.0 mttt -57.32 -32.73 66.99 Favored 'General case' 0 C--N 1.33 -0.257 0 C-N-CA 120.667 -0.413 . . . . 0.0 110.143 179.355 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 56.1 tt0 -71.05 -37.6 72.53 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.98 0.419 . . . . 0.0 110.467 179.304 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -58.14 -36.97 73.75 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.184 -179.858 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.4 mt -82.16 -27.04 32.91 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.01 0.433 . . . . 0.0 110.48 179.376 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -55.77 -37.73 68.93 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.072 -179.783 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.424 HG22 ' H ' ' A' ' 21' ' ' THR . 1.3 t -76.56 -20.82 56.44 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.633 179.817 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 61.0 mmt-85 -73.7 -3.31 27.52 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 120.769 0.318 . . . . 0.0 110.308 179.67 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 107.0 19.67 9.37 Favored Glycine 0 CA--C 1.526 0.747 0 N-CA-C 110.728 -0.949 . . . . 0.0 110.728 -179.601 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.613 HG12 ' N ' ' A' ' 25' ' ' LYS . 26.2 t -105.35 167.43 3.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 N-CA-C 110.327 -0.249 . . . . 0.0 110.327 -179.934 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.613 ' N ' HG12 ' A' ' 24' ' ' VAL . 99.6 mttt -125.86 131.99 52.28 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.348 179.359 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.431 HG11 ' HB3' ' A' ' 16' ' ' LYS . 1.7 m -134.79 108.94 11.09 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.289 0 CA-C-N 116.506 -0.315 . . . . 0.0 110.355 179.838 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.6 ' HD3' ' H ' ' A' ' 29' ' ' ALA . 14.5 tmtt? -109.25 161.72 14.97 Favored 'General case' 0 C--O 1.221 -0.398 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 179.976 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.478 ' CE2' HD21 ' A' ' 32' ' ' LEU . 58.0 t80 -40.58 -29.58 0.09 Allowed 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.095 0.474 . . . . 0.0 110.966 179.588 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.6 ' H ' ' HD3' ' A' ' 27' ' ' LYS . . . -60.65 -24.44 65.56 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.835 -179.797 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.84 -45.77 91.05 Favored 'General case' 0 C--O 1.221 -0.426 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.406 -179.335 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.494 ' H ' HD12 ' A' ' 31' ' ' LEU . 5.5 mp -64.77 -41.03 96.17 Favored 'General case' 0 C--O 1.216 -0.693 0 CA-C-O 120.989 0.423 . . . . 0.0 110.156 179.591 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.478 HD21 ' CE2' ' A' ' 28' ' ' TYR . 56.2 mt -55.34 -46.1 76.4 Favored 'General case' 0 C--N 1.316 -0.869 0 C-N-CA 119.453 -0.899 . . . . 0.0 111.118 -178.765 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 63.9 tttm -84.68 -50.45 7.63 Favored 'General case' 0 C--N 1.32 -0.676 0 C-N-CA 120.496 -0.482 . . . . 0.0 111.771 -179.25 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . 0.441 ' O ' HG22 ' A' ' 38' ' ' VAL . 74.9 t80 -61.16 -50.42 73.25 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.312 -178.786 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.485 ' CB ' ' O ' ' A' ' 31' ' ' LEU . 17.7 t80 -60.75 -46.12 91.66 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.29 -179.36 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 91.7 m-20 -70.17 -25.27 63.36 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 120.601 -0.44 . . . . 0.0 111.339 -179.541 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -65.03 -53.43 46.05 Favored 'General case' 0 N--CA 1.462 0.143 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.593 -179.074 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.505 ' O ' ' N ' ' A' ' 42' ' ' CYS . 2.6 m -72.86 -39.46 58.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 C-N-CA 120.481 -0.488 . . . . 0.0 111.037 -179.579 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 25.1 mmtt -57.93 -25.82 61.4 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.724 -179.528 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 85.3 m-20 -49.84 -63.6 1.06 Allowed 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 120.684 -0.406 . . . . 0.0 111.004 179.933 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.4 ' C ' ' SG ' ' A' ' 42' ' ' CYS . 1.6 p -114.59 -11.01 12.45 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.538 -0.301 . . . . 0.0 111.319 -179.939 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . 0.505 ' N ' ' O ' ' A' ' 38' ' ' VAL . 1.5 m 63.72 47.35 0.77 Allowed Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.697 -179.385 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.499 ' CD ' ' N ' ' A' ' 42' ' ' CYS . 57.9 Cg_endo -72.23 -30.45 13.03 Favored 'Trans proline' 0 N--CA 1.493 1.458 0 C-N-CA 122.699 2.266 . . . . 0.0 112.432 179.928 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . 0.69 ' CE2' H141 ' A' ' 201' ' ' MYR . 2.0 t-105 -58.32 -3.41 0.27 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.433 -179.643 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.494 ' H ' ' C ' ' A' ' 43' ' ' PRO . 2.9 t80 50.45 53.45 14.06 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.168 0.508 . . . . 0.0 110.16 -179.837 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.477 ' CD ' ' N ' ' A' ' 45' ' ' PHE . 38.3 Cg_endo -67.94 -12.35 35.01 Favored 'Trans proline' 0 C--N 1.308 -1.602 0 C-N-CA 122.835 2.357 . . . . 0.0 112.065 179.846 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 52.9 tt0 -59.11 -46.43 88.35 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.194 -179.688 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.515 ' O ' ' H42' ' A' ' 201' ' ' MYR . 44.9 tt0 -89.27 -18.03 27.82 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.029 0.443 . . . . 0.0 110.332 179.584 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . 0.789 ' O ' ' H71' ' A' ' 201' ' ' MYR . . . 77.11 66.56 1.79 Allowed Glycine 0 CA--C 1.525 0.696 0 N-CA-C 110.247 -1.141 . . . . 0.0 110.247 -178.921 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . 0.506 ' OG1' ' NE2' ' A' ' 98' ' ' GLN . 2.9 t -138.0 155.67 48.61 Favored 'General case' 0 C--N 1.33 -0.282 0 C-N-CA 121.043 -0.263 . . . . 0.0 110.658 -179.548 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.429 ' HA ' ' HE1' ' A' ' 44' ' ' TRP . 1.5 mt -87.7 140.6 15.54 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.2 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.305 179.3 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . 0.432 ' OD2' ' O ' ' A' ' 43' ' ' PRO . 69.8 m-20 -111.14 120.12 41.25 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.191 179.631 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.511 ' CG1' HD12 ' A' ' 90' ' ' ILE . 24.9 mm -94.78 -56.07 5.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.893 179.215 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -78.0 -49.41 14.12 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.561 -179.464 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.569 ' CG ' HH21 ' A' ' 58' ' ' ARG . 83.8 mtt85 -59.95 -32.59 70.95 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.132 -0.486 . . . . 0.0 109.958 -179.708 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' TRP . . . . . 0.748 ' HE1' ' HE1' ' A' ' 83' ' ' TRP . 18.2 t-105 -62.89 -39.9 95.91 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.52 179.359 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 83.6 mtp180 -63.48 -35.24 79.8 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.444 -179.794 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . 0.569 HH21 ' CG ' ' A' ' 55' ' ' ARG . 43.6 mtm-85 -60.16 -50.92 71.77 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 120.509 -0.476 . . . . 0.0 111.006 -179.96 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.405 HG13 ' N ' ' A' ' 60' ' ' GLY . 7.4 p -73.96 -39.48 51.39 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.377 0 C-N-CA 120.861 -0.335 . . . . 0.0 110.644 179.581 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . 0.433 ' O ' ' CB ' ' A' ' 64' ' ' GLN . . . -63.07 -49.21 73.67 Favored Glycine 0 C--O 1.222 -0.634 0 N-CA-C 111.353 -0.699 . . . . 0.0 111.353 -179.225 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 66.2 t0 -61.82 -44.87 95.99 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 120.625 0.25 . . . . 0.0 111.156 -179.497 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' CYS . . . . . 0.436 ' SG ' ' O ' ' A' ' 58' ' ' ARG . 73.3 m -62.9 -55.83 22.57 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.207 -179.227 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 12.6 m-85 -64.22 -43.23 95.63 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.1 -179.821 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . 0.433 ' CB ' ' O ' ' A' ' 60' ' ' GLY . 61.3 tt0 -62.37 -39.82 94.43 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.651 -179.45 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -57.01 -54.07 50.93 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 120.765 -0.374 . . . . 0.0 110.849 -179.865 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 66.4 m-85 -67.86 -39.77 83.72 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.706 179.764 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.523 ' O ' ' N ' ' A' ' 71' ' ' GLY . 57.1 t80 -58.75 -41.88 87.52 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.427 -179.501 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . 0.409 ' CG ' ' O ' ' A' ' 64' ' ' GLN . 4.4 m120 -62.79 -45.29 93.35 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.331 -178.964 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 24.6 p -74.98 -20.12 59.8 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 120.608 -0.437 . . . . 0.0 109.985 -179.433 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 47.6 m-85 -114.11 16.28 18.14 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.401 179.945 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . 0.523 ' N ' ' O ' ' A' ' 67' ' ' TYR . . . -154.18 -111.03 0.41 Allowed Glycine 0 CA--C 1.534 1.239 0 N-CA-C 111.06 -0.816 . . . . 0.0 111.06 -179.984 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -73.06 140.1 30.78 Favored 'Trans proline' 0 N--CA 1.494 1.548 0 C-N-CA 121.989 1.793 . . . . 0.0 113.177 -179.34 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 80.7 mm-40 -86.28 -42.84 13.41 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.487 179.326 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.694 ' CD ' ' H ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -80.78 -24.63 38.48 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.027 179.933 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.498 ' H ' ' HD3' ' A' ' 74' ' ' LYS . 75.2 t 53.91 101.04 0.03 OUTLIER Pre-proline 0 N--CA 1.449 -0.481 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.189 -179.719 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 44.5 Cg_exo -55.05 129.28 34.44 Favored 'Trans proline' 0 N--CA 1.492 1.413 0 C-N-CA 121.666 1.578 . . . . 0.0 111.758 179.845 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.504 ' O ' HG12 ' A' ' 77' ' ' VAL . 48.3 t -82.31 -6.81 10.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.835 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 43.2 p -44.26 -23.23 0.09 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.64 -179.817 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . 0.407 ' N ' ' C ' ' A' ' 77' ' ' VAL . . . -57.62 -28.91 64.09 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.079 0.466 . . . . 0.0 110.431 179.73 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 48.8 t80 -61.19 -39.63 90.9 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.153 179.529 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 66.9 m -56.14 -40.14 73.36 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.391 -179.9 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 14.2 m-85 -60.99 -48.94 79.49 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 120.737 -0.385 . . . . 0.0 110.792 179.65 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' TRP . . . . . 0.748 ' HE1' ' HE1' ' A' ' 56' ' ' TRP . 40.5 m0 -57.72 -36.11 71.58 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.57 -179.652 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 78.7 m-20 -62.77 -47.47 83.37 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 120.388 -0.525 . . . . 0.0 110.899 -179.863 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 36.7 tp -71.25 -52.47 18.84 Favored 'General case' 0 C--O 1.219 -0.524 0 C-N-CA 120.333 -0.547 . . . . 0.0 110.588 179.611 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -58.42 -26.68 31.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 C-N-CA 120.804 -0.358 . . . . 0.0 110.552 -179.889 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.405 ' CB ' ' O ' ' A' ' 83' ' ' TRP . 63.4 tttt -65.97 -49.65 67.12 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.634 179.884 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.1 pp20? -80.07 -20.72 44.53 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.007 -179.665 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.538 ' O ' HD13 ' A' ' 89' ' ' LEU . 0.2 OUTLIER -61.49 -47.12 87.11 Favored 'General case' 0 N--CA 1.443 -0.793 0 C-N-CA 120.172 -0.611 . . . . 0.0 110.322 -179.111 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.511 HD12 ' CG1' ' A' ' 53' ' ' ILE . 3.4 mt -64.4 -44.4 97.11 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.156 0 C-N-CA 120.174 -0.611 . . . . 0.0 109.775 -179.815 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . 0.458 ' O ' ' OD1' ' A' ' 91' ' ' ASP . 64.6 t0 -62.19 -37.22 84.46 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.063 -179.16 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . 0.639 ' O ' HG23 ' A' ' 95' ' ' VAL . 26.6 tttm -42.12 145.57 0.36 Allowed 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.929 0.395 . . . . 0.0 110.363 -179.58 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 57.5 mttp -79.43 -17.09 55.01 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.669 -179.637 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 71.1 mm-40 -109.64 53.14 0.7 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.642 -179.777 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.639 HG23 ' O ' ' A' ' 92' ' ' LYS . 44.9 t -73.09 148.08 9.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-O 120.911 0.386 . . . . 0.0 110.431 179.696 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' ASN . . . . . 0.614 ' O ' ' N ' ' A' ' 98' ' ' GLN . 0.0 OUTLIER -41.91 166.81 0.07 OUTLIER Pre-proline 0 C--N 1.327 -0.402 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.291 179.971 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_exo -39.59 -13.16 0.02 OUTLIER 'Trans proline' 0 N--CA 1.493 1.471 0 C-N-CA 123.079 2.52 . . . . 0.0 112.713 178.868 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . 0.614 ' N ' ' O ' ' A' ' 96' ' ' ASN . 8.8 tt0 -45.4 -31.65 1.77 Allowed 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.101 179.197 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 50.1 t -61.82 -56.43 17.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 C-N-CA 120.333 -0.547 . . . . 0.0 110.503 -178.909 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 88.9 mtp -72.15 -41.37 67.18 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.247 179.564 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -63.36 -28.4 69.97 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.769 -179.192 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . 0.438 ' HB2' ' O ' ' A' ' 98' ' ' GLN . . . -65.63 -15.52 62.84 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.507 -179.978 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 76.7 t -60.01 -18.64 16.07 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.487 179.83 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -61.81 -25.98 67.83 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.678 179.982 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 98.6 mm-40 -49.71 103.06 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.938 0.399 . . . . 0.0 110.532 179.998 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 11.0 m -61.66 -43.22 99.26 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.329 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 94.4 mt-10 -117.54 141.33 48.49 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.498 -179.794 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . 0.551 ' C ' ' H ' ' A' ' 110' ' ' LEU . 95.2 mt-10 -66.45 133.12 49.78 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 120.644 -0.423 . . . . 0.0 110.132 179.325 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 42.2 pt -55.39 -2.14 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.19 179.466 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.551 ' H ' ' C ' ' A' ' 108' ' ' GLU . 95.6 mt -96.45 5.96 49.75 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-O 120.806 0.336 . . . . 0.0 110.463 -179.762 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -114.45 129.68 56.67 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.385 179.904 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 30.2 p -136.86 -119.94 0.15 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.273 179.884 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' ASN . . . . . 0.416 ' C ' ' OD1' ' A' ' 113' ' ' ASN . 43.4 t-20 -64.39 -41.39 96.7 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.371 179.8 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 68.6 m -134.27 154.8 51.08 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.61 -179.848 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' GLN . . . . . 0.446 ' O ' ' O ' ' A' ' 118' ' ' LEU . 87.4 mt-30 -87.08 85.42 7.23 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.391 179.9 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 7.3 m -63.58 -45.26 91.23 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.63 -179.771 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 72.7 m-20 -61.53 -45.12 95.52 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.763 -179.397 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.446 ' O ' ' O ' ' A' ' 115' ' ' GLN . 91.1 mt -116.49 123.91 48.64 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.435 179.877 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 88.9 mt-10 -110.45 124.01 50.96 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-O 120.655 0.264 . . . . 0.0 110.425 179.954 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 41.7 m80 -115.75 147.45 40.92 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.465 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 96.9 m-70 -111.43 143.93 41.46 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.455 -179.824 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 67.2 m80 -66.12 -40.6 90.81 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.631 -179.929 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 32.7 m170 -122.22 135.28 54.74 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.54 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 124' ' ' HIS . . . . . . . . . . . . . 44.7 t60 -60.67 -45.36 94.41 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.552 -179.881 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 60.5 t-80 . . . . . 0 C--O 1.22 -0.453 0 CA-C-O 117.967 -1.016 . . . . 0.0 110.573 179.948 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 201' ' ' MYR . . . . . 0.789 ' H71' ' O ' ' A' ' 49' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . 0.526 ' O ' ' N ' ' A' ' 6' ' ' SER . . . . . . . . 0 CA--C 1.523 0.592 0 N-CA-C 110.464 -1.054 . . . . 0.0 110.464 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 20.6 pt20 -43.09 -24.94 0.09 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.847 0.356 . . . . 0.0 110.658 -179.679 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.415 ' N ' ' O ' ' A' ' 2' ' ' GLY . 98.0 mt-10 -73.8 -64.69 0.95 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.69 -179.862 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.734 HD12 ' N ' ' A' ' 6' ' ' SER . 4.0 pp -83.83 -41.07 17.9 Favored 'General case' 0 C--O 1.223 -0.32 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.246 -179.944 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.734 ' N ' HD12 ' A' ' 5' ' ' LEU . 16.5 m -49.95 -45.91 51.77 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 120.823 -0.351 . . . . 0.0 110.695 -178.7 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . 0.434 ' HA ' ' H82' ' A' ' 201' ' ' MYR . 84.8 mt-30 -62.14 -29.18 70.16 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 120.751 -0.38 . . . . 0.0 110.536 179.483 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . 0.489 ' O ' HG23 ' A' ' 12' ' ' VAL . 33.3 m170 -80.15 -53.41 6.71 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.807 0.336 . . . . 0.0 111.616 -179.408 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 80.4 mm-40 -65.78 -43.7 87.98 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.282 -179.096 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.536 ' O ' ' N ' ' A' ' 14' ' ' GLN . 96.1 mtt-85 -68.98 -55.24 11.52 Favored 'General case' 0 C--O 1.216 -0.668 0 C-N-CA 120.531 -0.468 . . . . 0.0 110.582 -179.369 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.434 ' CD1' H143 ' A' ' 201' ' ' MYR . 46.3 t80 -46.68 -38.7 10.18 Favored 'General case' 0 C--N 1.319 -0.759 0 C-N-CA 119.793 -0.763 . . . . 0.0 110.903 -179.215 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.489 HG23 ' O ' ' A' ' 8' ' ' HIS . 73.9 t -71.41 -60.15 2.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 N-CA-C 112.337 0.495 . . . . 0.0 112.337 -179.389 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.477 ' O ' ' CB ' ' A' ' 17' ' ' GLN . 95.3 mt-10 -80.16 -47.68 14.34 Favored 'General case' 0 C--O 1.213 -0.861 0 C-N-CA 120.804 -0.359 . . . . 0.0 111.431 -178.77 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . 0.536 ' N ' ' O ' ' A' ' 10' ' ' ARG . 51.5 tp60 -50.9 -44.16 59.94 Favored 'General case' 0 C--N 1.317 -0.83 0 C-N-CA 120.794 -0.363 . . . . 0.0 110.577 -179.192 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.5 HD13 ' O ' ' A' ' 15' ' ' LEU . 0.2 OUTLIER -78.01 -59.15 2.9 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 120.123 -0.631 . . . . 0.0 111.896 -179.041 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.667 ' HB3' HG11 ' A' ' 26' ' ' VAL . 98.5 mttt -56.8 -35.49 68.8 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.882 -178.54 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . 0.477 ' CB ' ' O ' ' A' ' 13' ' ' GLU . 60.3 tt0 -71.61 -40.24 69.95 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.499 179.885 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -55.64 -32.8 63.48 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 -179.783 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.444 HD13 ' CZ ' ' A' ' 82' ' ' TYR . 3.5 mt -86.09 -31.81 21.7 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.151 179.132 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -51.62 -43.97 62.73 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.933 -178.696 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.462 HG22 ' H ' ' A' ' 21' ' ' THR . 0.2 OUTLIER -64.96 -30.45 71.44 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.577 179.91 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 78.5 mmt-85 -67.7 -7.56 28.01 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.318 -179.772 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 107.17 19.52 9.4 Favored Glycine 0 CA--C 1.525 0.683 0 N-CA-C 111.121 -0.792 . . . . 0.0 111.121 179.696 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.63 HG12 ' N ' ' A' ' 25' ' ' LYS . 38.8 t -101.82 167.95 2.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 N-CA-C 110.212 -0.292 . . . . 0.0 110.212 179.897 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.63 ' N ' HG12 ' A' ' 24' ' ' VAL . 99.0 mttt -132.74 144.63 50.41 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.399 179.57 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.667 HG11 ' HB3' ' A' ' 16' ' ' LYS . 30.0 m -132.12 130.55 60.93 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.354 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.699 179.91 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 14.3 pttp -109.81 163.78 13.2 Favored 'General case' 0 C--O 1.228 -0.056 0 CA-C-O 120.741 0.305 . . . . 0.0 110.499 179.66 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 93.6 m-85 -49.77 -32.13 13.14 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.959 0.409 . . . . 0.0 110.519 179.999 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -55.12 -24.35 25.6 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.39 179.84 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.46 ' O ' ' CB ' ' A' ' 34' ' ' PHE . 99.0 m-20 -64.44 -46.1 84.62 Favored 'General case' 0 C--O 1.22 -0.492 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.808 -179.987 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.478 ' O ' ' CB ' ' A' ' 35' ' ' PHE . 5.3 mp -63.53 -40.42 96.99 Favored 'General case' 0 C--N 1.315 -0.902 0 C-N-CA 120.23 -0.588 . . . . 0.0 110.407 -179.747 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 30.8 mt -58.8 -49.78 76.39 Favored 'General case' 0 C--N 1.313 -0.98 0 C-N-CA 119.634 -0.826 . . . . 0.0 111.549 -178.179 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -87.75 -51.19 6.0 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 112.591 0.589 . . . . 0.0 112.591 -178.58 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . 0.682 ' O ' HG22 ' A' ' 38' ' ' VAL . 9.7 t80 -59.68 -50.25 74.56 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.805 -178.344 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.478 ' CB ' ' O ' ' A' ' 31' ' ' LEU . 10.0 t80 -63.47 -47.91 79.82 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.499 -0.48 . . . . 0.0 110.666 -179.966 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 55.1 t0 -67.69 -29.19 68.39 Favored 'General case' 0 N--CA 1.456 -0.145 0 C-N-CA 120.426 -0.51 . . . . 0.0 111.176 -179.418 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.572 ' CZ ' HG22 ' A' ' 59' ' ' VAL . 9.9 t80 -66.34 -51.53 56.25 Favored 'General case' 0 C--N 1.332 -0.173 0 C-N-CA 120.642 -0.423 . . . . 0.0 111.611 -178.255 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.682 HG22 ' O ' ' A' ' 34' ' ' PHE . 9.1 m -76.47 -39.14 33.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.95 -179.708 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -62.74 -26.78 68.86 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.596 -179.555 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 40.5 t0 -52.97 -52.95 56.43 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.856 -179.299 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 12.0 p -114.07 -6.65 13.1 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.143 179.947 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . 0.522 ' N ' ' O ' ' A' ' 38' ' ' VAL . 3.3 m 43.44 56.52 12.22 Favored Pre-proline 0 CA--C 1.532 0.267 0 CA-C-O 120.885 0.374 . . . . 0.0 110.28 -178.967 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.539 ' C ' ' H ' ' A' ' 45' ' ' PHE . 61.2 Cg_endo -79.34 -15.19 12.76 Favored 'Trans proline' 0 C--N 1.313 -1.304 0 C-N-CA 122.378 2.052 . . . . 0.0 112.428 -179.795 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . 0.894 ' NE1' H141 ' A' ' 201' ' ' MYR . 0.0 OUTLIER -69.71 22.06 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.474 -179.238 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.539 ' H ' ' C ' ' A' ' 43' ' ' PRO . 18.1 t80 36.25 68.86 1.33 Allowed Pre-proline 0 C--O 1.233 0.191 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.343 179.981 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.433 ' O ' ' OE1' ' A' ' 7' ' ' GLN . 48.9 Cg_endo -75.18 -0.45 10.04 Favored 'Trans proline' 0 C--N 1.305 -1.751 0 C-N-CA 122.69 2.26 . . . . 0.0 112.189 -179.252 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 86.9 mt-30 -60.31 -52.83 63.6 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 120.604 -0.438 . . . . 0.0 110.538 -179.797 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 58.9 tt0 -89.23 -14.49 35.83 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.778 0.323 . . . . 0.0 110.448 179.717 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . 0.471 ' O ' ' CB ' ' A' ' 98' ' ' GLN . . . 72.94 58.02 5.0 Favored Glycine 0 CA--C 1.524 0.63 0 N-CA-C 110.336 -1.106 . . . . 0.0 110.336 -178.929 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 2.6 t -132.54 169.2 16.94 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.886 0.374 . . . . 0.0 110.79 -179.331 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.478 ' CD1' HD23 ' A' ' 89' ' ' LEU . 1.4 mt -85.02 142.17 13.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.434 179.345 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 80.0 m-20 -111.25 121.54 45.53 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.648 -0.705 . . . . 0.0 111.246 179.468 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.459 ' CG1' HD12 ' A' ' 90' ' ' ILE . 31.1 mm -94.11 -55.0 6.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.28 179.231 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -71.96 -55.23 7.83 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-O 120.873 0.368 . . . . 0.0 111.796 -178.708 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 86.5 mtm-85 -57.51 -30.49 65.18 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.178 -0.465 . . . . 0.0 109.999 -179.607 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' TRP . . . . . 0.503 ' CE3' ' CZ3' ' A' ' 44' ' ' TRP . 12.5 t-105 -62.73 -41.36 99.13 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.727 178.856 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 96.5 mtt-85 -63.24 -33.57 75.77 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.453 -179.835 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . 0.489 ' O ' ' SG ' ' A' ' 62' ' ' CYS . 96.7 mtt180 -63.14 -51.77 65.15 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.552 -0.459 . . . . 0.0 111.285 -179.384 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.572 HG22 ' CZ ' ' A' ' 37' ' ' PHE . 3.3 p -66.24 -35.52 75.17 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.333 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.678 179.84 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -73.22 -48.87 17.74 Favored Glycine 0 CA--C 1.528 0.861 0 C-N-CA 120.911 -0.662 . . . . 0.0 111.778 -179.674 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 95.8 m-20 -62.92 -44.51 95.88 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.669 0.271 . . . . 0.0 111.473 -179.074 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' CYS . . . . . 0.489 ' SG ' ' O ' ' A' ' 58' ' ' ARG . 74.6 m -60.73 -58.93 6.36 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.877 0.37 . . . . 0.0 110.877 -179.356 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 24.7 m-85 -61.64 -41.0 96.88 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.81 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 53.9 tt0 -60.59 -39.29 87.56 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.5 -0.318 . . . . 0.0 111.055 -179.873 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.472 ' O ' ' OD1' ' A' ' 68' ' ' ASN . 20.2 t0 -58.25 -52.1 67.01 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 120.943 0.402 . . . . 0.0 110.68 -179.704 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 83.6 m-85 -73.18 -41.14 64.18 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 120.473 -0.491 . . . . 0.0 111.309 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 62.6 t80 -57.55 -47.39 82.16 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.803 -178.78 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . 0.472 ' OD1' ' O ' ' A' ' 65' ' ' ASP . 0.2 OUTLIER -62.8 -41.65 99.37 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.676 -179.853 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.468 ' N ' ' ND2' ' A' ' 68' ' ' ASN . 40.8 p -66.43 -17.97 65.09 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.268 179.972 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 7.9 m-85 -98.8 14.87 27.28 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.547 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 166.22 -87.71 0.1 OUTLIER Glycine 0 CA--C 1.535 1.328 0 C-N-CA 120.764 -0.731 . . . . 0.0 111.734 179.53 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . 0.423 ' O ' ' O ' ' A' ' 68' ' ' ASN . 33.7 Cg_exo -51.13 126.59 19.38 Favored 'Trans proline' 0 N--CA 1.496 1.624 0 C-N-CA 121.866 1.711 . . . . 0.0 112.592 179.938 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.521 ' N ' ' OE1' ' A' ' 73' ' ' GLU . 58.4 mp0 -86.82 -43.93 12.11 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.905 -0.588 . . . . 0.0 110.506 179.286 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.628 ' CD ' ' H ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -104.26 -7.57 19.95 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.108 -179.695 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.419 ' N ' ' HD3' ' A' ' 74' ' ' LYS . 30.2 t 59.41 133.38 0.03 OUTLIER Pre-proline 0 N--CA 1.448 -0.551 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.718 -178.978 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -53.43 129.21 32.58 Favored 'Trans proline' 0 N--CA 1.493 1.459 0 C-N-CA 121.535 1.49 . . . . 0.0 111.238 178.043 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.425 ' O ' ' N ' ' A' ' 80' ' ' PHE . 59.6 t -80.85 -16.54 12.47 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.687 179.891 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 65.7 p -45.94 -22.82 0.23 Allowed 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.945 0.402 . . . . 0.0 110.072 -179.931 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -67.6 -34.8 77.74 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.68 179.403 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . 0.425 ' N ' ' O ' ' A' ' 77' ' ' VAL . 10.2 m-85 -57.74 -35.38 70.63 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.33 -179.633 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 94.9 p -60.36 -40.29 90.22 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.355 179.87 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' TYR . . . . . 0.444 ' CZ ' HD13 ' A' ' 19' ' ' LEU . 13.8 m-85 -60.17 -49.39 77.81 Favored 'General case' 0 C--O 1.223 -0.29 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.797 179.81 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' TRP . . . . . 0.519 ' N ' ' CD1' ' A' ' 83' ' ' TRP . 9.6 m0 -59.12 -40.39 85.24 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.311 179.956 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 78.0 m-20 -62.68 -43.23 99.33 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 120.691 -0.404 . . . . 0.0 110.572 -179.923 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -70.25 -55.43 9.29 Favored 'General case' 0 C--O 1.221 -0.416 0 N-CA-C 110.215 -0.291 . . . . 0.0 110.215 179.409 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -60.88 -25.52 35.95 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.884 0 C-N-CA 120.959 -0.296 . . . . 0.0 110.717 -179.66 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.426 ' CB ' ' O ' ' A' ' 83' ' ' TRP . 42.2 tttp -65.26 -50.16 66.83 Favored 'General case' 0 C--N 1.317 -0.807 0 C-N-CA 120.467 -0.493 . . . . 0.0 110.555 179.716 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.1 pp20? -80.34 -19.69 45.91 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.679 -179.891 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.478 HD23 ' CD1' ' A' ' 51' ' ' ILE . 14.5 tp -61.5 -45.02 96.0 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.354 -179.015 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.459 HD12 ' CG1' ' A' ' 53' ' ' ILE . 3.6 mt -65.04 -43.86 95.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 C-N-CA 120.293 -0.563 . . . . 0.0 109.956 -179.778 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 94.1 m-20 -65.16 -8.02 15.15 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.841 -178.938 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 84.7 tttt -66.9 146.13 54.73 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.42 179.91 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -61.7 -41.64 97.87 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.661 -179.843 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . 0.46 ' O ' ' C ' ' A' ' 95' ' ' VAL . 97.9 mt-10 -77.66 6.94 6.34 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.828 -179.82 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.46 ' C ' ' O ' ' A' ' 94' ' ' GLU . 2.7 m 30.72 -110.62 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.283 0 O-C-N 123.692 0.62 . . . . 0.0 110.707 -179.806 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' ASN . . . . . 0.531 ' O ' ' N ' ' A' ' 98' ' ' GLN . 1.3 m120 -153.32 160.86 30.43 Favored Pre-proline 0 N--CA 1.45 -0.438 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.568 179.356 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . 0.482 ' O ' ' N ' ' A' ' 99' ' ' VAL . 53.7 Cg_exo -44.5 -12.23 0.05 OUTLIER 'Trans proline' 0 C--N 1.31 -1.473 0 C-N-CA 122.689 2.259 . . . . 0.0 112.146 178.974 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . 0.531 ' N ' ' O ' ' A' ' 96' ' ' ASN . 6.0 pt20 -46.27 -15.39 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.896 -179.861 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . 0.482 ' N ' ' O ' ' A' ' 97' ' ' PRO . 74.9 t -60.83 -49.37 84.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 C-N-CA 120.834 -0.347 . . . . 0.0 111.017 -179.442 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 97.9 mmm -73.01 -43.15 62.48 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.922 0.391 . . . . 0.0 111.056 -179.748 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . 0.728 ' HB2' ' H51' ' A' ' 201' ' ' MYR . . . -63.95 -21.65 66.58 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.482 -179.737 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -55.99 -15.32 3.34 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.656 -179.906 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 51.6 t -63.63 -21.26 28.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.414 179.516 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -55.69 -46.69 77.58 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.611 -179.864 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 88.0 mt-30 -86.04 110.41 19.49 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.317 -0.402 . . . . 0.0 110.576 179.899 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 24.1 p -66.98 -31.95 72.86 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.623 179.912 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 85.4 mt-10 -56.99 142.52 41.62 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.385 -179.587 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . 0.555 ' C ' ' H ' ' A' ' 110' ' ' LEU . 92.2 mt-10 -65.4 136.25 56.26 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.768 -0.373 . . . . 0.0 110.201 179.626 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 45.3 pt -61.14 4.14 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.364 179.622 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.555 ' H ' ' C ' ' A' ' 108' ' ' GLU . 96.4 mt -101.73 -5.98 24.26 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.892 0.377 . . . . 0.0 110.538 -179.735 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 63.2 tttm -102.37 128.77 48.81 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.683 -179.969 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . 0.532 ' OG ' ' N ' ' A' ' 113' ' ' ASN . 3.1 p -87.57 -147.13 0.14 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.463 -179.875 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' ASN . . . . . 0.532 ' N ' ' OG ' ' A' ' 112' ' ' SER . 90.5 m-20 -62.09 -42.32 99.09 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.385 -179.442 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 92.9 p -153.86 -5.74 0.17 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.582 179.941 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 94.9 mm-40 -70.82 150.3 45.96 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.422 -179.695 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 73.1 p -72.8 169.73 16.14 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.405 -179.873 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 88.8 m-20 -62.62 -17.44 60.29 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.47 -179.69 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 82.2 mt -63.47 -40.66 97.69 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.403 179.503 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 55.49 78.57 0.18 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.539 -179.921 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 58.1 t-80 -61.66 -44.92 96.05 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.558 -179.752 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 78.7 m80 -99.5 123.53 43.85 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.38 179.973 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 58.0 t-80 -60.51 -42.46 96.45 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.591 -179.909 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 98.5 m-70 -109.02 143.38 38.4 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.456 -179.945 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 124' ' ' HIS . . . . . . . . . . . . . 76.2 m80 -61.07 -42.52 98.65 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.458 -179.78 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 79.3 m80 . . . . . 0 C--O 1.22 -0.478 0 CA-C-O 117.99 -1.005 . . . . 0.0 110.581 -179.959 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 201' ' ' MYR . . . . . 0.894 H141 ' NE1' ' A' ' 44' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.752 0 N-CA-C 110.984 -0.846 . . . . 0.0 110.984 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 88.1 mt-30 -64.24 -38.97 92.95 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.779 0.323 . . . . 0.0 110.733 179.997 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.774 ' OE1' ' HB2' ' A' ' 101' ' ' ALA . 90.4 mt-10 -47.96 -22.95 0.66 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.509 -179.969 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 51.8 tp -41.97 -34.57 0.71 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.26 -179.55 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 42.6 m -55.09 -42.05 72.34 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.077 0.465 . . . . 0.0 110.327 -179.899 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . 0.412 ' N ' ' O ' ' A' ' 4' ' ' GLU . 95.2 mt-30 -61.1 -30.8 70.57 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.883 -0.598 . . . . 0.0 110.689 179.614 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 59.4 t-80 -62.1 -41.72 98.5 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.023 0.439 . . . . 0.0 110.117 179.72 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 80.1 mm-40 -60.27 -46.65 89.07 Favored 'General case' 0 C--O 1.245 0.819 0 CA-C-O 121.562 0.696 . . . . 0.0 110.026 179.937 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.41 ' O ' ' CB ' ' A' ' 14' ' ' GLN . 24.5 mtm180 -63.48 -29.02 70.37 Favored 'General case' 0 C--O 1.217 -0.608 0 C-N-CA 120.241 -0.583 . . . . 0.0 109.799 179.506 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 37.8 t80 -62.86 -36.71 84.16 Favored 'General case' 0 C--N 1.328 -0.327 0 O-C-N 123.562 0.539 . . . . 0.0 109.888 179.902 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 3.7 t -62.66 -48.32 88.71 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 C-N-CA 119.837 -0.745 . . . . 0.0 110.834 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 79.8 mm-40 -80.87 -38.9 27.31 Favored 'General case' 0 C--N 1.322 -0.595 0 C-N-CA 119.935 -0.706 . . . . 0.0 111.767 -179.173 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . 0.41 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 63.9 tp60 -65.38 -53.05 48.92 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.538 -0.755 . . . . 0.0 110.865 -179.171 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.577 HD13 ' O ' ' A' ' 15' ' ' LEU . 0.3 OUTLIER -63.12 -45.86 90.02 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.453 -0.499 . . . . 0.0 109.917 -179.126 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 53.8 mttp -54.82 -32.5 60.48 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 120.204 -0.599 . . . . 0.0 110.503 179.79 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 59.9 tt0 -67.16 -41.32 86.19 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.556 179.994 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -57.58 -30.35 65.2 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.617 -0.72 . . . . 0.0 109.763 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.2 mt -86.44 -28.82 23.28 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.253 0.549 . . . . 0.0 110.651 178.848 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -51.12 -43.02 61.06 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.779 -178.784 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.73 -28.87 69.89 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.55 179.762 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 82.8 mmt-85 -71.01 -6.34 38.21 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.353 -179.831 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 108.04 20.12 8.57 Favored Glycine 0 CA--C 1.524 0.65 0 N-CA-C 111.16 -0.776 . . . . 0.0 111.16 179.93 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.609 HG12 ' N ' ' A' ' 25' ' ' LYS . 18.3 t -102.29 169.38 1.88 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 N-CA-C 110.345 -0.243 . . . . 0.0 110.345 179.857 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.609 ' N ' HG12 ' A' ' 24' ' ' VAL . 99.4 mttt -115.43 146.69 41.38 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.368 179.803 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.474 ' O ' HG23 ' A' ' 26' ' ' VAL . 2.3 m -115.31 23.4 5.34 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.272 0 CA-C-O 120.996 0.427 . . . . 0.0 110.662 -179.584 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.517 ' N ' ' OD2' ' A' ' 30' ' ' ASP . 33.5 pttt -51.97 163.58 0.34 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.219 -179.712 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 75.8 m-85 -58.15 -35.83 72.12 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.819 -0.352 . . . . 0.0 110.654 -179.727 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.42 ' HB3' ' HD2' ' A' ' 27' ' ' LYS . . . -53.84 -23.8 13.6 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.691 -179.953 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.517 ' OD2' ' N ' ' A' ' 27' ' ' LYS . 59.3 m-20 -63.5 -46.68 84.97 Favored 'General case' 0 C--O 1.223 -0.335 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.685 -179.509 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.502 ' H ' HD12 ' A' ' 31' ' ' LEU . 5.4 mp -67.28 -41.09 86.03 Favored 'General case' 0 C--O 1.221 -0.446 0 CA-C-O 121.251 0.548 . . . . 0.0 110.487 179.575 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.411 HD12 ' HA ' ' A' ' 29' ' ' ALA . 55.7 mt -56.73 -44.84 82.06 Favored 'General case' 0 C--N 1.314 -0.948 0 C-N-CA 119.546 -0.862 . . . . 0.0 111.057 -178.927 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 86.5 tttt -86.09 -49.38 7.82 Favored 'General case' 0 C--N 1.32 -0.714 0 C-N-CA 120.475 -0.49 . . . . 0.0 111.421 -178.922 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 58.0 t80 -61.93 -49.88 74.36 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.237 -178.687 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.482 ' CB ' ' O ' ' A' ' 31' ' ' LEU . 7.9 t80 -62.96 -46.9 85.57 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.189 -179.827 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 94.4 m-20 -65.31 -34.32 78.07 Favored 'General case' 0 C--N 1.347 0.477 0 CA-C-O 120.721 0.296 . . . . 0.0 111.167 -179.432 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.458 ' CE2' ' CD2' ' A' ' 63' ' ' PHE . 1.9 m-85 -60.53 -47.85 84.35 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.919 0.39 . . . . 0.0 111.111 -179.053 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.529 ' O ' ' N ' ' A' ' 42' ' ' CYS . 27.8 m -77.82 -40.2 26.98 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.592 -179.704 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.43 ' N ' HG23 ' A' ' 38' ' ' VAL . 88.2 tttt -56.59 -26.93 56.78 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.635 -179.847 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 93.2 m-20 -54.4 -62.38 1.69 Allowed 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 120.748 -0.381 . . . . 0.0 111.292 -179.043 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.478 ' O ' ' SG ' ' A' ' 42' ' ' CYS . 45.8 p -114.0 5.53 16.14 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.101 -179.506 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . 0.529 ' N ' ' O ' ' A' ' 38' ' ' VAL . 28.1 p 37.5 57.97 4.28 Favored Pre-proline 0 N--CA 1.465 0.288 0 CA-C-O 120.772 0.32 . . . . 0.0 110.341 -179.235 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 69.3 Cg_endo -75.79 -11.92 20.04 Favored 'Trans proline' 0 C--N 1.312 -1.343 0 C-N-CA 122.779 2.32 . . . . 0.0 112.339 -179.312 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . 0.463 ' NE1' H141 ' A' ' 201' ' ' MYR . 0.0 OUTLIER -82.5 12.48 4.51 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.024 -179.569 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.454 ' CE1' ' OE1' ' A' ' 47' ' ' GLN . 21.3 t80 39.85 54.59 5.99 Favored Pre-proline 0 C--N 1.331 -0.206 0 CA-C-O 120.864 0.364 . . . . 0.0 110.227 179.882 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.438 ' CD ' ' N ' ' A' ' 45' ' ' PHE . 19.1 Cg_endo -58.88 -2.62 1.18 Allowed 'Trans proline' 0 C--N 1.308 -1.598 0 C-N-CA 122.898 2.399 . . . . 0.0 112.256 -179.522 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.454 ' OE1' ' CE1' ' A' ' 45' ' ' PHE . 88.2 mt-30 -60.73 -52.62 64.33 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.238 179.933 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.427 ' O ' ' H51' ' A' ' 201' ' ' MYR . 76.9 tt0 -89.09 -21.92 23.15 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-O 121.053 0.454 . . . . 0.0 110.397 179.104 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . 0.477 ' O ' ' H71' ' A' ' 201' ' ' MYR . . . 78.89 63.24 2.11 Favored Glycine 0 CA--C 1.523 0.554 0 N-CA-C 110.534 -1.026 . . . . 0.0 110.534 -179.486 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . 0.427 ' OG1' ' NE2' ' A' ' 98' ' ' GLN . 11.2 t -137.19 160.8 37.96 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.836 0.351 . . . . 0.0 110.748 -179.411 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.3 mt -83.53 133.53 28.95 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.425 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.521 179.603 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -116.95 120.83 39.64 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.373 -0.83 . . . . 0.0 110.345 179.298 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 20.3 mm -91.43 -48.13 13.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.922 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -63.17 -44.98 93.91 Favored 'General case' 0 C--O 1.238 0.46 0 CA-C-O 121.255 0.55 . . . . 0.0 110.66 -179.399 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 85.0 mtt85 -64.14 -34.36 77.89 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.115 -0.493 . . . . 0.0 109.903 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 29.4 t-105 -59.39 -39.13 82.38 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-O 121.125 0.488 . . . . 0.0 110.4 -179.466 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 83.7 mtp180 -64.12 -39.08 93.26 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.347 179.949 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . 0.442 ' O ' ' OD2' ' A' ' 61' ' ' ASP . 83.9 mtt85 -60.88 -52.06 66.64 Favored 'General case' 0 C--N 1.331 -0.228 0 C-N-CA 120.715 -0.394 . . . . 0.0 111.209 -179.972 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 5.9 p -69.01 -31.05 48.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.13 179.179 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -67.71 -44.58 80.61 Favored Glycine 0 CA--C 1.526 0.74 0 N-CA-C 111.344 -0.703 . . . . 0.0 111.344 -179.819 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . 0.442 ' OD2' ' O ' ' A' ' 58' ' ' ARG . 0.5 OUTLIER -65.87 -38.01 87.66 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.779 0.323 . . . . 0.0 110.609 -179.42 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 76.1 m -64.98 -49.57 69.78 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.04 0.448 . . . . 0.0 110.678 -179.45 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . 0.458 ' CD2' ' CE2' ' A' ' 37' ' ' PHE . 12.0 m-85 -67.29 -28.94 68.43 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.282 179.626 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 56.9 tt0 -61.48 -45.42 94.32 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 120.658 -0.417 . . . . 0.0 110.967 -179.872 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 24.4 t0 -62.97 -51.83 65.37 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.005 0.431 . . . . 0.0 110.595 179.699 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 54.1 m-85 -62.34 -32.81 73.64 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.037 -0.528 . . . . 0.0 110.234 179.819 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.416 ' OH ' ' CD ' ' A' ' 76' ' ' PRO . 58.2 t80 -61.83 -40.2 94.46 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.312 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 88.6 m-20 -63.96 -39.92 95.23 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.343 -179.626 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 61.4 p -49.3 -34.3 15.17 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.693 -179.31 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 69.1 m-85 -65.58 -47.0 77.25 Favored 'General case' 0 C--N 1.322 -0.609 0 C-N-CA 120.075 -0.65 . . . . 0.0 111.134 -179.906 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . 0.497 ' H ' ' HD3' ' A' ' 72' ' ' PRO . . . 110.91 71.48 0.64 Allowed Glycine 0 N--CA 1.472 1.036 0 N-CA-C 110.853 -0.899 . . . . 0.0 110.853 -179.545 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . 0.497 ' HD3' ' H ' ' A' ' 71' ' ' GLY . 24.5 Cg_exo -62.78 142.06 87.46 Favored 'Trans proline' 0 C--N 1.305 -1.74 0 C-N-CA 123.241 2.628 . . . . 0.0 111.891 -179.861 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 97.6 mt-10 -83.2 -46.29 12.88 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-O 121.047 0.451 . . . . 0.0 110.206 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.548 ' HD3' ' H ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -137.14 3.87 2.66 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.573 -0.739 . . . . 0.0 111.861 -179.72 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 54.1 t 57.1 100.11 0.04 OUTLIER Pre-proline 0 C--N 1.325 -0.486 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.485 -178.248 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . 0.416 ' CD ' ' OH ' ' A' ' 67' ' ' TYR . 48.6 Cg_exo -53.38 126.8 22.84 Favored 'Trans proline' 0 N--CA 1.494 1.556 0 C-N-CA 122.032 1.821 . . . . 0.0 112.176 -179.647 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.477 ' O ' ' N ' ' A' ' 79' ' ' ALA . 45.3 t -84.01 -20.81 8.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.875 179.497 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 71.5 p -40.75 -24.99 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.464 -179.262 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . 0.477 ' N ' ' O ' ' A' ' 77' ' ' VAL . . . -65.5 -41.83 92.79 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.144 0.497 . . . . 0.0 110.868 179.597 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . 0.454 ' N ' ' O ' ' A' ' 77' ' ' VAL . 2.4 m-85 -62.77 -39.37 93.96 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.644 179.853 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 73.4 p -54.17 -42.39 69.58 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.355 -179.725 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 9.5 m-85 -61.05 -54.24 47.22 Favored 'General case' 0 CA--C 1.52 -0.208 0 C-N-CA 120.847 -0.341 . . . . 0.0 110.659 179.832 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' TRP . . . . . . . . . . . . . 37.7 t90 -56.78 -36.7 70.15 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.543 179.724 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 92.6 m-20 -62.86 -48.54 78.56 Favored 'General case' 0 C--O 1.235 0.327 0 C-N-CA 120.775 -0.37 . . . . 0.0 111.155 -179.409 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 33.1 tp -70.41 -51.53 28.86 Favored 'General case' 0 N--CA 1.447 -0.62 0 C-N-CA 120.532 -0.467 . . . . 0.0 110.376 179.676 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -58.22 -27.35 32.1 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 C-N-CA 120.511 -0.475 . . . . 0.0 110.513 -179.766 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 64.5 tttt -65.11 -48.9 72.0 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.666 -178.898 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.2 pp20? -80.48 -21.33 42.11 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.739 -179.876 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.537 ' O ' HD13 ' A' ' 89' ' ' LEU . 0.2 OUTLIER -62.11 -43.09 99.59 Favored 'General case' 0 N--CA 1.447 -0.625 0 C-N-CA 120.046 -0.662 . . . . 0.0 110.113 -178.68 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 2.2 mt -63.33 -43.12 98.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 C-N-CA 119.949 -0.7 . . . . 0.0 110.052 -179.618 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 -55.57 -17.1 4.81 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.764 -178.478 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 75.3 tttt -61.52 134.28 56.68 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.315 179.635 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -62.37 -41.22 98.46 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.683 -179.806 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . 0.448 ' O ' ' C ' ' A' ' 95' ' ' VAL . 81.0 mm-40 -74.85 -2.22 25.78 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.971 -179.603 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.448 ' C ' ' O ' ' A' ' 94' ' ' GLU . 1.9 m 30.55 -106.71 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.29 0 O-C-N 123.831 0.707 . . . . 0.0 110.442 179.939 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' ASN . . . . . 0.439 ' O ' ' N ' ' A' ' 98' ' ' GLN . 0.8 OUTLIER -152.63 164.43 20.33 Favored Pre-proline 0 C--N 1.322 -0.596 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.658 179.047 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . 0.413 ' HB2' ' H72' ' A' ' 201' ' ' MYR . 50.9 Cg_exo -46.07 -13.28 0.09 OUTLIER 'Trans proline' 0 N--CA 1.494 1.52 0 C-N-CA 122.797 2.332 . . . . 0.0 112.464 179.079 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . 0.439 ' N ' ' O ' ' A' ' 96' ' ' ASN . 3.5 pt20 -54.11 -15.88 1.71 Allowed 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.856 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 71.8 t -61.87 -50.19 81.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 C-N-CA 120.82 -0.352 . . . . 0.0 111.108 -179.152 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 90.9 mmm -73.61 -42.2 61.81 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.988 0.423 . . . . 0.0 111.059 179.948 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . 0.774 ' HB2' ' OE1' ' A' ' 4' ' ' GLU . . . -63.43 -26.88 68.94 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.679 -179.737 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -51.43 -15.55 0.43 Allowed 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.686 -179.922 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.401 ' O ' HG12 ' A' ' 103' ' ' VAL . 74.0 t -65.49 -17.45 22.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.392 179.439 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -58.92 -39.36 81.32 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.601 -179.722 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 97.9 mt-30 51.98 176.33 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.68 179.826 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 19.4 m -61.73 -44.46 96.86 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.691 -179.891 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 93.8 mt-10 -125.18 163.28 22.8 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.485 -179.709 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . 0.536 ' OE1' ' N ' ' A' ' 108' ' ' GLU . 54.5 mp0 -90.41 120.19 31.32 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.061 -0.518 . . . . 0.0 109.937 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 42.4 pt -43.1 -19.15 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.491 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.514 ' N ' ' O ' ' A' ' 108' ' ' GLU . 35.1 mt -63.61 -42.04 98.25 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.429 -179.821 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 66.4 tttm -67.57 -38.34 83.92 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.449 179.895 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 51.2 m -59.47 -47.29 86.05 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.79 -179.211 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 90.1 m-20 -65.82 -42.51 90.54 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.633 179.823 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . 0.701 ' OG ' HG23 ' A' ' 116' ' ' THR . 23.1 t -158.23 139.12 13.04 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.526 179.78 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 75.2 mt-30 -89.44 20.72 3.72 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.805 179.824 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . 0.701 HG23 ' OG ' ' A' ' 114' ' ' SER . 41.3 p -63.37 -32.51 73.96 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.44 179.873 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 65.6 t0 -65.68 -47.24 76.1 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.677 179.832 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 92.8 mt -125.99 76.61 1.61 Allowed 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.546 -179.878 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 83.4 tt0 -65.46 -40.47 93.24 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.393 179.856 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 39.5 p-80 -154.15 167.34 30.2 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.568 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 63.2 m80 -119.79 144.19 47.43 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.326 179.988 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 54.7 m-70 -113.25 138.67 49.66 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.507 179.939 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 85.5 t60 -62.47 -40.92 98.2 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.458 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 124' ' ' HIS . . . . . . . . . . . . . 29.4 m80 -60.98 -43.32 99.0 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.597 179.973 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 97.9 m-70 . . . . . 0 C--O 1.22 -0.472 0 CA-C-O 118.013 -0.994 . . . . 0.0 110.591 179.956 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 201' ' ' MYR . . . . . 0.656 ' H52' ' OE1' ' A' ' 4' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.71 0 N-CA-C 110.887 -0.885 . . . . 0.0 110.887 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 99.2 mm-40 -61.81 -39.79 92.99 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.825 0.345 . . . . 0.0 110.573 179.803 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -55.52 -22.4 21.15 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.517 179.765 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.579 ' HB2' ' H21' ' A' ' 201' ' ' MYR . 51.2 tp -42.31 -34.14 0.74 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.564 -179.999 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 56.2 m -54.21 -37.48 64.6 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.568 179.362 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 97.8 mm-40 -62.49 -37.3 85.48 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.588 179.741 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . 0.41 ' CD2' H102 ' A' ' 201' ' ' MYR . 59.1 t-80 -56.03 -43.93 78.28 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.585 179.689 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 81.9 tt0 -59.85 -53.16 61.18 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.563 179.114 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.479 ' O ' ' N ' ' A' ' 14' ' ' GLN . 86.8 mtt180 -60.61 -31.65 70.82 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.597 179.085 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.501 ' O ' ' HB2' ' A' ' 15' ' ' LEU . 51.1 t80 -60.66 -36.47 78.77 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.563 -179.601 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 3.0 t -63.24 -48.66 86.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.604 -179.198 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -83.49 -41.97 17.41 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.629 -179.571 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . 0.479 ' N ' ' O ' ' A' ' 10' ' ' ARG . 67.6 tp60 -61.39 -52.87 62.83 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.602 -179.119 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.708 HD13 ' O ' ' A' ' 15' ' ' LEU . 0.3 OUTLIER -61.25 -47.43 86.08 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.575 -179.976 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.478 ' HB3' HG11 ' A' ' 26' ' ' VAL . 87.0 mttt -56.29 -35.28 67.32 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.59 179.487 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 80.0 mt-30 -72.94 -36.08 67.13 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.622 178.636 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.416 ' O ' HG23 ' A' ' 21' ' ' THR . . . -57.22 -32.59 66.68 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.58 179.512 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.1 mt -85.59 -33.34 21.71 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.576 177.997 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -46.97 -42.37 17.79 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.529 -179.541 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.512 ' C ' ' H ' ' A' ' 23' ' ' GLY . 0.2 OUTLIER -71.43 -25.75 62.45 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.581 -179.578 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 82.6 mmt-85 -72.88 19.52 0.09 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.562 179.674 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . 0.512 ' H ' ' C ' ' A' ' 21' ' ' THR . . . 86.31 18.26 59.3 Favored Glycine 0 CA--C 1.524 0.627 0 N-CA-C 110.934 -0.866 . . . . 0.0 110.934 -179.604 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.634 HG12 ' N ' ' A' ' 25' ' ' LYS . 22.8 t -105.39 168.85 2.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 120.787 0.327 . . . . 0.0 110.622 -179.927 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.634 ' N ' HG12 ' A' ' 24' ' ' VAL . 63.1 mttp -131.01 136.43 48.5 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.524 179.305 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.478 HG11 ' HB3' ' A' ' 16' ' ' LYS . 4.8 m -134.37 108.3 10.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.545 -179.459 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.477 ' O ' ' N ' ' A' ' 30' ' ' ASP . 13.0 ttmt -107.4 158.78 16.9 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.541 178.867 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.422 ' H ' ' HG2' ' A' ' 27' ' ' LYS . 97.9 m-85 -39.01 -34.22 0.15 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.534 179.39 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -60.19 -25.48 65.61 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.575 -179.706 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.487 ' O ' ' CB ' ' A' ' 34' ' ' PHE . 1.0 OUTLIER -60.06 -46.3 90.01 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.614 -179.028 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.566 ' H ' HD12 ' A' ' 31' ' ' LEU . 5.8 mp -63.68 -42.68 97.99 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.493 -179.959 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 36.8 mt -58.49 -46.11 87.34 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.588 -178.465 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.461 ' NZ ' ' CZ ' ' A' ' 37' ' ' PHE . 65.3 tttm -87.53 -49.22 7.33 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.52 -177.038 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . 0.487 ' CB ' ' O ' ' A' ' 30' ' ' ASP . 43.0 t80 -60.9 -50.25 74.16 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.53 -178.182 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.521 ' CB ' ' O ' ' A' ' 31' ' ' LEU . 7.1 t80 -61.84 -46.09 90.98 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.614 -178.938 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 86.1 m-20 -65.39 -35.2 80.23 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.574 -179.248 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.544 ' CE2' ' CD2' ' A' ' 63' ' ' PHE . 1.9 m-85 -60.89 -46.74 89.44 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.569 -179.191 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.622 ' O ' ' N ' ' A' ' 42' ' ' CYS . 25.8 m -76.52 -37.46 30.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.532 -178.825 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -62.56 -29.67 70.75 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.584 -179.633 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 81.3 m-20 -59.14 -44.84 92.09 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.557 -178.588 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.524 ' C ' ' SG ' ' A' ' 42' ' ' CYS . 41.6 p -115.06 -3.25 12.63 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.58 -178.849 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . 0.622 ' N ' ' O ' ' A' ' 38' ' ' VAL . 1.8 p 36.19 60.48 3.15 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.572 -179.608 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.402 ' HD3' ' N ' ' A' ' 42' ' ' CYS . 57.1 Cg_endo -77.7 -40.22 0.43 Allowed 'Trans proline' 0 C--N 1.305 -1.717 0 C-N-CA 122.796 2.331 . . . . 0.0 112.115 -179.334 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . 0.801 ' HE1' ' H ' ' A' ' 52' ' ' ASP . 0.0 OUTLIER -73.43 3.44 6.02 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.552 -179.633 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.558 ' O ' ' N ' ' A' ' 47' ' ' GLN . 64.0 m-85 54.91 50.49 6.34 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.577 -179.527 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.528 ' CD ' ' N ' ' A' ' 45' ' ' PHE . 52.9 Cg_exo -40.1 -16.77 0.04 OUTLIER 'Trans proline' 0 C--N 1.305 -1.747 0 C-N-CA 122.835 2.357 . . . . 0.0 112.165 179.116 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.558 ' N ' ' O ' ' A' ' 45' ' ' PHE . 71.9 tp60 -63.84 -48.5 76.52 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.542 -179.532 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.419 ' OE2' ' HB3' ' A' ' 101' ' ' ALA . 51.6 tp10 -89.41 -45.22 9.62 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.636 179.867 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . 0.488 ' O ' ' H71' ' A' ' 201' ' ' MYR . . . 96.61 68.45 0.98 Allowed Glycine 0 CA--C 1.524 0.616 0 N-CA-C 110.956 -0.857 . . . . 0.0 110.956 -179.306 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . 0.698 ' O ' H132 ' A' ' 201' ' ' MYR . 7.0 t -130.03 170.2 14.3 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.842 0.353 . . . . 0.0 110.556 -179.333 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.3 mt -103.75 132.14 50.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.665 178.814 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . 0.801 ' H ' ' HE1' ' A' ' 44' ' ' TRP . 96.3 m-20 -118.51 121.42 40.23 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.549 179.04 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 22.0 mm -91.51 -53.86 8.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.584 -179.167 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 88.9 tttt -64.17 -48.27 76.61 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.564 -179.78 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 22.9 ttm-85 -61.53 -40.67 95.49 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.627 -179.611 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' TRP . . . . . 0.598 ' CE3' ' CH2' ' A' ' 44' ' ' TRP . 36.0 t-105 -51.74 -37.28 50.47 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.577 179.706 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -66.61 -38.92 87.97 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.596 -179.959 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 94.2 mtt-85 -61.53 -52.5 64.21 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.586 -179.857 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.443 HG13 ' N ' ' A' ' 60' ' ' GLY . 2.8 p -63.34 -43.62 98.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.628 179.879 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . 0.443 ' N ' HG13 ' A' ' 59' ' ' VAL . . . -64.53 -33.46 87.29 Favored Glycine 0 CA--C 1.525 0.697 0 N-CA-C 110.938 -0.865 . . . . 0.0 110.938 -179.709 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 10.9 m-20 -66.1 -37.01 84.7 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.788 0.327 . . . . 0.0 110.615 -179.701 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 84.0 m -63.45 -53.67 48.48 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.572 -179.82 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . 0.544 ' CD2' ' CE2' ' A' ' 37' ' ' PHE . 56.2 m-85 -67.66 -30.37 69.9 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.572 -179.608 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 60.0 tt0 -60.72 -42.26 96.92 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.579 179.382 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 29.5 t0 -63.18 -53.8 47.53 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.525 179.581 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' TYR . . . . . 0.457 ' O ' ' OG1' ' A' ' 69' ' ' THR . 60.6 m-85 -63.17 -35.55 80.68 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.518 179.615 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 62.5 t80 -57.9 -38.36 75.7 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.61 179.788 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 98.8 m-20 -66.66 -38.82 87.63 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.553 -179.896 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.457 ' OG1' ' O ' ' A' ' 66' ' ' TYR . 58.1 p -61.38 -29.74 70.1 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.618 -179.337 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -65.81 -40.94 92.33 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.572 -179.718 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . 0.506 ' H ' ' HD3' ' A' ' 72' ' ' PRO . . . 104.38 71.75 0.85 Allowed Glycine 0 CA--C 1.525 0.705 0 N-CA-C 110.937 -0.865 . . . . 0.0 110.937 179.665 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . 0.506 ' HD3' ' H ' ' A' ' 71' ' ' GLY . 19.3 Cg_exo -65.37 144.49 80.34 Favored 'Trans proline' 0 C--N 1.305 -1.721 0 C-N-CA 122.788 2.325 . . . . 0.0 112.173 179.326 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -76.29 -50.32 14.66 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.572 -179.806 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.519 ' HD3' ' H ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -138.88 6.08 2.4 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.56 -179.495 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 52.0 t 56.06 94.32 0.05 OUTLIER Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.612 -179.775 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -52.38 124.22 14.53 Favored 'Trans proline' 0 C--N 1.304 -1.767 0 C-N-CA 122.796 2.331 . . . . 0.0 112.143 -179.755 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.412 ' O ' ' N ' ' A' ' 80' ' ' PHE . 41.7 t -84.18 -15.43 11.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.565 -179.467 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 69.0 p -42.17 -27.18 0.12 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.546 179.927 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.87 -41.67 98.14 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.596 179.613 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . 0.412 ' N ' ' O ' ' A' ' 77' ' ' VAL . 2.3 m-85 -66.4 -33.28 75.35 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.547 -179.984 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 41.8 t -60.56 -42.52 96.78 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.568 179.802 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 7.6 m-85 -59.92 -52.23 66.3 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.553 179.445 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' TRP . . . . . 0.4 ' O ' ' CB ' ' A' ' 87' ' ' LYS . 41.1 t90 -59.03 -36.49 75.08 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.612 179.855 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 78.2 m-20 -62.02 -46.99 86.74 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.576 -179.559 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.402 ' O ' ' HG3' ' A' ' 88' ' ' GLU . 30.9 tp -70.64 -56.96 5.27 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.609 179.506 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -54.93 -24.97 15.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.563 179.547 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.4 ' CB ' ' O ' ' A' ' 83' ' ' TRP . 55.0 tttt -68.89 -47.6 65.46 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.581 -179.825 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . 0.463 ' OE1' ' O ' ' A' ' 88' ' ' GLU . 1.3 pp20? -82.71 -18.71 39.88 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.569 -179.802 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.601 ' O ' HD13 ' A' ' 89' ' ' LEU . 0.2 OUTLIER -61.99 -46.15 90.51 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.526 179.504 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 2.7 mt -62.73 -40.68 89.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.606 179.561 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 51.3 t0 -50.72 -42.56 57.41 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.59 -179.943 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 97.2 mttt -68.03 143.63 55.46 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.604 179.888 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -75.5 9.02 2.4 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.622 -179.818 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 40.4 tp10 -59.34 -33.72 71.48 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.499 179.859 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.413 ' H ' HG22 ' A' ' 95' ' ' VAL . 8.3 m -67.18 133.26 31.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.501 179.826 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' ASN . . . . . 0.541 ' O ' ' N ' ' A' ' 98' ' ' GLN . 1.1 m-20 -85.54 162.82 46.84 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.588 -179.624 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_exo -42.64 -13.45 0.04 OUTLIER 'Trans proline' 0 C--N 1.305 -1.763 0 C-N-CA 122.896 2.397 . . . . 0.0 112.101 179.271 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . 0.615 ' NE2' ' H91' ' A' ' 201' ' ' MYR . 5.0 pt20 -46.24 -25.42 0.61 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.573 -179.81 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 98.4 t -63.22 -50.6 78.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.557 -179.926 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 47.6 ttp -66.77 -41.25 88.02 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.538 -179.729 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . 0.419 ' HB3' ' OE2' ' A' ' 48' ' ' GLU . . . -60.72 -25.31 66.34 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.585 -179.238 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . 0.408 ' CB ' HG21 ' A' ' 50' ' ' THR . . . -63.13 -17.08 61.95 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.542 179.998 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 55.8 t -60.46 -19.53 18.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.591 179.413 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -58.3 -38.94 78.04 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.579 179.894 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 98.8 mm-40 -74.04 -38.18 64.08 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.595 -179.913 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 82.0 p -65.58 -20.41 66.31 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.619 179.992 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 92.2 mt-10 54.26 -164.18 0.11 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.508 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . 0.577 ' C ' ' H ' ' A' ' 110' ' ' LEU . 72.7 mm-40 -90.04 125.85 35.55 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.589 179.22 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 44.0 pt -58.86 2.26 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.577 -179.976 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.577 ' H ' ' C ' ' A' ' 108' ' ' GLU . 91.6 mt -95.18 -5.65 43.47 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.628 179.871 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 86.5 tttt -121.48 127.13 50.74 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.594 179.948 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . 0.436 ' OG ' ' N ' ' A' ' 113' ' ' ASN . 95.4 p -148.52 -113.02 0.07 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.563 -179.962 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' ASN . . . . . 0.436 ' N ' ' OG ' ' A' ' 112' ' ' SER . 77.4 m-20 -62.17 -34.79 77.09 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.618 179.617 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 62.4 p -153.07 160.2 42.92 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.53 179.735 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 86.4 mt-30 -90.15 129.65 36.4 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.581 179.993 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . 0.406 ' OG1' ' N ' ' A' ' 117' ' ' ASP . 67.5 p -108.68 -74.46 0.66 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.602 179.874 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . 0.406 ' N ' ' OG1' ' A' ' 116' ' ' THR . 92.5 m-20 -62.36 -44.46 96.41 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.616 179.827 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.638 ' O ' HD13 ' A' ' 118' ' ' LEU . 0.2 OUTLIER -63.54 -44.69 93.48 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.517 179.869 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 80.4 tt0 -60.39 132.64 54.54 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.568 -179.91 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . 0.431 ' CD2' ' NE2' ' A' ' 122' ' ' HIS . 15.3 p-80 -147.31 156.85 43.29 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.644 179.932 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 80.7 m80 -112.2 154.96 24.76 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.569 -179.979 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 122' ' ' HIS . . . . . 0.431 ' NE2' ' CD2' ' A' ' 120' ' ' HIS . 97.6 m-70 -117.11 160.57 20.8 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.613 179.962 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 94.7 m-70 -65.78 -42.41 90.82 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.538 -179.94 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 124' ' ' HIS . . . . . . . . . . . . . 71.5 m80 -60.63 -41.3 94.62 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.498 -179.982 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 81.3 t60 . . . . . 0 C--O 1.22 -0.474 0 CA-C-O 118.064 -0.97 . . . . 0.0 110.535 -179.979 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 201' ' ' MYR . . . . . 0.698 H132 ' O ' ' A' ' 50' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.717 0 N-CA-C 110.95 -0.86 . . . . 0.0 110.95 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 99.4 mm-40 -62.61 -36.9 84.23 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.955 0.407 . . . . 0.0 110.369 -179.987 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.457 ' HB3' ' H62' ' A' ' 201' ' ' MYR . 93.7 mt-10 -51.21 -21.75 2.24 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.483 179.846 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 41.5 tp -42.98 -34.86 1.06 Allowed 'General case' 0 C--O 1.236 0.348 0 CA-C-O 120.998 0.427 . . . . 0.0 110.429 -179.625 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.589 ' CB ' HH12 ' A' ' 10' ' ' ARG . 50.2 m -54.15 -35.18 61.96 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 120.493 -0.483 . . . . 0.0 109.958 179.789 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 71.3 tp60 -64.71 -33.24 75.5 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.96 -0.563 . . . . 0.0 110.44 179.504 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 86.3 t60 -59.16 -45.11 91.84 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-O 120.95 0.405 . . . . 0.0 110.069 -179.947 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -60.51 -43.38 97.13 Favored 'General case' 0 C--O 1.241 0.649 0 CA-C-N 116.034 -0.53 . . . . 0.0 109.874 179.478 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.589 HH12 ' CB ' ' A' ' 6' ' ' SER . 80.2 mtt85 -66.22 -37.31 85.24 Favored 'General case' 0 C--O 1.21 -0.974 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 179.61 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.54 ' CD1' H122 ' A' ' 201' ' ' MYR . 0.1 OUTLIER -53.28 -38.76 63.38 Favored 'General case' 0 C--N 1.319 -0.753 0 C-N-CA 120.445 -0.502 . . . . 0.0 110.172 -179.967 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 2.3 t -65.67 -52.93 44.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 C-N-CA 119.932 -0.707 . . . . 0.0 111.497 -179.868 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 77.0 tt0 -80.49 -48.64 12.5 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 120.403 -0.519 . . . . 0.0 112.004 -178.73 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . 0.501 ' N ' ' O ' ' A' ' 10' ' ' ARG . 60.9 tp60 -53.64 -53.0 58.12 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.909 -178.848 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.582 HD13 ' O ' ' A' ' 15' ' ' LEU . 0.4 OUTLIER -63.26 -49.29 74.7 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.35 -0.54 . . . . 0.0 110.121 -179.589 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 62.8 mttm -53.25 -33.81 54.55 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 120.499 -0.48 . . . . 0.0 110.268 179.319 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 89.3 mm-40 -75.42 -35.66 60.94 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.566 179.183 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -57.06 -34.44 68.25 Favored 'General case' 0 C--O 1.223 -0.296 0 CA-C-N 116.044 -0.526 . . . . 0.0 109.956 -179.931 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.9 mt -85.42 -33.48 21.93 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.096 0.474 . . . . 0.0 110.564 179.243 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -47.46 -43.28 24.05 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.541 -179.129 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.493 ' C ' ' H ' ' A' ' 23' ' ' GLY . 0.1 OUTLIER -72.02 -24.07 61.5 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.555 -179.908 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 71.8 mmt-85 -74.69 24.08 0.09 Allowed 'General case' 0 C--O 1.233 0.187 0 CA-C-O 120.945 0.402 . . . . 0.0 110.435 179.906 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . 0.493 ' H ' ' C ' ' A' ' 21' ' ' THR . . . 82.49 17.96 67.43 Favored Glycine 0 CA--C 1.526 0.724 0 N-CA-C 110.89 -0.884 . . . . 0.0 110.89 179.876 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.593 HG12 ' N ' ' A' ' 25' ' ' LYS . 21.9 t -105.42 167.12 3.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 N-CA-C 110.294 -0.261 . . . . 0.0 110.294 -179.901 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.593 ' N ' HG12 ' A' ' 24' ' ' VAL . 69.9 mmtt -129.43 132.26 46.94 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.26 179.518 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.688 HG23 ' O ' ' A' ' 26' ' ' VAL . 30.8 m -127.83 105.22 13.26 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.252 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.239 -179.956 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.423 ' N ' ' OD1' ' A' ' 30' ' ' ASP . 8.3 pttm -104.89 163.39 12.56 Favored 'General case' 0 C--O 1.218 -0.579 0 N-CA-C 109.806 -0.442 . . . . 0.0 109.806 179.812 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 84.2 m-85 -42.86 -34.89 1.03 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.961 0.41 . . . . 0.0 110.782 179.981 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -56.85 -23.27 42.91 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.819 179.839 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.423 ' OD1' ' N ' ' A' ' 27' ' ' LYS . 1.1 m-20 -61.91 -46.97 87.04 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.613 -179.159 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.5 ' O ' ' CB ' ' A' ' 35' ' ' PHE . 5.8 mp -67.24 -41.56 85.42 Favored 'General case' 0 C--O 1.215 -0.73 0 CA-C-O 120.943 0.401 . . . . 0.0 110.393 179.738 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 42.3 mt -57.27 -45.86 83.64 Favored 'General case' 0 C--N 1.314 -0.973 0 C-N-CA 119.419 -0.913 . . . . 0.0 111.03 -178.359 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -84.32 -50.17 8.07 Favored 'General case' 0 C--N 1.32 -0.696 0 C-N-CA 120.472 -0.491 . . . . 0.0 111.909 -179.089 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . 0.858 ' O ' HG22 ' A' ' 38' ' ' VAL . 42.0 t80 -62.47 -49.56 74.92 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.461 -178.531 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.5 ' CB ' ' O ' ' A' ' 31' ' ' LEU . 22.4 t80 -61.22 -44.56 97.08 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.103 -179.567 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -69.37 -40.56 77.39 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 120.275 -0.57 . . . . 0.0 111.663 179.975 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.573 ' CE2' ' CE1' ' A' ' 63' ' ' PHE . 3.0 m-85 -62.08 -48.66 79.22 Favored 'General case' 0 CA--C 1.518 -0.278 0 CA-C-O 120.858 0.361 . . . . 0.0 111.887 -178.281 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.858 HG22 ' O ' ' A' ' 34' ' ' PHE . 17.1 m -70.03 -41.62 79.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.467 -179.745 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -63.04 -31.7 72.89 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.506 -0.316 . . . . 0.0 110.95 -179.732 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 98.8 m-20 -56.66 -49.71 74.24 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 120.906 -0.317 . . . . 0.0 111.113 -179.169 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.46 ' O ' ' SG ' ' A' ' 42' ' ' CYS . 15.4 p -106.64 -7.61 17.29 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.545 -0.298 . . . . 0.0 110.954 -179.741 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . 0.554 ' N ' ' O ' ' A' ' 38' ' ' VAL . 28.6 p 38.04 57.52 4.8 Favored Pre-proline 0 N--CA 1.463 0.186 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.303 -179.234 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -75.95 -31.42 5.06 Favored 'Trans proline' 0 C--N 1.314 -1.257 0 C-N-CA 122.551 2.167 . . . . 0.0 112.582 -179.4 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . 0.631 ' CH2' ' CE3' ' A' ' 56' ' ' TRP . 0.0 OUTLIER -77.76 13.75 1.25 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.89 -179.646 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.532 ' CD2' ' OD2' ' A' ' 52' ' ' ASP . 6.1 m-85 39.56 53.58 5.06 Favored Pre-proline 0 C--O 1.232 0.142 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.076 -179.874 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.444 ' CD ' ' N ' ' A' ' 45' ' ' PHE . 11.1 Cg_endo -53.38 -5.7 0.28 Allowed 'Trans proline' 0 C--N 1.31 -1.488 0 C-N-CA 122.714 2.276 . . . . 0.0 112.004 -179.688 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.462 ' H ' ' C ' ' A' ' 45' ' ' PHE . 64.1 tp60 -64.17 -48.79 74.6 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.333 -179.448 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.468 ' O ' ' H51' ' A' ' 201' ' ' MYR . 1.2 tp10 -89.42 -30.24 18.47 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-O 120.908 0.385 . . . . 0.0 110.531 179.155 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . 0.67 ' CA ' ' H92' ' A' ' 201' ' ' MYR . . . 87.65 75.19 1.28 Allowed Glycine 0 CA--C 1.523 0.573 0 N-CA-C 110.844 -0.902 . . . . 0.0 110.844 -179.445 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 13.6 t -144.11 165.22 28.43 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.623 0.249 . . . . 0.0 110.653 -179.792 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.1 mt -98.96 133.85 40.05 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.265 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 179.283 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . 0.611 ' H ' ' HE1' ' A' ' 44' ' ' TRP . 73.7 m-20 -117.91 121.17 40.0 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.276 179.083 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 18.5 mm -87.32 -46.49 16.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.825 179.998 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -66.22 -45.84 79.29 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-O 121.108 0.48 . . . . 0.0 111.283 -179.775 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 77.3 mmt-85 -63.72 -33.97 76.84 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.908 -0.587 . . . . 0.0 109.909 -179.507 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' TRP . . . . . 0.631 ' CE3' ' CH2' ' A' ' 44' ' ' TRP . 50.3 t-105 -59.29 -36.79 76.21 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-O 121.3 0.572 . . . . 0.0 110.049 179.994 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 44.0 ttm180 -65.21 -41.33 94.58 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.308 179.55 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 95.2 mtt-85 -61.75 -53.07 61.01 Favored 'General case' 0 N--CA 1.466 0.334 0 C-N-CA 120.793 -0.363 . . . . 0.0 111.562 -179.491 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.499 HG13 ' N ' ' A' ' 60' ' ' GLY . 4.8 p -63.16 -45.93 97.26 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.391 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.198 179.632 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . 0.499 ' N ' HG13 ' A' ' 59' ' ' VAL . . . -63.04 -36.72 93.85 Favored Glycine 0 CA--C 1.524 0.615 0 N-CA-C 111.05 -0.82 . . . . 0.0 111.05 179.903 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 53.9 m-20 -65.24 -35.74 82.0 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.652 0.263 . . . . 0.0 110.692 -179.479 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 80.9 m -64.29 -55.33 22.09 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.821 0.344 . . . . 0.0 110.718 -179.93 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . 0.573 ' CE1' ' CE2' ' A' ' 37' ' ' PHE . 59.4 m-85 -64.47 -33.99 77.17 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.427 179.47 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 57.9 tt0 -60.0 -42.89 95.26 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 120.891 -0.324 . . . . 0.0 110.614 -179.88 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 20.8 t0 -61.1 -51.71 68.0 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.825 179.834 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 41.3 m-85 -65.97 -35.03 79.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.739 179.735 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 56.9 t80 -59.57 -44.41 93.31 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.291 -179.424 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 39.6 t30 -64.37 -40.33 95.62 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.579 179.941 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 41.0 p -66.1 -22.5 66.4 Favored 'General case' 0 CA--C 1.516 -0.332 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.342 179.933 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -70.04 -46.85 64.14 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 120.009 -0.676 . . . . 0.0 110.995 179.911 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . 0.509 ' H ' ' HD3' ' A' ' 72' ' ' PRO . . . 113.29 70.73 0.55 Allowed Glycine 0 CA--C 1.532 1.101 0 N-CA-C 110.698 -0.961 . . . . 0.0 110.698 -179.494 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . 0.509 ' HD3' ' H ' ' A' ' 71' ' ' GLY . 23.6 Cg_exo -63.93 147.34 92.01 Favored 'Trans proline' 0 N--CA 1.499 1.822 0 C-N-CA 123.029 2.486 . . . . 0.0 112.068 179.979 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -80.8 -49.52 11.0 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-O 120.953 0.406 . . . . 0.0 110.338 179.63 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.492 ' HD3' ' H ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -137.46 2.62 2.49 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.654 -179.481 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 68.8 t 57.7 93.5 0.05 OUTLIER Pre-proline 0 C--N 1.325 -0.48 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.211 -178.805 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -53.58 126.66 22.5 Favored 'Trans proline' 0 N--CA 1.495 1.59 0 C-N-CA 121.805 1.67 . . . . 0.0 111.786 -179.583 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.466 ' O ' ' N ' ' A' ' 80' ' ' PHE . 40.8 t -83.25 -20.53 9.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.679 179.822 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 63.6 p -41.55 -26.34 0.07 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.265 -179.27 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . 0.433 ' N ' ' O ' ' A' ' 77' ' ' VAL . . . -64.02 -42.69 97.04 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.546 179.654 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . 0.466 ' N ' ' O ' ' A' ' 77' ' ' VAL . 10.8 m-85 -64.5 -35.45 80.98 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.143 179.694 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 37.3 m -59.89 -42.09 93.01 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.353 179.814 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 4.1 m-85 -60.17 -51.36 69.91 Favored 'General case' 0 C--N 1.331 -0.215 0 C-N-CA 120.88 -0.328 . . . . 0.0 110.609 -179.951 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' TRP . . . . . . . . . . . . . 47.2 t90 -59.23 -39.01 81.39 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.645 179.66 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 12.4 m120 -61.86 -44.14 97.43 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.562 -179.651 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 25.0 tp -72.14 -59.32 2.8 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 120.358 -0.537 . . . . 0.0 110.135 179.359 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -50.74 -28.79 6.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-O 120.895 0.379 . . . . 0.0 110.395 179.709 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 66.0 tttt -65.26 -50.99 63.67 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.9 -179.293 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.1 pp20? -79.96 -20.1 46.35 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.801 -179.683 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.528 ' O ' HD13 ' A' ' 89' ' ' LEU . 0.2 OUTLIER -61.85 -46.24 90.31 Favored 'General case' 0 N--CA 1.443 -0.815 0 C-N-CA 120.158 -0.617 . . . . 0.0 110.486 -178.771 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 3.2 mt -63.67 -44.21 98.37 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 C-N-CA 119.891 -0.723 . . . . 0.0 109.937 -179.605 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 -64.88 -12.29 47.2 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.785 -178.988 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 68.1 tttt -74.04 139.83 44.98 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.377 179.736 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -74.86 -10.22 59.29 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.84 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 80.3 mm-40 -86.47 52.31 2.46 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.562 179.857 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 27.1 m -115.89 131.71 67.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.485 179.915 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' ASN . . . . . 0.445 ' OD1' ' N ' ' A' ' 96' ' ' ASN . 0.0 OUTLIER -58.76 161.88 7.73 Favored Pre-proline 0 C--N 1.324 -0.528 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.474 179.777 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -58.98 -13.22 17.86 Favored 'Trans proline' 0 N--CA 1.495 1.597 0 C-N-CA 122.821 2.347 . . . . 0.0 112.153 179.682 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . 0.94 HE22 ' H81' ' A' ' 201' ' ' MYR . 0.9 OUTLIER -48.47 -23.08 0.84 Allowed 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.557 179.818 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 77.4 t -63.0 -51.65 69.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 C-N-CA 120.56 -0.456 . . . . 0.0 110.743 -179.692 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 89.0 mmm -71.29 -40.13 71.08 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.578 179.741 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -64.25 -24.01 67.51 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.551 -179.618 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -67.89 -14.95 63.38 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.482 179.896 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.448 ' O ' ' O ' ' A' ' 106' ' ' THR . 55.7 t -63.84 -19.59 24.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.328 179.531 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -60.76 -36.54 79.2 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.718 -179.885 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . 0.426 ' OE1' ' CD2' ' A' ' 45' ' ' PHE . 53.9 tt0 -64.79 -42.12 95.3 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.055 -179.652 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . 0.448 ' O ' ' O ' ' A' ' 103' ' ' VAL . 28.3 m -105.67 125.21 50.73 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.704 -179.762 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -130.31 179.51 5.87 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.57 -179.97 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . 0.496 ' C ' ' N ' ' A' ' 110' ' ' LEU . 98.7 mt-10 -108.64 122.82 47.9 Favored 'General case' 0 CA--C 1.513 -0.445 0 CA-C-N 115.943 -0.571 . . . . 0.0 109.895 179.132 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 38.3 pt -49.45 -11.63 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.036 179.779 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.496 ' N ' ' C ' ' A' ' 108' ' ' GLU . 36.3 mt -68.16 -40.88 82.25 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.725 179.779 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -68.47 -39.98 81.16 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.357 -179.921 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 16.2 t -62.52 -44.42 96.4 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.856 -179.549 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 10.3 m120 -63.03 -40.82 98.86 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.539 -179.941 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 35.6 p -158.04 160.92 37.93 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.593 179.872 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 115' ' ' GLN . . . . . 0.43 ' O ' ' O ' ' A' ' 118' ' ' LEU . 14.8 pt20 -100.88 7.66 43.54 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.377 179.89 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 11.4 m -60.75 -44.63 96.46 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.395 -179.676 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 59.7 t0 -61.49 -49.45 76.74 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.842 -179.962 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.43 ' O ' ' O ' ' A' ' 115' ' ' GLN . 86.0 mt -122.46 132.53 54.39 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.583 -179.857 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 22.4 pt-20 -136.22 161.38 35.93 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.555 -0.293 . . . . 0.0 110.293 -179.93 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 70.3 m80 -115.85 150.24 37.32 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.243 -179.965 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 88.4 m-70 -129.82 157.23 42.78 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.424 -179.933 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 36.0 m80 -120.4 143.75 48.29 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.6 -179.925 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 98.3 m-70 -65.44 -38.55 90.22 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.412 -179.928 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 124' ' ' HIS . . . . . . . . . . . . . 78.1 m80 -117.63 143.43 46.15 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.625 179.908 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 71.7 t60 . . . . . 0 C--O 1.22 -0.464 0 CA-C-O 118.004 -0.998 . . . . 0.0 110.517 179.9 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 201' ' ' MYR . . . . . 0.94 ' H81' HE22 ' A' ' 98' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.646 0 N-CA-C 110.987 -0.845 . . . . 0.0 110.987 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . 0.489 ' O ' ' N ' ' A' ' 5' ' ' LEU . 89.3 mt-30 -65.37 -22.08 66.76 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.819 0.342 . . . . 0.0 110.576 -179.828 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.496 ' O ' ' N ' ' A' ' 7' ' ' GLN . 91.2 mt-10 -43.09 -20.52 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.558 179.912 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.489 ' N ' ' O ' ' A' ' 3' ' ' GLN . 59.6 tp -41.42 -37.47 1.05 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.602 179.671 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 96.3 p -59.09 -37.0 76.07 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.611 179.675 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . 0.496 ' N ' ' O ' ' A' ' 4' ' ' GLU . 58.3 tt0 -65.11 -37.01 86.1 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.552 179.05 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . 0.601 ' CE1' H112 ' A' ' 201' ' ' MYR . 78.8 t60 -53.83 -45.81 70.99 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.519 179.636 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -60.77 -46.24 91.22 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.553 179.688 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.487 ' O ' ' CB ' ' A' ' 14' ' ' GLN . 88.5 mtt-85 -64.91 -32.28 73.91 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.566 179.496 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.584 ' CE1' HD23 ' A' ' 15' ' ' LEU . 48.1 t80 -59.72 -35.19 74.03 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.529 179.854 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 4.2 t -65.21 -48.27 84.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.53 -178.935 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -83.79 -32.71 25.22 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.563 -179.82 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . 0.487 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 60.8 tp60 -73.58 -50.27 22.11 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.562 -178.186 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.68 HD13 ' O ' ' A' ' 15' ' ' LEU . 0.3 OUTLIER -63.45 -47.6 81.2 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.521 179.761 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.452 ' HB3' HG11 ' A' ' 26' ' ' VAL . 92.7 mttt -57.33 -32.76 67.04 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.582 179.086 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 60.1 tt0 -73.12 -37.52 66.64 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.598 178.461 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -56.76 -32.98 66.13 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.533 179.442 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.416 ' O ' ' N ' ' A' ' 22' ' ' ARG . 2.8 mt -85.73 -33.13 21.55 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.597 178.569 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 63.9 tttm -44.44 -42.65 7.18 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.559 -179.928 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.576 ' C ' ' H ' ' A' ' 23' ' ' GLY . 0.2 OUTLIER -75.39 -27.7 59.19 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.516 -179.706 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.416 ' N ' ' O ' ' A' ' 19' ' ' LEU . 77.8 mmt-85 -68.9 21.64 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.536 -179.874 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . 0.576 ' H ' ' C ' ' A' ' 21' ' ' THR . . . 87.56 14.11 64.1 Favored Glycine 0 CA--C 1.525 0.7 0 N-CA-C 110.887 -0.885 . . . . 0.0 110.887 -179.567 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.558 HG12 ' N ' ' A' ' 25' ' ' LYS . 11.3 t -104.89 167.19 2.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-O 120.871 0.367 . . . . 0.0 110.538 179.726 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.558 ' N ' HG12 ' A' ' 24' ' ' VAL . 99.3 mttt -135.23 120.95 19.53 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.534 179.62 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.466 HG23 ' O ' ' A' ' 26' ' ' VAL . 17.2 m -120.53 116.12 49.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.551 -179.769 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 29.9 pttt -108.67 166.93 10.43 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.541 179.953 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 98.4 m-85 -47.29 -40.01 15.86 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.551 179.384 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -57.99 -23.38 53.7 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.609 179.547 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 54.9 t0 -62.08 -43.79 98.08 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.548 -179.647 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.525 ' O ' ' CB ' ' A' ' 35' ' ' PHE . 5.6 mp -66.48 -43.45 85.38 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.588 179.545 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.431 ' O ' ' OD2' ' A' ' 36' ' ' ASP . 35.4 mt -58.4 -42.44 87.18 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.508 -177.852 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 85.3 tttt -86.33 -51.69 6.08 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.577 -178.229 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 57.6 t80 -61.7 -49.53 76.11 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.543 -177.669 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.525 ' CB ' ' O ' ' A' ' 31' ' ' LEU . 6.7 t80 -62.26 -44.83 95.66 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.593 -178.398 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . 0.431 ' OD2' ' O ' ' A' ' 32' ' ' LEU . 98.4 m-20 -66.95 -35.45 80.0 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.45 -179.644 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 2.3 m-85 -61.18 -52.56 64.29 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.558 -178.642 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.561 ' O ' ' N ' ' A' ' 42' ' ' CYS . 23.0 m -68.06 -38.89 80.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.623 -178.442 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -61.62 -25.94 67.67 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.517 -179.067 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 67.3 t0 -55.61 -55.3 33.69 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.49 -178.693 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.506 ' O ' ' SG ' ' A' ' 42' ' ' CYS . 15.5 p -115.35 -2.65 12.58 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.561 -178.517 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . 0.561 ' N ' ' O ' ' A' ' 38' ' ' VAL . 23.1 p 38.25 59.25 5.05 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.558 -179.418 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.418 ' C ' ' H ' ' A' ' 45' ' ' PHE . 64.8 Cg_endo -77.12 -23.97 9.99 Favored 'Trans proline' 0 C--N 1.305 -1.72 0 C-N-CA 122.871 2.38 . . . . 0.0 112.142 -179.57 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . 0.534 ' CZ3' ' CE3' ' A' ' 56' ' ' TRP . 0.0 OUTLIER -69.36 5.1 1.41 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.569 -179.477 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.418 ' H ' ' C ' ' A' ' 43' ' ' PRO . 38.4 t80 48.2 57.56 17.97 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.572 179.79 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 23.2 Cg_endo -61.0 -7.09 7.18 Favored 'Trans proline' 0 C--N 1.305 -1.74 0 C-N-CA 122.758 2.305 . . . . 0.0 112.16 -178.777 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 82.6 mt-30 -54.7 -52.91 60.95 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.541 -179.796 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.492 ' O ' ' H51' ' A' ' 201' ' ' MYR . 43.8 tp10 -89.68 -27.69 19.95 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.619 179.317 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . 0.5 ' O ' ' H71' ' A' ' 201' ' ' MYR . . . 85.73 66.04 1.43 Allowed Glycine 0 CA--C 1.525 0.671 0 N-CA-C 110.978 -0.849 . . . . 0.0 110.978 -178.847 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 10.7 t -132.77 170.2 15.61 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.788 0.327 . . . . 0.0 110.584 -179.449 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.463 ' HA ' H142 ' A' ' 201' ' ' MYR . 1.8 mt -93.66 141.55 14.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.549 179.532 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . 0.522 ' H ' ' HE1' ' A' ' 44' ' ' TRP . 1.2 m-20 -114.51 122.76 47.56 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.542 179.784 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.47 ' CG1' HD12 ' A' ' 90' ' ' ILE . 25.2 mm -96.16 -55.75 5.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.648 179.648 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 67.8 mttm -73.34 -49.26 28.29 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.569 -178.978 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -62.16 -32.01 72.58 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.561 -178.555 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' TRP . . . . . 0.534 ' CE3' ' CZ3' ' A' ' 44' ' ' TRP . 13.0 t-105 -62.86 -38.28 90.2 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.557 179.304 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -64.31 -36.4 83.98 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.523 -179.728 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 94.6 mtt180 -60.54 -53.4 57.93 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.591 -179.294 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.429 HG13 ' N ' ' A' ' 60' ' ' GLY . 2.6 p -66.96 -42.72 89.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.629 -179.862 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . 0.429 ' N ' HG13 ' A' ' 59' ' ' VAL . . . -62.72 -37.77 95.37 Favored Glycine 0 CA--C 1.525 0.707 0 N-CA-C 110.915 -0.874 . . . . 0.0 110.915 179.695 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 95.4 m-20 -65.88 -40.37 91.55 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.878 0.371 . . . . 0.0 110.602 -179.238 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 76.7 m -63.34 -57.18 11.2 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.568 -178.927 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 37.8 m-85 -64.4 -42.67 95.96 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.62 -179.153 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 55.8 tt0 -63.92 -34.43 77.95 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.558 -179.345 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.401 ' O ' HG23 ' A' ' 69' ' ' THR . 41.2 t0 -60.33 -53.44 57.62 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.597 -179.945 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 65.7 m-85 -69.81 -39.19 76.67 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.507 179.962 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 69.5 t80 -60.55 -41.07 93.77 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.586 -179.844 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . 0.452 ' OD1' ' O ' ' A' ' 72' ' ' PRO . 51.2 t-20 -65.36 -45.52 83.83 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.536 -179.387 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.401 HG23 ' O ' ' A' ' 65' ' ' ASP . 80.4 p -68.87 -16.78 63.86 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.594 -179.185 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 2.3 m-85 -76.02 -5.66 47.45 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.596 -179.325 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . 0.493 ' O ' ' N ' ' A' ' 73' ' ' GLU . . . 153.94 -67.14 0.31 Allowed Glycine 0 CA--C 1.525 0.715 0 N-CA-C 110.912 -0.875 . . . . 0.0 110.912 179.535 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . 0.452 ' O ' ' OD1' ' A' ' 68' ' ' ASN . 38.6 Cg_exo -39.69 88.12 0.01 OUTLIER 'Trans proline' 0 C--N 1.304 -1.812 0 C-N-CA 122.815 2.344 . . . . 0.0 112.114 -176.874 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.493 ' N ' ' O ' ' A' ' 71' ' ' GLY . 83.2 tt0 -66.24 -34.65 78.49 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.576 179.589 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.7 ' CD ' ' H ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -97.0 -16.72 20.46 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.549 179.9 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.511 ' O ' ' O ' ' A' ' 74' ' ' LYS . 19.8 t 57.4 132.04 0.02 OUTLIER Pre-proline 0 C--N 1.329 -0.323 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.526 179.447 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 41.1 Cg_exo -50.44 123.65 11.68 Favored 'Trans proline' 0 C--N 1.305 -1.737 0 C-N-CA 122.864 2.376 . . . . 0.0 112.101 178.352 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.417 ' O ' ' N ' ' A' ' 80' ' ' PHE . 40.6 t -81.79 -20.33 10.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.531 -179.795 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . 0.41 ' O ' ' OG ' ' A' ' 81' ' ' SER . 22.7 p -43.1 -24.8 0.09 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.585 178.815 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.91 -37.74 86.88 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.534 179.92 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . 0.417 ' N ' ' O ' ' A' ' 77' ' ' VAL . 2.5 m-85 -63.1 -37.17 86.16 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.601 -179.263 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . 0.41 ' OG ' ' O ' ' A' ' 78' ' ' THR . 93.3 p -58.62 -39.6 80.94 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.574 -179.727 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 11.2 m-85 -61.17 -47.73 84.82 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.601 179.688 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' TRP . . . . . 0.422 ' O ' ' CB ' ' A' ' 87' ' ' LYS . 40.0 t90 -59.19 -37.82 78.35 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.568 -179.528 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 97.5 m-20 -61.24 -47.04 87.87 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.549 -178.598 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 25.4 tp -72.27 -55.44 7.17 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.563 179.782 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -56.11 -25.37 19.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.567 179.506 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.422 ' CB ' ' O ' ' A' ' 83' ' ' TRP . 57.1 tttt -67.56 -50.78 56.89 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.61 179.467 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . 0.469 ' C ' ' CD ' ' A' ' 88' ' ' GLU . 0.9 OUTLIER -78.96 -20.17 49.89 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.551 -179.873 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.581 ' O ' HD13 ' A' ' 89' ' ' LEU . 0.2 OUTLIER -60.29 -49.42 77.66 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.535 179.845 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.47 HD12 ' CG1' ' A' ' 53' ' ' ILE . 3.3 mt -63.79 -41.09 91.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.56 179.21 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 97.5 m-20 -69.18 -16.43 63.62 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.572 -179.409 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 70.4 tttt -68.4 140.97 55.83 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.561 -179.886 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -70.9 -4.56 25.05 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.488 -179.522 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 27.5 tp10 -84.57 46.78 1.27 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.562 -179.579 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 34.1 m -125.83 132.91 70.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.519 -179.807 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' ASN . . . . . 0.587 ' O ' ' N ' ' A' ' 98' ' ' GLN . 10.1 m-20 -87.18 157.58 53.54 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.548 -179.249 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_exo -41.35 -13.24 0.03 OUTLIER 'Trans proline' 0 C--N 1.305 -1.733 0 C-N-CA 122.812 2.341 . . . . 0.0 112.147 178.785 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . 0.587 ' N ' ' O ' ' A' ' 96' ' ' ASN . 6.9 pt20 -51.75 -34.45 39.36 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.554 179.951 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 90.4 t -64.52 -51.12 71.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.58 179.348 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 81.5 mtp -68.68 -38.35 80.28 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.563 179.907 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -59.36 -27.7 66.18 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.587 -179.854 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -61.72 -16.11 46.4 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.604 179.732 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 83.1 t -64.77 -19.09 24.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.525 179.719 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -55.64 -38.76 69.95 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.502 -179.934 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 77.0 mt-30 45.55 -115.36 0.51 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.559 -179.714 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 28.9 m -64.49 133.26 52.07 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.556 -179.89 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 86.9 mt-10 -124.19 -175.61 3.29 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.519 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . 0.55 ' O ' ' N ' ' A' ' 110' ' ' LEU . 73.8 mm-40 -106.58 122.45 46.34 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.553 179.373 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . 0.418 ' O ' ' OG ' ' A' ' 112' ' ' SER . 43.8 pt -45.49 -12.87 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.595 179.869 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.55 ' N ' ' O ' ' A' ' 108' ' ' GLU . 25.6 mt -67.11 -44.94 78.68 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.509 179.843 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 62.4 tttm -65.34 -33.86 76.96 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.566 -179.605 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . 0.418 ' OG ' ' O ' ' A' ' 109' ' ' ILE . 97.0 p -63.57 -46.83 84.09 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.551 -179.813 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 31.7 t30 -65.57 -42.45 91.79 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.588 179.608 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . 0.444 ' C ' ' H ' ' A' ' 116' ' ' THR . 22.8 t -164.51 132.57 3.38 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.552 179.994 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 86.6 mt-30 -77.94 27.65 0.18 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.54 179.984 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . 0.444 ' H ' ' C ' ' A' ' 114' ' ' SER . 7.8 m -61.22 -41.3 96.62 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.557 179.914 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . 0.522 ' C ' HD12 ' A' ' 118' ' ' LEU . 95.0 m-20 -59.93 -44.96 94.02 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.592 179.656 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.522 HD12 ' C ' ' A' ' 117' ' ' ASP . 10.8 mp -106.38 29.46 6.82 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.626 -179.708 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 72.0 tt0 -46.32 131.26 10.65 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.565 179.949 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 94.8 m-70 -112.4 139.07 48.28 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.538 -179.84 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 121' ' ' HIS . . . . . 0.443 ' O ' ' NE2' ' A' ' 124' ' ' HIS . 96.4 m-70 -107.7 141.08 39.78 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.572 179.284 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 75.1 m80 -65.08 -37.04 86.22 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.543 179.701 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 62.6 t60 -119.88 122.48 41.37 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.524 -179.904 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 124' ' ' HIS . . . . . 0.443 ' NE2' ' O ' ' A' ' 121' ' ' HIS . 96.1 m-70 -107.96 134.13 51.3 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.534 179.723 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 89.1 m-70 . . . . . 0 C--O 1.219 -0.512 0 CA-C-O 117.999 -1.0 . . . . 0.0 110.571 179.981 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 201' ' ' MYR . . . . . 0.601 H112 ' CE1' ' A' ' 8' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.704 0 N-CA-C 110.941 -0.864 . . . . 0.0 110.941 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 52.3 tt0 -63.14 -29.38 70.75 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.871 0.367 . . . . 0.0 110.444 -179.827 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 95.2 mt-10 -55.97 -22.98 29.52 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.651 179.811 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 43.2 tp -44.23 -35.3 2.2 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.511 -179.525 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 78.2 p -55.03 -35.14 64.13 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.641 -0.423 . . . . 0.0 109.92 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 68.2 tp60 -64.11 -35.57 81.17 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.181 179.561 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . 0.579 ' ND1' ' H81' ' A' ' 201' ' ' MYR . 83.2 t60 -60.28 -44.62 95.18 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.257 179.988 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -58.78 -46.53 87.3 Favored 'General case' 0 C--O 1.241 0.613 0 C-N-CA 120.522 -0.471 . . . . 0.0 110.183 -179.923 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.443 ' O ' ' CB ' ' A' ' 14' ' ' GLN . 87.2 mtt-85 -67.21 -36.53 81.92 Favored 'General case' 0 C--O 1.21 -1.008 0 N-CA-C 109.322 -0.622 . . . . 0.0 109.322 179.607 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.472 ' CD2' H122 ' A' ' 201' ' ' MYR . 20.3 t80 -57.87 -27.9 63.67 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 120.878 -0.329 . . . . 0.0 110.313 -179.433 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 6.7 t -73.8 -51.16 25.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 C-N-CA 120.241 -0.584 . . . . 0.0 111.109 179.69 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -81.49 -23.72 37.17 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.084 0.469 . . . . 0.0 111.635 -179.329 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . 0.443 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 66.5 tp60 -77.49 -53.57 7.47 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.978 -179.117 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.572 HD13 ' O ' ' A' ' 15' ' ' LEU . 0.2 OUTLIER -63.47 -45.4 90.98 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-O 120.896 0.379 . . . . 0.0 110.062 -179.907 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.552 ' HB3' HG11 ' A' ' 26' ' ' VAL . 98.3 mttt -59.99 -36.22 76.7 Favored 'General case' 0 C--O 1.232 0.145 0 C-N-CA 120.617 -0.433 . . . . 0.0 109.953 179.568 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 73.9 mt-30 -72.94 -40.33 65.48 Favored 'General case' 0 C--O 1.238 0.453 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.632 178.738 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -57.33 -26.57 61.14 Favored 'General case' 0 CA--C 1.518 -0.256 0 CA-C-N 115.918 -0.583 . . . . 0.0 109.97 179.935 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 4.2 mt -84.71 -40.96 16.71 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.846 -0.342 . . . . 0.0 110.452 178.949 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 28.8 mtmt -45.45 -44.2 12.04 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.124 -178.885 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.447 ' H ' HG22 ' A' ' 21' ' ' THR . 0.1 OUTLIER -58.5 -34.33 70.82 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 120.422 -0.511 . . . . 0.0 110.425 -179.5 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 84.2 mmt-85 -66.56 -7.09 17.72 Favored 'General case' 0 C--N 1.332 -0.195 0 C-N-CA 120.656 -0.418 . . . . 0.0 110.295 -179.881 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 107.22 23.7 6.87 Favored Glycine 0 CA--C 1.526 0.778 0 N-CA-C 111.021 -0.832 . . . . 0.0 111.021 -179.721 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.66 HG12 ' N ' ' A' ' 25' ' ' LYS . 38.6 t -102.89 169.32 1.96 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 N-CA-C 110.337 -0.246 . . . . 0.0 110.337 -179.991 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.66 ' N ' HG12 ' A' ' 24' ' ' VAL . 99.0 mttt -134.65 131.82 38.22 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.985 -0.376 . . . . 0.0 109.985 179.268 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.552 HG11 ' HB3' ' A' ' 16' ' ' LYS . 28.4 m -122.88 129.23 75.26 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.285 0 N-CA-C 109.989 -0.374 . . . . 0.0 109.989 179.887 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 23.7 ttmt -109.53 159.99 16.61 Favored 'General case' 0 N--CA 1.463 0.18 0 N-CA-C 110.065 -0.346 . . . . 0.0 110.065 179.585 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -50.61 -31.77 16.93 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.001 0.429 . . . . 0.0 109.867 179.341 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -55.34 -23.31 23.29 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.225 179.414 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.423 ' O ' ' CB ' ' A' ' 34' ' ' PHE . 86.0 m-20 -61.2 -48.15 82.84 Favored 'General case' 0 C--O 1.219 -0.512 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.56 -179.525 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.495 ' O ' ' CB ' ' A' ' 35' ' ' PHE . 5.3 mp -66.07 -41.45 90.74 Favored 'General case' 0 C--O 1.216 -0.708 0 C-N-CA 120.571 -0.452 . . . . 0.0 110.385 179.469 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 37.8 mt -58.97 -46.3 88.45 Favored 'General case' 0 C--N 1.313 -0.99 0 C-N-CA 119.468 -0.893 . . . . 0.0 111.176 -178.013 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.441 ' O ' ' CB ' ' A' ' 37' ' ' PHE . 87.9 tttt -85.49 -48.17 9.22 Favored 'General case' 0 C--N 1.319 -0.754 0 C-N-CA 120.553 -0.459 . . . . 0.0 112.091 -178.692 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . 0.825 ' O ' HG22 ' A' ' 38' ' ' VAL . 44.0 t80 -63.54 -48.07 79.04 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.376 -178.993 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.495 ' CB ' ' O ' ' A' ' 31' ' ' LEU . 18.4 t80 -61.85 -48.41 80.68 Favored 'General case' 0 C--N 1.33 -0.242 0 C-N-CA 120.475 -0.49 . . . . 0.0 110.363 -179.146 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 65.8 t0 -72.96 -34.8 66.72 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 120.474 -0.49 . . . . 0.0 111.462 -179.803 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.712 ' CZ ' HG22 ' A' ' 59' ' ' VAL . 4.3 t80 -60.99 -48.5 81.55 Favored 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 120.984 -0.286 . . . . 0.0 111.635 -178.296 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.825 HG22 ' O ' ' A' ' 34' ' ' PHE . 15.4 m -74.6 -36.93 42.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 C-N-CA 120.408 -0.517 . . . . 0.0 110.688 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -55.7 -29.79 60.02 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.867 -179.813 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 68.0 t0 -47.03 -61.49 1.85 Allowed 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 120.646 -0.421 . . . . 0.0 110.745 -179.744 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 13.9 p -114.8 2.01 14.27 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.345 -0.388 . . . . 0.0 111.049 179.822 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . 0.539 ' N ' ' O ' ' A' ' 38' ' ' VAL . 1.9 m 38.07 58.59 4.9 Favored Pre-proline 0 CA--C 1.534 0.364 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.831 -178.706 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.49 ' C ' ' H ' ' A' ' 45' ' ' PHE . 26.9 Cg_exo -63.39 -36.97 52.32 Favored 'Trans proline' 0 N--CA 1.5 1.885 0 C-N-CA 122.617 2.211 . . . . 0.0 112.857 -179.069 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . 0.829 ' HE1' ' H ' ' A' ' 52' ' ' ASP . 0.0 OUTLIER -66.45 6.19 0.48 Allowed 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.62 -179.281 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.493 ' C ' ' H ' ' A' ' 47' ' ' GLN . 19.8 m-85 44.25 56.48 13.51 Favored Pre-proline 0 C--N 1.33 -0.24 0 N-CA-C 109.887 -0.412 . . . . 0.0 109.887 -179.832 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.494 ' O ' ' H42' ' A' ' 201' ' ' MYR . 10.2 Cg_endo -51.27 -6.34 0.12 Allowed 'Trans proline' 0 N--CA 1.493 1.445 0 C-N-CA 122.773 2.316 . . . . 0.0 111.917 179.929 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.493 ' H ' ' C ' ' A' ' 45' ' ' PHE . 95.9 mm-40 -62.72 -52.04 64.82 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.128 -179.913 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.482 ' N ' ' CD ' ' A' ' 48' ' ' GLU . 0.0 OUTLIER -88.0 -31.82 19.14 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-O 121.04 0.448 . . . . 0.0 110.169 178.973 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 85.7 66.18 1.42 Allowed Glycine 0 CA--C 1.523 0.554 0 N-CA-C 110.616 -0.994 . . . . 0.0 110.616 -178.731 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 14.8 t -125.98 170.24 11.91 Favored 'General case' 0 CA--C 1.517 -0.305 0 CA-C-O 120.679 0.276 . . . . 0.0 110.772 -179.502 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.445 HD11 ' OH ' ' A' ' 11' ' ' TYR . 1.3 mt -102.36 138.88 25.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.198 179.814 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . 0.829 ' H ' ' HE1' ' A' ' 44' ' ' TRP . 84.2 m-20 -114.28 122.15 45.84 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.726 179.644 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.504 ' CG1' HD12 ' A' ' 90' ' ' ILE . 29.9 mm -94.63 -55.86 5.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.506 179.735 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -78.01 -50.48 12.02 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-O 121.032 0.444 . . . . 0.0 111.707 -179.06 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 93.1 mtt-85 -59.47 -32.01 69.85 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.082 -0.508 . . . . 0.0 109.863 -179.64 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' TRP . . . . . 0.573 ' CE3' ' CH2' ' A' ' 44' ' ' TRP . 23.2 t-105 -60.7 -40.81 93.64 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.449 179.098 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 92.5 mtm-85 -63.28 -33.63 75.93 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 120.291 -0.564 . . . . 0.0 109.831 179.92 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 74.0 ttt180 -60.41 -52.47 65.1 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 120.315 -0.554 . . . . 0.0 110.853 -179.571 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.712 HG22 ' CZ ' ' A' ' 37' ' ' PHE . 4.3 p -69.0 -42.8 82.26 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.571 0 CA-C-O 120.71 0.29 . . . . 0.0 110.567 179.48 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . 0.435 ' O ' ' CB ' ' A' ' 64' ' ' GLN . . . -65.27 -47.58 78.72 Favored Glycine 0 CA--C 1.525 0.688 0 CA-C-N 116.297 -0.41 . . . . 0.0 112.337 -178.945 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 96.9 m-20 -60.98 -40.76 94.65 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.784 0.292 . . . . 0.0 111.296 -178.552 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 70.7 m -61.72 -59.92 4.45 Favored 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 120.708 -0.397 . . . . 0.0 111.467 -179.299 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 15.4 m-85 -65.72 -42.71 90.75 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.342 -179.805 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . 0.473 ' HG2' HD21 ' A' ' 68' ' ' ASN . 58.2 tt0 -61.17 -41.31 96.57 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.388 -179.458 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 24.8 t0 -55.46 -56.78 16.19 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.872 0.368 . . . . 0.0 110.906 -179.757 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 50.5 m-85 -64.57 -43.31 94.3 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 120.57 -0.452 . . . . 0.0 110.421 179.664 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 64.7 t80 -52.65 -42.33 64.58 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.596 -179.351 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . 0.473 HD21 ' HG2' ' A' ' 64' ' ' GLN . 19.3 m-20 -62.77 -42.51 99.72 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.421 -179.298 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 25.0 p -71.67 -16.46 62.25 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.495 -179.992 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -87.35 12.83 11.04 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.769 -179.632 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 152.06 -79.17 0.2 Allowed Glycine 0 CA--C 1.53 0.98 0 C-N-CA 120.384 -0.912 . . . . 0.0 112.322 179.039 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_exo -40.59 100.84 0.03 OUTLIER 'Trans proline' 0 C--N 1.307 -1.642 0 C-N-CA 122.712 2.275 . . . . 0.0 112.06 -178.514 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 80.2 mm-40 -73.47 -42.76 61.51 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.655 -0.702 . . . . 0.0 109.928 179.19 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.668 ' CD ' ' H ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -94.95 -13.39 25.38 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.091 179.779 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.485 ' O ' ' O ' ' A' ' 74' ' ' LYS . 36.4 t 56.22 123.77 0.01 OUTLIER Pre-proline 0 CA--C 1.544 0.715 0 O-C-N 123.143 0.277 . . . . 0.0 111.416 -179.938 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_exo -53.24 128.04 27.56 Favored 'Trans proline' 0 N--CA 1.495 1.616 0 C-N-CA 121.166 1.244 . . . . 0.0 112.251 179.232 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.453 ' O ' ' N ' ' A' ' 80' ' ' PHE . 59.8 t -82.84 -18.42 10.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 115.38 -0.827 . . . . 0.0 110.65 179.211 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 62.7 p -42.98 -24.23 0.06 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.924 0.392 . . . . 0.0 110.433 -179.621 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . 0.436 ' N ' ' O ' ' A' ' 77' ' ' VAL . . . -64.88 -37.88 89.09 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.784 179.642 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . 0.453 ' N ' ' O ' ' A' ' 77' ' ' VAL . 3.7 m-85 -58.94 -33.14 70.25 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.418 -179.744 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 39.0 t -60.3 -42.94 96.59 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.115 179.708 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 -59.69 -49.91 75.92 Favored 'General case' 0 CA--C 1.517 -0.311 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.586 179.722 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' TRP . . . . . 0.471 ' C ' ' CD1' ' A' ' 83' ' ' TRP . 8.3 t-105 -54.51 -40.38 68.51 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.733 -179.826 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 87.6 m-20 -61.98 -44.84 95.9 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 120.461 -0.496 . . . . 0.0 111.153 -179.404 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 29.9 tp -73.29 -55.08 6.9 Favored 'General case' 0 C--O 1.222 -0.377 0 C-N-CA 120.31 -0.556 . . . . 0.0 110.565 179.569 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -55.58 -25.77 18.54 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 C-N-CA 120.591 -0.444 . . . . 0.0 110.406 179.921 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 67.4 tttt -67.4 -50.68 58.49 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.656 179.648 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . 0.413 ' OE1' ' O ' ' A' ' 88' ' ' GLU . 1.1 pp20? -79.76 -20.02 47.3 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.745 -0.661 . . . . 0.0 111.113 -179.077 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.531 ' O ' HD13 ' A' ' 89' ' ' LEU . 0.2 OUTLIER -62.05 -46.3 89.76 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 120.66 -0.416 . . . . 0.0 110.227 -179.446 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.504 HD12 ' CG1' ' A' ' 53' ' ' ILE . 3.8 mt -64.69 -43.05 96.61 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.215 0 C-N-CA 120.184 -0.606 . . . . 0.0 109.85 -179.662 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -54.92 -42.83 72.7 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.974 -178.758 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 58.9 mmtt -48.32 131.13 16.71 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 120.668 -0.413 . . . . 0.0 110.4 -179.991 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -63.57 -37.43 87.29 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.603 179.854 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 70.5 tt0 -69.92 54.98 0.13 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.347 -179.625 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 35.5 m -70.44 155.51 7.58 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-O 120.946 0.403 . . . . 0.0 110.057 -179.948 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' ASN . . . . . . . . . . . . . 1.3 m-20 -59.28 160.42 12.63 Favored Pre-proline 0 C--N 1.325 -0.476 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.873 -179.289 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -60.02 -10.83 13.46 Favored 'Trans proline' 0 N--CA 1.494 1.503 0 C-N-CA 123.101 2.534 . . . . 0.0 111.941 179.391 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . 0.479 ' O ' ' HB2' ' A' ' 102' ' ' ALA . 5.0 pt20 -44.36 -26.98 0.38 Allowed 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.869 -179.412 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 85.9 t -65.1 -50.65 73.25 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 C-N-CA 120.434 -0.507 . . . . 0.0 110.578 -179.628 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 96.7 mtp -80.79 -39.11 27.3 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.819 179.645 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -64.93 -31.79 73.19 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.087 -179.527 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . 0.479 ' HB2' ' O ' ' A' ' 98' ' ' GLN . . . -62.95 -14.62 49.47 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.736 0.303 . . . . 0.0 110.464 -179.853 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 75.8 t -60.97 -21.83 25.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.448 179.72 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -57.71 -38.28 74.99 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.483 -179.892 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 58.3 tt0 -91.29 96.35 10.5 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.405 179.775 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 3.6 t -147.26 158.19 43.87 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.635 179.973 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 89.9 mt-10 -89.0 149.17 23.38 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.459 -179.822 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . 0.522 ' C ' ' H ' ' A' ' 110' ' ' LEU . 97.0 mt-10 -73.84 139.16 44.89 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 120.378 -0.529 . . . . 0.0 109.655 179.092 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 26.7 pt -54.86 -5.21 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.127 179.452 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.622 ' O ' HD12 ' A' ' 110' ' ' LEU . 3.4 pp -170.35 120.05 0.59 Allowed 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 116.251 -0.431 . . . . 0.0 109.99 179.789 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . 0.448 ' HG3' ' H ' ' A' ' 114' ' ' SER . 25.5 pttm -139.4 151.12 46.03 Favored 'General case' 0 C--O 1.231 0.124 0 CA-C-O 120.67 0.271 . . . . 0.0 110.377 -179.512 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 88.1 p -60.42 -22.28 63.21 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.667 -179.358 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 39.7 t30 -64.63 -40.81 96.11 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.682 179.73 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . 0.448 ' H ' ' HG3' ' A' ' 111' ' ' LYS . 23.3 t -117.64 -68.0 0.95 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.917 179.991 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 9.3 mt-30 41.31 86.48 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.034 0.445 . . . . 0.0 110.744 -179.73 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 72.0 p -74.28 -22.86 59.11 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.009 -0.542 . . . . 0.0 110.353 179.869 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 97.7 m-20 -83.44 -66.8 0.85 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.6 179.855 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 43.5 mt -63.44 -41.66 98.67 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.855 -179.89 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 94.0 mt-10 52.79 -170.78 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.701 -179.695 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 77.1 m-70 -66.52 -39.38 88.59 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.742 179.96 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 99.2 m-70 -112.71 149.05 33.46 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.601 -179.908 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 96.2 m-70 -63.93 -39.8 94.99 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.577 -179.771 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 75.6 m80 -113.41 149.06 34.67 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.549 -179.89 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 124' ' ' HIS . . . . . . . . . . . . . 85.2 m-70 -62.63 -43.64 98.3 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.782 -179.948 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 97.6 m-70 . . . . . 0 C--O 1.22 -0.489 0 CA-C-O 118.029 -0.986 . . . . 0.0 110.522 -179.896 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 201' ' ' MYR . . . . . 0.579 ' H81' ' ND1' ' A' ' 8' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.704 0 N-CA-C 110.958 -0.857 . . . . 0.0 110.958 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 77.5 mt-30 -58.27 -31.31 67.33 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.898 0.38 . . . . 0.0 110.624 -179.921 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.431 ' OE1' ' OE1' ' A' ' 7' ' ' GLN . 78.0 mm-40 -51.91 -23.48 5.0 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.284 -179.945 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 37.2 tp -42.84 -27.2 0.17 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.439 -179.406 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 37.6 t -59.68 -41.64 91.14 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.15 179.661 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . 0.431 ' OE1' ' OE1' ' A' ' 4' ' ' GLU . 89.1 mt-30 -61.96 -30.19 70.75 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.569 179.827 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 84.5 t60 -63.46 -44.83 93.33 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.822 0.344 . . . . 0.0 110.359 179.932 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 80.5 tt0 -59.66 -50.13 75.04 Favored 'General case' 0 C--O 1.243 0.721 0 CA-C-O 121.361 0.6 . . . . 0.0 110.352 179.7 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.43 ' O ' ' CB ' ' A' ' 14' ' ' GLN . 86.2 mtt180 -62.44 -33.18 74.3 Favored 'General case' 0 C--O 1.211 -0.956 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 179.55 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.532 ' CE1' H143 ' A' ' 201' ' ' MYR . 31.7 t80 -58.89 -36.4 74.59 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 110.175 -0.305 . . . . 0.0 110.175 -179.588 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.406 HG11 ' CD2' ' A' ' 31' ' ' LEU . 3.6 t -64.36 -49.66 79.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 C-N-CA 119.987 -0.685 . . . . 0.0 111.488 179.997 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -81.08 -30.74 34.62 Favored 'General case' 0 C--N 1.324 -0.523 0 C-N-CA 120.582 -0.447 . . . . 0.0 111.826 -179.357 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . 0.43 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 60.5 tp60 -74.23 -52.17 13.18 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.916 -0.583 . . . . 0.0 110.896 -178.982 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.568 HD13 ' O ' ' A' ' 15' ' ' LEU . 0.2 OUTLIER -62.91 -44.21 96.7 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 120.407 -0.517 . . . . 0.0 109.809 -179.557 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.662 ' HB3' HG21 ' A' ' 26' ' ' VAL . 66.0 mttm -59.53 -34.4 72.6 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.848 0.356 . . . . 0.0 110.198 179.091 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 35.8 mm-40 -66.58 -42.01 87.65 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.489 0.661 . . . . 0.0 110.022 179.038 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.624 ' O ' HG22 ' A' ' 21' ' ' THR . . . -61.39 -28.66 69.4 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.912 -0.585 . . . . 0.0 109.732 179.277 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.9 mt -74.19 -33.85 63.56 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.933 0.397 . . . . 0.0 110.652 178.651 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 67.8 mttm -54.56 -37.33 65.34 Favored 'General case' 0 C--N 1.323 -0.548 0 C-N-CA 120.188 -0.605 . . . . 0.0 109.883 -179.775 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.624 HG22 ' O ' ' A' ' 18' ' ' ALA . 1.2 t -60.57 -28.1 68.2 Favored 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 120.397 -0.521 . . . . 0.0 110.863 179.37 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 7.7 mmm180 -80.2 12.79 2.65 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-O 120.98 0.419 . . . . 0.0 110.584 -179.567 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 81.04 14.0 80.1 Favored Glycine 0 CA--C 1.522 0.514 0 N-CA-C 110.491 -1.044 . . . . 0.0 110.491 -179.8 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.581 HG12 ' N ' ' A' ' 25' ' ' LYS . 37.9 t -86.83 165.34 2.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 C-N-CA 120.981 -0.287 . . . . 0.0 110.446 -179.706 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.581 ' N ' HG12 ' A' ' 24' ' ' VAL . 99.1 mttt -139.12 129.61 25.76 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 120.916 -0.314 . . . . 0.0 110.235 179.429 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.662 HG21 ' HB3' ' A' ' 16' ' ' LYS . 13.7 m -126.74 130.89 71.57 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.239 0 N-CA-C 109.943 -0.391 . . . . 0.0 109.943 179.584 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.55 ' N ' ' OD2' ' A' ' 30' ' ' ASP . 10.9 ttmt -109.16 161.78 14.89 Favored 'General case' 0 C--O 1.221 -0.401 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 179.674 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.411 ' H ' ' HG2' ' A' ' 27' ' ' LYS . 98.4 m-85 -41.89 -33.28 0.51 Allowed 'General case' 0 C--O 1.236 0.392 0 CA-C-O 121.101 0.477 . . . . 0.0 110.796 179.646 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.401 ' HA ' HD12 ' A' ' 32' ' ' LEU . . . -55.7 -22.45 23.52 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.525 179.702 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.55 ' OD2' ' N ' ' A' ' 27' ' ' LYS . 3.2 m-20 -58.55 -49.48 77.27 Favored 'General case' 0 CA--C 1.516 -0.364 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.281 -179.396 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.5 ' O ' ' CB ' ' A' ' 35' ' ' PHE . 4.9 mp -67.21 -41.27 86.05 Favored 'General case' 0 C--O 1.215 -0.75 0 CA-C-O 120.985 0.421 . . . . 0.0 110.242 179.273 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.448 ' O ' ' OD1' ' A' ' 36' ' ' ASP . 40.8 mt -59.04 -44.97 91.84 Favored 'General case' 0 C--N 1.315 -0.927 0 C-N-CA 119.692 -0.803 . . . . 0.0 111.246 -178.238 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.527 ' O ' ' CD1' ' A' ' 37' ' ' PHE . 88.6 tttt -84.53 -37.79 20.82 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.939 -178.658 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . 0.581 ' O ' HG22 ' A' ' 38' ' ' VAL . 62.4 t80 -78.07 -51.03 10.93 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.393 -178.681 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.5 ' CB ' ' O ' ' A' ' 31' ' ' LEU . 12.9 t80 -60.07 -46.55 89.19 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.389 -179.327 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . 0.468 ' OD1' ' O ' ' A' ' 33' ' ' LYS . 3.7 p-10 -70.28 -31.37 68.7 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 120.216 -0.594 . . . . 0.0 111.198 -179.438 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.527 ' CD1' ' O ' ' A' ' 33' ' ' LYS . 1.4 m-85 -60.68 -55.62 31.07 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-O 120.73 0.3 . . . . 0.0 111.673 -179.037 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.581 HG22 ' O ' ' A' ' 34' ' ' PHE . 5.3 m -69.7 -37.65 74.38 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 C-N-CA 120.556 -0.458 . . . . 0.0 110.717 -179.565 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 65.5 tttm -56.92 -27.61 61.07 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.57 -179.822 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 93.4 m-20 -50.6 -62.98 1.27 Allowed 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 120.685 -0.406 . . . . 0.0 110.63 -179.546 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.492 ' O ' ' SG ' ' A' ' 42' ' ' CYS . 24.9 p -115.05 8.99 15.87 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.293 -179.943 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . 0.521 ' N ' ' O ' ' A' ' 38' ' ' VAL . 7.4 p 38.42 59.14 5.24 Favored Pre-proline 0 N--CA 1.465 0.279 0 CA-C-O 120.883 0.373 . . . . 0.0 110.679 -179.529 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.49 ' C ' ' H ' ' A' ' 45' ' ' PHE . 57.5 Cg_endo -74.21 -28.1 10.99 Favored 'Trans proline' 0 C--N 1.31 -1.499 0 C-N-CA 122.79 2.327 . . . . 0.0 112.445 -179.619 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . 0.527 ' NE1' H132 ' A' ' 201' ' ' MYR . 0.6 OUTLIER -62.28 1.37 0.33 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.603 -179.469 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.544 ' O ' ' N ' ' A' ' 47' ' ' GLN . 60.8 m-85 50.44 55.61 16.81 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.44 -179.277 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.425 ' CD ' ' N ' ' A' ' 45' ' ' PHE . 70.1 Cg_exo -42.14 -14.82 0.05 OUTLIER 'Trans proline' 0 C--N 1.307 -1.627 0 C-N-CA 122.849 2.366 . . . . 0.0 112.218 179.644 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.773 ' O ' ' H31' ' A' ' 201' ' ' MYR . 87.1 mt-30 -65.98 -53.07 43.64 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.248 -179.27 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.727 ' O ' ' H51' ' A' ' 201' ' ' MYR . 65.8 tt0 -88.87 -30.21 19.07 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.373 178.599 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . 0.41 ' O ' ' H71' ' A' ' 201' ' ' MYR . . . 73.78 50.64 10.74 Favored Glycine 0 CA--C 1.526 0.764 0 N-CA-C 110.383 -1.087 . . . . 0.0 110.383 -179.239 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . 0.493 ' OG1' ' NE2' ' A' ' 98' ' ' GLN . 15.0 t -107.68 160.71 15.49 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.842 0.354 . . . . 0.0 110.744 -179.468 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.434 ' HB ' HD11 ' A' ' 90' ' ' ILE . 1.5 mt -89.71 137.35 21.59 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-O 121.143 0.497 . . . . 0.0 110.593 179.452 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 57.9 m-20 -108.18 120.77 43.29 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.435 -0.802 . . . . 0.0 111.328 179.227 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.475 ' CG1' HD12 ' A' ' 90' ' ' ILE . 30.2 mm -95.03 -57.01 4.68 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.255 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.17 179.166 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -77.09 -49.03 16.21 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-O 121.076 0.465 . . . . 0.0 111.215 -179.659 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 84.5 mtt85 -60.31 -32.47 71.25 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.01 -179.628 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 13.8 t-105 -61.87 -40.3 94.91 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.735 179.48 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 80.2 mtp85 -62.82 -38.55 91.16 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.531 -179.555 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 83.7 mtt85 -60.84 -52.65 64.16 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 120.593 -0.443 . . . . 0.0 111.385 -179.546 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.409 HG13 ' N ' ' A' ' 60' ' ' GLY . 3.2 p -66.55 -42.12 89.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.6 179.739 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . 0.409 ' N ' HG13 ' A' ' 59' ' ' VAL . . . -61.7 -45.37 96.4 Favored Glycine 0 CA--C 1.522 0.521 0 N-CA-C 111.229 -0.748 . . . . 0.0 111.229 -179.399 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 71.3 m-20 -64.67 -35.15 80.1 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 121.118 -0.233 . . . . 0.0 110.669 -179.444 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 72.4 m -64.21 -59.73 4.06 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.809 0.338 . . . . 0.0 111.144 -179.492 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 50.7 m-85 -65.4 -39.7 92.52 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.284 -0.417 . . . . 0.0 110.86 179.642 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . 0.402 ' CB ' ' O ' ' A' ' 60' ' ' GLY . 58.5 tt0 -63.91 -36.02 82.57 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.749 -179.65 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 31.4 t0 -60.75 -52.77 63.7 Favored 'General case' 0 C--N 1.323 -0.549 0 C-N-CA 120.709 -0.396 . . . . 0.0 110.497 179.957 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 69.8 m-85 -70.5 -42.73 70.94 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.911 179.69 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 65.0 t80 -57.99 -43.39 86.54 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.226 -179.457 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . 0.455 ' C ' ' OD1' ' A' ' 68' ' ' ASN . 21.2 t-20 -60.58 -44.32 96.35 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.28 -179.917 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 82.2 p -74.48 -18.36 60.63 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 120.555 -0.458 . . . . 0.0 110.111 -179.934 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 26.7 m-85 -109.04 16.5 22.53 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.261 179.736 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -167.7 -105.61 0.18 Allowed Glycine 0 CA--C 1.533 1.156 0 C-N-CA 120.579 -0.82 . . . . 0.0 111.126 -179.99 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . 0.585 ' HG2' HG22 ' A' ' 75' ' ' VAL . 67.7 Cg_endo -74.13 147.61 38.27 Favored 'Trans proline' 0 N--CA 1.494 1.558 0 C-N-CA 121.893 1.729 . . . . 0.0 113.093 -179.592 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 98.1 mt-10 -85.64 -47.49 9.77 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.286 179.541 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.704 ' CD ' ' H ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -95.84 -17.34 21.21 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.512 -178.821 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.585 HG22 ' HG2' ' A' ' 72' ' ' PRO . 26.7 t 59.2 131.87 0.02 OUTLIER Pre-proline 0 C--N 1.324 -0.505 0 CA-C-N 115.589 -0.732 . . . . 0.0 111.214 -179.186 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 49.4 Cg_exo -52.43 127.88 25.72 Favored 'Trans proline' 0 N--CA 1.494 1.536 0 C-N-CA 121.629 1.552 . . . . 0.0 111.358 179.045 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.458 ' O ' HG12 ' A' ' 77' ' ' VAL . 46.2 t -82.62 -8.5 11.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.898 179.988 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 73.7 p -48.22 -20.51 0.38 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.361 -179.707 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -60.45 -24.62 65.37 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.499 179.5 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 47.8 t80 -60.81 -39.25 88.26 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.436 -179.987 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 77.4 p -58.46 -40.52 82.88 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.529 -179.958 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' TYR . . . . . 0.43 ' OH ' HG11 ' A' ' 26' ' ' VAL . 23.5 m-85 -60.62 -52.3 65.75 Favored 'General case' 0 C--O 1.221 -0.412 0 C-N-CA 120.674 -0.41 . . . . 0.0 110.812 179.736 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' TRP . . . . . 0.405 ' O ' ' CB ' ' A' ' 87' ' ' LYS . 77.2 t90 -54.14 -39.67 66.69 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.431 -0.349 . . . . 0.0 110.638 -179.807 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 67.7 m-20 -63.28 -47.12 83.68 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.768 -0.373 . . . . 0.0 111.197 -179.813 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 32.7 tp -70.67 -54.39 12.07 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 120.21 -0.596 . . . . 0.0 110.705 179.399 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -56.53 -26.62 23.41 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.162 -179.81 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.405 ' CB ' ' O ' ' A' ' 83' ' ' TRP . 53.8 tttt -66.61 -49.18 67.14 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.841 -179.473 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.2 pp20? -79.6 -20.44 46.88 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.54 -179.788 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.516 ' O ' HD13 ' A' ' 89' ' ' LEU . 0.2 OUTLIER -62.36 -45.82 91.42 Favored 'General case' 0 N--CA 1.446 -0.64 0 C-N-CA 120.077 -0.649 . . . . 0.0 110.574 -179.224 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.475 HD12 ' CG1' ' A' ' 53' ' ' ILE . 3.5 mt -64.91 -43.57 96.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 C-N-CA 120.332 -0.547 . . . . 0.0 109.78 -179.936 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 91.1 m-20 -44.06 -36.86 2.72 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.844 -178.455 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -50.49 129.28 21.85 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 120.475 -0.49 . . . . 0.0 110.427 179.803 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -62.34 -40.72 97.29 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.652 -179.853 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . 0.468 ' O ' ' C ' ' A' ' 95' ' ' VAL . 97.7 mt-10 -71.33 -3.96 23.48 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.823 -179.607 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.468 ' C ' ' O ' ' A' ' 94' ' ' GLU . 2.4 m 29.58 -109.88 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.36 0 O-C-N 123.711 0.632 . . . . 0.0 110.403 -179.791 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' ASN . . . . . 0.498 ' N ' ' OD1' ' A' ' 96' ' ' ASN . 0.0 OUTLIER -154.17 169.93 9.24 Favored Pre-proline 0 C--N 1.325 -0.461 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.482 178.962 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -48.56 -13.14 0.23 Allowed 'Trans proline' 0 N--CA 1.494 1.542 0 C-N-CA 122.705 2.27 . . . . 0.0 112.296 179.118 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . 0.493 ' NE2' ' OG1' ' A' ' 50' ' ' THR . 3.5 pt20 -53.17 -20.85 4.31 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.704 -179.908 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 90.4 t -61.17 -49.44 84.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.812 -178.92 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 78.3 mtm -72.59 -42.37 64.63 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.953 0.406 . . . . 0.0 111.099 179.6 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . 0.613 ' HB1' ' H32' ' A' ' 201' ' ' MYR . . . -60.97 -26.06 67.29 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.627 -179.248 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . 0.439 ' HB2' ' OE2' ' A' ' 48' ' ' GLU . . . -57.13 -15.55 5.76 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.481 179.817 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 72.0 t -64.76 -21.33 29.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.304 179.647 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -57.04 -40.75 77.35 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.715 -179.857 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . 0.524 ' NE2' ' OE1' ' A' ' 47' ' ' GLN . 89.9 mt-30 -100.57 70.39 1.45 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.335 179.772 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 87.1 m -61.25 -45.06 96.07 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.135 -179.627 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 90.3 mt-10 49.85 -161.01 0.06 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.17 -179.845 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . 0.555 ' OE1' ' N ' ' A' ' 108' ' ' GLU . 56.3 mp0 -112.21 118.82 36.38 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 179.613 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 41.5 pt -48.82 -14.13 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.339 -179.853 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.47 ' N ' ' C ' ' A' ' 108' ' ' GLU . 30.9 mt -64.91 -41.23 95.75 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.395 179.467 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -68.36 -35.82 78.29 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.399 179.818 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 44.7 t -60.81 -47.63 85.49 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.668 -179.508 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 17.0 m120 -65.57 -45.0 84.99 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.548 179.769 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 40.3 t -158.2 139.02 12.99 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.344 179.809 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 87.9 mt-30 -85.42 -4.63 59.22 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.384 179.843 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 15.0 m -62.5 -46.68 87.34 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.706 -179.631 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -63.33 -36.98 85.5 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.962 0.41 . . . . 0.0 110.47 179.977 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 38.3 tp -142.84 90.87 2.24 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.549 179.785 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 93.0 mt-10 -66.32 -40.15 89.73 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.761 0.315 . . . . 0.0 110.625 179.79 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 97.2 m-70 -135.88 143.74 45.19 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.561 -179.698 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 98.9 m-70 -69.42 138.98 54.0 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.607 -179.909 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 73.3 t60 -60.74 -40.78 93.65 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.58 -179.872 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 67.8 m80 -99.32 120.59 39.82 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.501 -179.847 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 124' ' ' HIS . . . . . . . . . . . . . 64.5 t-80 -61.49 -46.13 91.31 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.524 -179.933 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 84.1 t60 . . . . . 0 C--O 1.219 -0.507 0 CA-C-O 117.988 -1.006 . . . . 0.0 110.61 -179.964 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 201' ' ' MYR . . . . . 0.773 ' H31' ' O ' ' A' ' 47' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.725 0 N-CA-C 111.096 -0.802 . . . . 0.0 111.096 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 99.4 mm-40 -62.86 -30.18 71.31 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.899 0.381 . . . . 0.0 110.483 -179.871 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.427 ' O ' ' N ' ' A' ' 7' ' ' GLN . 80.0 mm-40 -56.01 -22.15 25.38 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.542 179.593 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 36.6 tp -41.38 -28.94 0.13 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.031 0.443 . . . . 0.0 110.266 -179.403 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 54.1 m -58.25 -41.27 83.86 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.963 0.411 . . . . 0.0 110.173 179.675 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . 0.427 ' N ' ' O ' ' A' ' 4' ' ' GLU . 88.1 mt-30 -64.26 -31.83 73.18 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.835 179.97 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . 0.479 ' HA ' ' H91' ' A' ' 201' ' ' MYR . 86.4 t60 -60.18 -45.67 92.31 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-O 120.913 0.387 . . . . 0.0 110.285 179.95 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 99.3 mt-10 -60.48 -43.96 96.42 Favored 'General case' 0 C--O 1.244 0.772 0 CA-C-O 121.243 0.544 . . . . 0.0 110.126 179.769 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.436 ' O ' ' CB ' ' A' ' 14' ' ' GLN . 92.2 mtt-85 -63.18 -34.09 76.88 Favored 'General case' 0 C--O 1.211 -0.969 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 179.578 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.777 ' CE2' H122 ' A' ' 201' ' ' MYR . 37.4 t80 -59.11 -38.68 80.15 Favored 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 120.765 -0.374 . . . . 0.0 110.369 -179.636 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 2.2 t -60.55 -51.81 68.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 C-N-CA 119.624 -0.83 . . . . 0.0 110.983 -179.675 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 82.8 tt0 -79.56 -38.31 34.43 Favored 'General case' 0 C--N 1.322 -0.609 0 C-N-CA 120.14 -0.624 . . . . 0.0 112.053 -178.968 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . 0.436 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 69.0 tp60 -64.32 -50.5 67.57 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.847 -179.0 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.568 HD13 ' O ' ' A' ' 15' ' ' LEU . 0.2 OUTLIER -62.98 -46.39 87.94 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.487 -0.485 . . . . 0.0 110.073 -179.648 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 61.0 mttp -58.14 -31.6 67.36 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 120.746 -0.381 . . . . 0.0 110.203 179.482 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 75.5 mt-30 -75.73 -35.19 60.3 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.723 178.889 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -57.14 -35.99 70.16 Favored 'General case' 0 CA--C 1.519 -0.224 0 CA-C-N 115.727 -0.67 . . . . 0.0 110.01 -179.992 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.436 ' O ' ' N ' ' A' ' 22' ' ' ARG . 3.0 mt -84.97 -32.92 22.76 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.131 0.491 . . . . 0.0 110.587 179.172 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -46.02 -42.04 12.76 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.472 -179.121 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.499 ' C ' ' H ' ' A' ' 23' ' ' GLY . 0.1 OUTLIER -74.74 -23.5 58.57 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.693 -179.972 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.436 ' N ' ' O ' ' A' ' 19' ' ' LEU . 27.0 mmt180 -73.44 19.91 0.1 Allowed 'General case' 0 N--CA 1.463 0.224 0 CA-C-O 120.78 0.324 . . . . 0.0 110.4 179.987 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . 0.499 ' H ' ' C ' ' A' ' 21' ' ' THR . . . 87.75 16.84 59.25 Favored Glycine 0 CA--C 1.524 0.633 0 N-CA-C 110.941 -0.863 . . . . 0.0 110.941 -179.976 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.597 HG12 ' N ' ' A' ' 25' ' ' LYS . 21.7 t -106.4 167.97 3.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 120.635 0.255 . . . . 0.0 110.533 -179.873 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.597 ' N ' HG12 ' A' ' 24' ' ' VAL . 88.3 tttt -135.37 128.84 32.4 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 109.881 -0.414 . . . . 0.0 109.881 179.345 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.504 HG23 ' O ' ' A' ' 26' ' ' VAL . 26.5 m -125.48 118.46 52.49 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.16 0 N-CA-C 109.993 -0.373 . . . . 0.0 109.993 -179.925 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.513 ' HD3' ' H ' ' A' ' 29' ' ' ALA . 13.7 tmtt? -110.03 160.07 16.75 Favored 'General case' 0 C--O 1.222 -0.392 0 N-CA-C 109.716 -0.476 . . . . 0.0 109.716 179.614 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 88.7 m-85 -41.94 -28.99 0.19 Allowed 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.028 0.442 . . . . 0.0 110.968 179.841 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.513 ' H ' ' HD3' ' A' ' 27' ' ' LYS . . . -60.27 -24.62 65.07 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.828 -179.849 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.455 ' O ' ' CB ' ' A' ' 34' ' ' PHE . 13.0 m-20 -62.48 -44.73 95.68 Favored 'General case' 0 C--O 1.216 -0.658 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.564 -179.673 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.494 ' H ' HD12 ' A' ' 31' ' ' LEU . 5.7 mp -65.48 -40.89 93.66 Favored 'General case' 0 C--N 1.322 -0.619 0 C-N-CA 120.576 -0.449 . . . . 0.0 110.101 179.449 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 32.1 mt -59.84 -45.23 93.08 Favored 'General case' 0 C--N 1.317 -0.833 0 C-N-CA 119.433 -0.907 . . . . 0.0 111.122 -178.698 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.424 ' O ' ' CB ' ' A' ' 37' ' ' PHE . 48.7 tttp -85.57 -47.37 9.93 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 112.084 0.402 . . . . 0.0 112.084 -179.016 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . 0.844 ' O ' HG22 ' A' ' 38' ' ' VAL . 54.4 t80 -63.42 -50.41 69.91 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.976 -178.833 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.475 ' CB ' ' O ' ' A' ' 31' ' ' LEU . 9.3 t80 -62.69 -45.1 94.34 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.298 -179.673 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 56.7 t0 -73.1 -37.17 66.82 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 120.558 -0.457 . . . . 0.0 111.332 -179.508 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.562 ' CZ ' HG22 ' A' ' 59' ' ' VAL . 5.6 t80 -61.43 -47.87 83.79 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.332 -178.376 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.844 HG22 ' O ' ' A' ' 34' ' ' PHE . 19.6 m -72.26 -35.89 54.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 115.626 -0.716 . . . . 0.0 110.341 -179.869 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 65.1 tttm -58.57 -28.98 66.04 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.475 179.78 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 62.9 t0 -45.05 -59.65 2.49 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 120.58 -0.448 . . . . 0.0 110.606 -179.857 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 11.4 p -113.86 -5.28 13.24 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.744 0.307 . . . . 0.0 110.885 179.945 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . 0.548 ' N ' ' HD3' ' A' ' 43' ' ' PRO . 0.0 OUTLIER 48.65 54.36 15.91 Favored Pre-proline 0 CA--C 1.538 0.493 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.572 -178.738 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.548 ' HD3' ' N ' ' A' ' 42' ' ' CYS . 27.0 Cg_exo -62.16 -38.97 51.95 Favored 'Trans proline' 0 N--CA 1.496 1.649 0 C-N-CA 122.051 1.834 . . . . 0.0 113.034 -179.075 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . 0.873 ' HE1' ' H ' ' A' ' 52' ' ' ASP . 0.0 OUTLIER -71.7 0.75 8.06 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.025 -178.911 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.566 ' O ' ' N ' ' A' ' 47' ' ' GLN . 33.9 m-85 53.37 48.51 5.13 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.664 -179.086 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.535 ' CD ' ' N ' ' A' ' 45' ' ' PHE . 44.7 Cg_exo -39.02 -17.83 0.04 OUTLIER 'Trans proline' 0 C--N 1.312 -1.394 0 C-N-CA 122.845 2.363 . . . . 0.0 112.348 179.11 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.566 ' N ' ' O ' ' A' ' 45' ' ' PHE . 83.6 mt-30 -58.25 -52.84 63.88 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.428 -179.642 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.562 ' O ' ' H51' ' A' ' 201' ' ' MYR . 47.1 tp10 -88.3 -34.22 17.74 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.821 -0.352 . . . . 0.0 110.236 178.975 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . 0.457 ' HA3' ' H71' ' A' ' 201' ' ' MYR . . . 87.29 71.7 1.29 Allowed Glycine 0 CA--C 1.526 0.723 0 N-CA-C 110.171 -1.172 . . . . 0.0 110.171 -178.514 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 12.4 t -129.76 171.78 12.32 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 110.4 -0.222 . . . . 0.0 110.4 -179.377 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.442 ' HA ' H142 ' A' ' 201' ' ' MYR . 1.1 mt -102.19 142.59 16.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 120.982 0.42 . . . . 0.0 110.491 179.29 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . 0.873 ' H ' ' HE1' ' A' ' 44' ' ' TRP . 73.6 m-20 -122.41 121.66 37.17 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.46 -0.791 . . . . 0.0 111.465 179.343 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.484 ' CG1' HD12 ' A' ' 90' ' ' ILE . 23.5 mm -95.58 -56.19 5.43 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.352 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.24 178.964 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -74.15 -50.65 18.41 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-O 120.94 0.4 . . . . 0.0 111.438 -179.531 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 91.4 mtt-85 -61.04 -35.62 77.4 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.533 -179.891 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' TRP . . . . . 0.637 ' CE3' ' CH2' ' A' ' 44' ' ' TRP . 24.8 t-105 -59.38 -36.25 75.42 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.191 0.52 . . . . 0.0 110.452 179.102 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 61.4 ttp180 -66.41 -37.95 86.37 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.162 179.852 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 87.5 mtt180 -60.48 -51.85 67.7 Favored 'General case' 0 N--CA 1.466 0.375 0 C-N-CA 120.956 -0.298 . . . . 0.0 111.75 -178.866 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.562 HG22 ' CZ ' ' A' ' 37' ' ' PHE . 2.9 p -62.46 -42.49 95.9 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.459 0 CA-C-O 120.95 0.405 . . . . 0.0 110.153 -179.952 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -68.95 -39.4 85.15 Favored Glycine 0 CA--C 1.527 0.836 0 N-CA-C 111.452 -0.659 . . . . 0.0 111.452 179.865 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 12.7 m-20 -64.97 -42.1 94.85 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.734 0.302 . . . . 0.0 111.075 -179.191 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 5.4 m -60.04 -53.29 59.56 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.619 -179.263 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 13.8 m-85 -67.61 -37.18 82.15 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.785 179.586 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 53.3 tt0 -62.45 -41.09 98.5 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.717 -179.715 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.462 ' O ' HG23 ' A' ' 69' ' ' THR . 46.2 t0 -60.74 -52.51 64.79 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.756 -179.9 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' TYR . . . . . 0.478 ' O ' ' OG1' ' A' ' 69' ' ' THR . 25.5 m-85 -66.17 -30.58 71.08 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.362 179.482 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 76.8 t80 -68.04 -41.77 81.57 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.541 -179.859 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . 0.427 ' O ' ' N ' ' A' ' 71' ' ' GLY . 99.0 m-20 -63.56 -40.24 96.48 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.129 -179.44 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.478 ' OG1' ' O ' ' A' ' 66' ' ' TYR . 74.5 p -49.8 -17.76 0.4 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.515 -179.73 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . 0.401 ' N ' ' C ' ' A' ' 68' ' ' ASN . 59.5 m-85 -93.31 15.72 14.94 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.82 -179.953 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . 0.427 ' N ' ' O ' ' A' ' 68' ' ' ASN . . . 40.58 58.02 2.64 Favored Glycine 0 CA--C 1.53 0.999 0 N-CA-C 110.905 -0.878 . . . . 0.0 110.905 -179.295 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . 0.409 ' HD3' ' N ' ' A' ' 71' ' ' GLY . 56.5 Cg_endo -76.48 132.54 13.6 Favored 'Trans proline' 0 N--CA 1.495 1.606 0 C-N-CA 122.89 2.393 . . . . 0.0 112.13 179.715 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 83.5 tt0 -90.88 -19.94 22.8 Favored 'General case' 0 CA--C 1.507 -0.701 0 CA-C-O 121.408 0.623 . . . . 0.0 110.673 179.813 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.505 ' O ' ' C ' ' A' ' 75' ' ' VAL . 53.9 mmtt -73.01 -47.21 47.14 Favored 'General case' 0 C--N 1.31 -1.134 0 CA-C-N 115.237 -0.892 . . . . 0.0 112.056 -178.134 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.582 ' O ' HG12 ' A' ' 75' ' ' VAL . 53.5 t 25.48 80.56 0.21 Allowed Pre-proline 0 CA--C 1.528 0.099 0 O-C-N 123.765 0.665 . . . . 0.0 111.476 179.874 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_exo -55.76 125.37 18.89 Favored 'Trans proline' 0 C--N 1.307 -1.654 0 C-N-CA 121.663 1.575 . . . . 0.0 111.703 -178.842 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 96.6 t -83.88 -21.09 8.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.788 179.811 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 40.2 p -43.41 -27.57 0.28 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.732 -179.079 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -51.95 -43.28 63.44 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.041 179.777 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . 0.528 ' CE2' ' OD1' ' A' ' 84' ' ' ASN . 60.2 t80 -63.05 -42.39 99.71 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.839 179.388 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 39.3 m -58.22 -44.63 88.28 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.477 -0.329 . . . . 0.0 110.871 -179.103 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 14.4 m-85 -60.67 -48.5 81.5 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 120.79 -0.364 . . . . 0.0 110.702 179.751 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' TRP . . . . . 0.407 ' O ' ' CB ' ' A' ' 87' ' ' LYS . 68.5 t90 -56.09 -39.81 72.68 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.647 179.936 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . 0.528 ' OD1' ' CE2' ' A' ' 80' ' ' PHE . 13.3 m120 -61.96 -45.2 94.69 Favored 'General case' 0 C--N 1.326 -0.429 0 C-N-CA 120.658 -0.417 . . . . 0.0 110.966 -179.496 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 50.8 tp -72.47 -56.88 4.7 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 120.466 -0.494 . . . . 0.0 110.449 179.717 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -54.11 -27.25 16.2 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 C-N-CA 120.671 -0.412 . . . . 0.0 110.123 -179.834 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.407 ' CB ' ' O ' ' A' ' 83' ' ' TRP . 65.0 tttt -65.61 -50.89 63.4 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.218 -179.734 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . 0.466 ' OE1' ' O ' ' A' ' 88' ' ' GLU . 1.0 OUTLIER -79.66 -19.94 47.88 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.72 -179.371 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.514 ' O ' HD13 ' A' ' 89' ' ' LEU . 0.2 OUTLIER -61.51 -46.42 90.04 Favored 'General case' 0 N--CA 1.444 -0.736 0 C-N-CA 120.128 -0.629 . . . . 0.0 110.043 -179.148 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.484 HD12 ' CG1' ' A' ' 53' ' ' ILE . 3.5 mt -64.05 -42.62 96.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 C-N-CA 120.229 -0.588 . . . . 0.0 109.867 -179.908 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 71.3 m-20 -53.24 -44.81 68.41 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.676 -178.028 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . 0.492 ' C ' ' H ' ' A' ' 94' ' ' GLU . 97.5 mttt -71.39 142.76 50.32 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.797 0.332 . . . . 0.0 110.762 179.354 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -71.99 14.95 0.18 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.507 179.841 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . 0.492 ' H ' ' C ' ' A' ' 92' ' ' LYS . 40.4 tp10 -61.99 -35.21 77.85 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.296 -179.895 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 34.9 m -70.89 137.58 23.54 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.45 179.924 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' ASN . . . . . 0.525 ' O ' ' N ' ' A' ' 98' ' ' GLN . 0.9 OUTLIER -82.76 166.2 37.33 Favored Pre-proline 0 C--N 1.325 -0.471 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.743 -179.813 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 67.7 Cg_exo -44.94 -11.36 0.04 OUTLIER 'Trans proline' 0 N--CA 1.492 1.384 0 C-N-CA 122.434 2.089 . . . . 0.0 112.111 178.963 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . 0.702 ' CD ' ' H72' ' A' ' 201' ' ' MYR . 6.1 pt20 -46.37 -28.19 1.27 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.717 -179.597 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 75.7 t -64.62 -48.94 82.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-O 120.855 0.36 . . . . 0.0 110.921 -179.954 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 94.8 mtp -69.39 -39.64 77.85 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.925 -179.83 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -61.52 -28.89 69.64 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.722 -179.319 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -59.52 -16.68 26.31 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.96 0.409 . . . . 0.0 110.225 179.777 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.583 ' O ' HG12 ' A' ' 103' ' ' VAL . 88.2 t -71.13 -2.95 3.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.562 179.439 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -59.66 -34.04 72.32 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.771 -179.932 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . 0.537 ' NE2' ' OE1' ' A' ' 47' ' ' GLN . 88.2 mt-30 -62.28 -43.18 99.41 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.819 -179.65 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . 0.44 ' O ' ' O ' ' A' ' 103' ' ' VAL . 87.9 m -109.79 125.35 52.62 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.399 -179.965 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . 0.554 ' CD ' ' H ' ' A' ' 107' ' ' GLU . 30.3 mp0 -68.33 161.58 27.09 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.53 -179.406 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . 0.557 ' C ' ' H ' ' A' ' 110' ' ' LEU . 94.7 mt-10 -92.25 140.37 29.68 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.201 -0.454 . . . . 0.0 109.923 179.705 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 33.0 pt -60.74 3.75 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.379 179.848 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.557 ' H ' ' C ' ' A' ' 108' ' ' GLU . 85.3 mt -109.54 32.33 5.1 Favored 'General case' 0 N--CA 1.461 0.082 0 CA-C-O 121.023 0.439 . . . . 0.0 110.37 -179.899 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . 0.43 ' CG ' HE22 ' A' ' 115' ' ' GLN . 43.3 pttt -82.2 -115.41 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.484 179.962 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . 0.499 ' OG ' ' N ' ' A' ' 113' ' ' ASN . 29.1 p -129.59 -132.88 0.21 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.259 179.584 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 113' ' ' ASN . . . . . 0.499 ' N ' ' OG ' ' A' ' 112' ' ' SER . 99.2 m-20 56.41 34.59 24.49 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.597 -179.802 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER 76.26 94.12 0.07 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.141 0.496 . . . . 0.0 110.623 179.962 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 115' ' ' GLN . . . . . 0.43 HE22 ' CG ' ' A' ' 111' ' ' LYS . 82.7 mt-30 -144.12 164.52 30.42 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.819 -179.967 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 8.2 m -60.8 -45.34 94.77 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.916 -0.583 . . . . 0.0 110.463 -179.494 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . 0.484 ' OD2' HD22 ' A' ' 110' ' ' LEU . 93.0 m-20 -73.79 171.15 13.87 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.542 179.91 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 50.6 mt -55.74 134.3 51.4 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.267 -179.346 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 94.2 mt-10 -66.5 -40.81 89.46 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.729 0.3 . . . . 0.0 110.949 -179.808 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 94.2 m-70 -115.95 146.77 41.81 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.508 -179.98 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 79.0 m80 -104.05 135.76 44.95 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.342 179.859 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 49.8 m-70 -114.78 150.47 35.36 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.636 -179.797 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 84.1 t60 -58.6 -41.83 86.73 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.457 -179.623 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 124' ' ' HIS . . . . . . . . . . . . . 76.9 t60 -119.71 123.23 43.28 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.52 179.852 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 84.0 t60 . . . . . 0 C--O 1.221 -0.444 0 CA-C-O 118.016 -0.992 . . . . 0.0 110.558 179.985 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 201' ' ' MYR . . . . . 0.777 H122 ' CE2' ' A' ' 11' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.732 0 N-CA-C 110.991 -0.844 . . . . 0.0 110.991 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 85.7 mt-30 -60.81 -27.06 67.76 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.859 0.361 . . . . 0.0 110.571 -179.937 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.674 ' OE1' ' H52' ' A' ' 201' ' ' MYR . 97.1 mt-10 -60.6 -23.6 64.83 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.611 179.823 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 37.6 tp -43.53 -32.74 0.97 Allowed 'General case' 0 C--O 1.234 0.271 0 CA-C-O 121.115 0.483 . . . . 0.0 110.362 -179.458 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 78.0 p -57.98 -37.76 74.84 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 120.662 -0.415 . . . . 0.0 110.111 179.952 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 68.5 tp60 -65.43 -32.19 73.69 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.406 179.605 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 75.3 t60 -59.73 -45.35 92.44 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.809 0.338 . . . . 0.0 110.292 -179.941 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -59.79 -46.71 88.36 Favored 'General case' 0 C--O 1.244 0.77 0 CA-C-O 121.177 0.513 . . . . 0.0 110.233 179.713 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.421 ' O ' ' CB ' ' A' ' 14' ' ' GLN . 63.6 mtp85 -64.27 -33.47 75.88 Favored 'General case' 0 C--O 1.209 -1.066 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 179.707 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.555 ' CE1' H143 ' A' ' 201' ' ' MYR . 29.8 t80 -58.78 -36.74 74.9 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.774 0.321 . . . . 0.0 110.322 -179.547 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 4.2 t -64.15 -50.28 77.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 C-N-CA 120.179 -0.608 . . . . 0.0 111.288 -179.939 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 93.7 mt-10 -80.24 -31.77 38.48 Favored 'General case' 0 C--N 1.325 -0.49 0 C-N-CA 120.485 -0.486 . . . . 0.0 111.767 -179.285 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . 0.421 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 65.1 tp60 -72.58 -53.22 12.54 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.025 -178.936 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.595 HD13 ' O ' ' A' ' 15' ' ' LEU . 0.2 OUTLIER -62.33 -45.51 92.88 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.842 -0.429 . . . . 0.0 109.842 -179.673 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.444 ' HB3' HG11 ' A' ' 26' ' ' VAL . 66.0 mttm -56.28 -34.42 66.42 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 120.49 -0.484 . . . . 0.0 109.977 179.489 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 69.7 mm-40 -72.05 -41.42 67.46 Favored 'General case' 0 C--O 1.241 0.608 0 CA-C-O 121.175 0.512 . . . . 0.0 110.521 178.551 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.544 ' O ' HG22 ' A' ' 21' ' ' THR . . . -53.64 -45.88 70.32 Favored 'General case' 0 C--O 1.223 -0.342 0 N-CA-C 109.693 -0.484 . . . . 0.0 109.693 179.902 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.449 ' O ' ' N ' ' A' ' 22' ' ' ARG . 4.5 mt -65.58 -37.11 85.72 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 120.984 0.421 . . . . 0.0 110.421 178.838 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 78.5 tttt -45.4 -37.22 4.85 Favored 'General case' 0 C--N 1.321 -0.646 0 C-N-CA 120.418 -0.513 . . . . 0.0 109.83 -179.798 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.544 HG22 ' O ' ' A' ' 18' ' ' ALA . 0.9 OUTLIER -63.14 -34.08 76.86 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.11 179.43 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.449 ' N ' ' O ' ' A' ' 19' ' ' LEU . 12.8 mmt180 -70.37 17.59 0.06 Allowed 'General case' 0 C--O 1.233 0.215 0 CA-C-O 120.801 0.334 . . . . 0.0 110.393 -179.721 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . 0.529 ' H ' ' C ' ' A' ' 21' ' ' THR . . . 83.13 13.11 77.94 Favored Glycine 0 CA--C 1.523 0.562 0 N-CA-C 110.356 -1.098 . . . . 0.0 110.356 -179.878 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.546 HG12 ' N ' ' A' ' 25' ' ' LYS . 12.7 t -89.2 167.49 1.68 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 N-CA-C 110.333 -0.247 . . . . 0.0 110.333 -179.907 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.546 ' N ' HG12 ' A' ' 24' ' ' VAL . 58.5 mttp -134.87 127.46 30.75 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.223 179.335 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.444 HG11 ' HB3' ' A' ' 16' ' ' LYS . 3.0 m -121.63 126.31 74.58 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.247 0 C-N-CA 121.018 -0.273 . . . . 0.0 110.393 -179.921 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 20.2 ttmt -110.88 159.38 17.75 Favored 'General case' 0 CA--C 1.528 0.114 0 N-CA-C 110.167 -0.308 . . . . 0.0 110.167 179.496 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 76.5 m-85 -49.67 -32.34 13.01 Favored 'General case' 0 C--O 1.237 0.44 0 CA-C-O 121.159 0.504 . . . . 0.0 110.224 179.414 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -55.21 -23.42 22.02 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.151 179.664 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.437 ' O ' ' CB ' ' A' ' 34' ' ' PHE . 87.5 m-20 -61.83 -46.77 88.03 Favored 'General case' 0 C--O 1.216 -0.66 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.758 -179.38 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.509 ' H ' HD12 ' A' ' 31' ' ' LEU . 5.4 mp -65.65 -40.76 92.83 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 121.106 0.479 . . . . 0.0 109.924 179.736 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 35.6 mt -59.2 -45.36 91.29 Favored 'General case' 0 C--N 1.314 -0.962 0 C-N-CA 119.798 -0.761 . . . . 0.0 110.962 -178.473 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.589 ' NZ ' ' CZ ' ' A' ' 37' ' ' PHE . 63.9 tttm -86.05 -50.25 7.18 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 112.064 0.394 . . . . 0.0 112.064 -179.089 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . 0.437 ' CB ' ' O ' ' A' ' 30' ' ' ASP . 51.4 t80 -60.21 -50.21 74.57 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.707 -0.678 . . . . 0.0 110.758 -178.591 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.486 ' CB ' ' O ' ' A' ' 31' ' ' LEU . 7.5 t80 -62.29 -46.84 86.96 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.354 -179.659 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 96.7 m-20 -63.03 -36.43 83.55 Favored 'General case' 0 C--N 1.344 0.329 0 CA-C-O 120.908 0.385 . . . . 0.0 111.209 -179.533 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.589 ' CZ ' ' NZ ' ' A' ' 33' ' ' LYS . 1.9 m-85 -57.33 -46.34 83.37 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.825 -179.479 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.561 ' O ' ' N ' ' A' ' 42' ' ' CYS . 23.8 m -81.78 -24.84 9.7 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 C-N-CA 120.299 -0.56 . . . . 0.0 110.395 179.694 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 45.8 tttp -58.03 -31.57 67.12 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 120.78 -0.368 . . . . 0.0 110.4 -179.208 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 65.2 t0 -52.94 -61.14 2.48 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 120.587 -0.445 . . . . 0.0 111.232 -179.548 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.409 ' C ' ' SG ' ' A' ' 42' ' ' CYS . 31.5 p -114.43 -32.03 6.05 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-O 121.141 0.496 . . . . 0.0 111.261 -179.531 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . 0.561 ' N ' ' O ' ' A' ' 38' ' ' VAL . 2.4 m 70.57 58.59 0.48 Allowed Pre-proline 0 C--N 1.324 -0.518 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.386 -178.698 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.55 ' C ' ' H ' ' A' ' 45' ' ' PHE . 19.9 Cg_exo -68.08 -25.13 38.04 Favored 'Trans proline' 0 N--CA 1.495 1.591 0 C-N-CA 122.443 2.096 . . . . 0.0 112.319 179.885 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . 0.55 ' CD1' H132 ' A' ' 201' ' ' MYR . 0.0 OUTLIER -58.1 0.39 0.07 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.059 -179.34 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.55 ' H ' ' C ' ' A' ' 43' ' ' PRO . 0.1 OUTLIER 63.86 82.11 0.22 Allowed Pre-proline 0 C--N 1.328 -0.369 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.25 -179.987 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_endo -71.89 -9.79 25.27 Favored 'Trans proline' 0 N--CA 1.489 1.219 0 C-N-CA 122.041 1.828 . . . . 0.0 112.24 -179.55 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.605 ' O ' ' H31' ' A' ' 201' ' ' MYR . 88.1 mt-30 -81.02 -54.72 5.31 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 120.525 -0.47 . . . . 0.0 110.516 -179.81 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.738 ' O ' ' H51' ' A' ' 201' ' ' MYR . 63.2 tt0 -88.82 -26.72 21.52 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.48 178.984 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . 0.569 ' O ' ' H71' ' A' ' 201' ' ' MYR . . . 68.56 61.01 5.0 Favored Glycine 0 CA--C 1.52 0.404 0 N-CA-C 110.086 -1.206 . . . . 0.0 110.086 -179.363 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 13.5 t -118.34 154.19 32.76 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.7 0.286 . . . . 0.0 110.995 -179.274 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.4 mt -80.63 137.06 22.07 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-O 121.259 0.552 . . . . 0.0 110.841 179.494 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . 0.427 ' OD2' ' O ' ' A' ' 43' ' ' PRO . 79.9 m-20 -108.85 121.48 45.18 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.106 -0.952 . . . . 0.0 111.249 179.504 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.486 ' CG1' HD12 ' A' ' 90' ' ' ILE . 27.6 mm -94.81 -56.02 5.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.111 179.145 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -78.66 -50.09 12.05 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-O 121.032 0.444 . . . . 0.0 111.243 -179.609 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 78.1 mtp180 -58.88 -31.94 69.04 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.016 179.756 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 19.1 t-105 -62.41 -39.18 92.44 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.061 0.458 . . . . 0.0 110.616 178.987 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -62.44 -36.27 81.89 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.135 -179.717 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 95.5 mtt-85 -62.14 -55.32 29.94 Favored 'General case' 0 C--N 1.331 -0.224 0 C-N-CA 120.508 -0.477 . . . . 0.0 111.54 -179.655 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.488 HG13 ' N ' ' A' ' 60' ' ' GLY . 5.0 p -65.6 -43.33 94.06 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.441 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.447 179.803 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . 0.488 ' N ' HG13 ' A' ' 59' ' ' VAL . . . -63.67 -41.53 98.99 Favored Glycine 0 C--O 1.22 -0.729 0 N-CA-C 111.33 -0.708 . . . . 0.0 111.33 -179.455 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 76.1 m-20 -61.64 -39.93 93.08 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.82 0.31 . . . . 0.0 110.749 -179.096 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 85.3 m -60.09 -62.98 1.47 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.996 0.427 . . . . 0.0 111.002 -179.694 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 70.7 m-85 -63.35 -42.2 98.9 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.864 -179.917 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . 0.487 ' HG2' HD21 ' A' ' 68' ' ' ASN . 56.5 tt0 -57.31 -40.49 78.0 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.814 0.34 . . . . 0.0 110.776 -179.736 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -58.87 -53.75 54.87 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.986 -179.79 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 71.1 m-85 -67.47 -36.49 81.25 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.681 179.851 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 67.7 t80 -60.69 -43.62 97.52 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.61 -179.469 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . 0.487 HD21 ' HG2' ' A' ' 64' ' ' GLN . 32.8 m-20 -63.79 -41.8 97.85 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.792 -179.203 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 40.5 p -71.64 -17.59 62.25 Favored 'General case' 0 CA--C 1.514 -0.441 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.227 -179.996 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -69.11 -18.59 63.99 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.955 179.881 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 165.24 -62.73 0.23 Allowed Glycine 0 CA--C 1.53 1.019 0 C-N-CA 120.887 -0.673 . . . . 0.0 111.453 -179.237 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -41.39 100.8 0.03 OUTLIER 'Trans proline' 0 C--N 1.313 -1.311 0 C-N-CA 122.691 2.261 . . . . 0.0 112.363 -179.616 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -73.81 -41.69 61.99 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.523 179.282 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.652 ' CD ' ' H ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -95.11 -13.9 24.69 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.243 -179.878 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.447 ' O ' ' O ' ' A' ' 74' ' ' LYS . 28.9 t 58.27 130.14 0.02 OUTLIER Pre-proline 0 CA--C 1.538 0.504 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.192 -178.985 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 48.6 Cg_exo -52.51 126.47 20.92 Favored 'Trans proline' 0 N--CA 1.496 1.636 0 C-N-CA 121.405 1.403 . . . . 0.0 112.283 179.102 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.46 ' O ' ' N ' ' A' ' 80' ' ' PHE . 56.6 t -83.9 -22.57 8.17 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.333 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.848 179.254 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 28.4 p -42.08 -24.65 0.05 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.371 -179.378 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . 0.446 ' N ' ' O ' ' A' ' 77' ' ' VAL . . . -65.76 -38.46 89.14 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.862 179.691 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . 0.46 ' N ' ' O ' ' A' ' 77' ' ' VAL . 3.8 m-85 -57.85 -34.8 70.11 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.435 -179.6 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 35.6 t -60.77 -42.88 98.38 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.269 179.947 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 21.8 m-85 -60.38 -50.15 74.74 Favored 'General case' 0 C--O 1.223 -0.32 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.038 179.905 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' TRP . . . . . . . . . . . . . 55.1 t90 -54.43 -39.14 67.08 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.573 -179.555 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 89.6 m-20 -62.31 -47.07 85.89 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 120.649 -0.42 . . . . 0.0 111.02 -179.584 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 41.0 tp -71.79 -54.35 10.45 Favored 'General case' 0 C--O 1.219 -0.545 0 C-N-CA 120.328 -0.549 . . . . 0.0 110.574 179.86 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -56.84 -25.93 23.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.372 179.643 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 63.9 tttt -65.1 -50.62 65.4 Favored 'General case' 0 C--N 1.321 -0.653 0 C-N-CA 120.177 -0.609 . . . . 0.0 110.16 179.892 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . 0.437 ' OE1' ' O ' ' A' ' 88' ' ' GLU . 0.9 OUTLIER -80.78 -20.07 43.42 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.008 -179.992 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 14.2 tp -61.03 -44.33 97.57 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.629 -178.95 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.486 HD12 ' CG1' ' A' ' 53' ' ' ILE . 3.3 mt -63.99 -43.58 97.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 C-N-CA 120.12 -0.632 . . . . 0.0 109.711 -179.634 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . 0.429 ' O ' ' OD1' ' A' ' 91' ' ' ASP . 64.9 t0 -47.45 -34.98 7.93 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.843 -179.02 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . 0.429 ' O ' ' CG2' ' A' ' 95' ' ' VAL . 72.1 tttt -58.84 143.84 46.23 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.924 -179.965 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 64.5 tttm -74.26 -42.56 59.42 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.087 179.846 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 69.1 tt0 -94.24 54.96 1.95 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.02 0.438 . . . . 0.0 110.47 -178.899 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.514 HG12 ' ND2' ' A' ' 96' ' ' ASN . 5.0 t -61.19 -74.3 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.717 -179.736 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' ASN . . . . . 0.644 ' ND2' ' N ' ' A' ' 96' ' ' ASN . 0.0 OUTLIER -154.04 162.84 25.83 Favored Pre-proline 0 C--N 1.328 -0.352 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.617 179.972 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . 0.456 ' C ' ' N ' ' A' ' 99' ' ' VAL . 14.1 Cg_endo -56.12 -11.01 5.09 Favored 'Trans proline' 0 N--CA 1.496 1.65 0 C-N-CA 122.999 2.466 . . . . 0.0 112.161 179.072 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . 0.598 ' OE1' ' ND2' ' A' ' 96' ' ' ASN . 5.5 pt20 -45.04 -19.59 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.614 -179.769 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . 0.456 ' N ' ' C ' ' A' ' 97' ' ' PRO . 82.8 t -63.68 -51.42 70.25 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 C-N-CA 120.618 -0.433 . . . . 0.0 110.871 -179.885 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . 0.447 ' O ' HG23 ' A' ' 103' ' ' VAL . 97.3 mmm -71.59 -40.08 70.1 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.916 179.905 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . 0.706 ' HB1' ' H32' ' A' ' 201' ' ' MYR . . . -62.99 -21.46 66.15 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.529 -179.759 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . 0.448 ' HB2' ' CD ' ' A' ' 48' ' ' GLU . . . -60.62 -15.95 33.53 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.477 179.894 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.448 ' O ' ' O ' ' A' ' 106' ' ' THR . 84.2 t -64.16 -18.84 23.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 120.984 0.421 . . . . 0.0 110.155 179.586 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -63.43 -38.37 90.88 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.827 -179.953 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 55.3 tt0 -64.28 -42.08 96.59 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.919 -179.499 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . 0.448 ' O ' ' O ' ' A' ' 103' ' ' VAL . 87.7 m -119.15 124.54 47.06 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.451 179.867 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 93.7 mt-10 -112.54 146.88 37.73 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.432 -179.895 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . 0.559 ' C ' ' H ' ' A' ' 110' ' ' LEU . 99.1 mt-10 -64.61 130.6 44.23 Favored 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 120.699 -0.4 . . . . 0.0 110.216 179.572 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 37.9 pt -58.0 -0.31 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.192 179.313 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.559 ' H ' ' C ' ' A' ' 108' ' ' GLU . 97.8 mt -96.23 -2.72 45.57 Favored 'General case' 0 C--O 1.233 0.185 0 C-N-CA 120.723 -0.391 . . . . 0.0 110.518 -179.725 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -111.15 128.89 56.04 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.314 179.916 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . 0.458 ' OG ' ' N ' ' A' ' 113' ' ' ASN . 86.8 p -136.87 -120.37 0.15 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.883 -0.598 . . . . 0.0 110.33 179.942 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 113' ' ' ASN . . . . . 0.458 ' N ' ' OG ' ' A' ' 112' ' ' SER . 8.2 m120 -63.13 -40.68 98.28 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.437 -179.889 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 45.0 t -140.53 143.66 35.51 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.466 179.85 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 88.3 mt-30 -70.68 90.52 0.77 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.535 -179.966 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 40.1 p -66.83 -34.77 78.53 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.567 179.995 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 64.9 t0 -60.83 -48.17 83.02 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.643 -179.877 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 30.4 tp -125.6 133.61 52.2 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.345 -179.961 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -104.52 130.14 52.49 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.751 0.31 . . . . 0.0 110.339 179.612 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 40.4 m80 -57.08 -41.44 78.85 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.482 -179.803 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 80.3 m80 -113.25 129.65 56.46 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.637 179.791 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 79.9 t60 -86.08 122.63 30.38 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.259 -179.988 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 99.3 m-70 -98.18 118.21 34.31 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.323 -179.982 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 124' ' ' HIS . . . . . . . . . . . . . 77.3 t60 -63.35 -43.66 97.05 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.532 -179.809 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 62.0 t-80 . . . . . 0 C--O 1.22 -0.468 0 CA-C-O 117.946 -1.026 . . . . 0.0 110.585 -179.981 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 201' ' ' MYR . . . . . 0.738 ' H51' ' O ' ' A' ' 48' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . 0.425 ' C ' ' N ' ' A' ' 4' ' ' GLU . . . . . . . . 0 CA--C 1.526 0.737 0 N-CA-C 111.009 -0.836 . . . . 0.0 111.009 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 86.9 mt-30 -46.42 -19.78 0.09 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.877 0.37 . . . . 0.0 110.736 -179.965 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.504 ' HG2' ' H61' ' A' ' 201' ' ' MYR . 82.6 tt0 -54.37 -24.13 18.33 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.471 179.975 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 41.7 tp -42.26 -28.22 0.18 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.386 -179.736 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 59.7 p -59.95 -40.01 87.51 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.665 -179.88 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 90.0 mm-40 -61.72 -36.04 79.81 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.158 179.569 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 84.4 t60 -61.13 -41.25 96.38 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.361 179.657 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 79.1 tt0 -58.38 -47.36 84.1 Favored 'General case' 0 C--O 1.24 0.597 0 CA-C-O 121.327 0.584 . . . . 0.0 110.122 179.878 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.406 ' O ' ' CB ' ' A' ' 14' ' ' GLN . 61.9 mmt-85 -63.54 -34.76 78.51 Favored 'General case' 0 C--O 1.213 -0.854 0 N-CA-C 109.186 -0.672 . . . . 0.0 109.186 179.562 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.793 ' CZ ' H121 ' A' ' 201' ' ' MYR . 35.9 t80 -58.29 -37.43 75.0 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 120.222 -0.591 . . . . 0.0 110.334 -179.642 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 16.9 t -63.33 -48.5 87.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 C-N-CA 120.24 -0.584 . . . . 0.0 111.898 179.885 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -83.39 -26.92 30.0 Favored 'General case' 0 C--N 1.322 -0.617 0 C-N-CA 120.383 -0.527 . . . . 0.0 111.777 -179.125 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . 0.406 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 68.2 tp60 -77.82 -51.79 9.93 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.823 -179.181 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.6 HD13 ' O ' ' A' ' 15' ' ' LEU . 0.3 OUTLIER -62.98 -45.98 89.87 Favored 'General case' 0 CA--C 1.535 0.38 0 N-CA-C 109.839 -0.43 . . . . 0.0 109.839 179.886 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.581 ' HB3' HG11 ' A' ' 26' ' ' VAL . 96.8 mttt -58.68 -37.64 76.49 Favored 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 120.464 -0.494 . . . . 0.0 110.265 179.514 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 75.4 mt-30 -70.24 -37.35 74.95 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.619 178.644 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -56.35 -33.07 65.3 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.114 -0.494 . . . . 0.0 109.935 179.842 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.8 mt -85.63 -32.16 22.18 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.043 0.449 . . . . 0.0 110.65 178.969 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 66.0 tttm -48.84 -43.02 38.26 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.497 -178.794 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.479 ' C ' ' H ' ' A' ' 23' ' ' GLY . 0.1 OUTLIER -70.32 -25.0 63.1 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.611 179.752 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 29.1 mmt180 -74.14 19.04 0.13 Allowed 'General case' 0 N--CA 1.463 0.178 0 CA-C-O 120.812 0.339 . . . . 0.0 110.393 -179.753 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . 0.479 ' H ' ' C ' ' A' ' 21' ' ' THR . . . 87.66 17.18 58.81 Favored Glycine 0 N--CA 1.468 0.824 0 N-CA-C 111.138 -0.785 . . . . 0.0 111.138 179.957 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.642 HG12 ' N ' ' A' ' 25' ' ' LYS . 24.7 t -105.61 169.37 2.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 120.57 0.224 . . . . 0.0 110.527 179.953 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.642 ' N ' HG12 ' A' ' 24' ' ' VAL . 67.4 mttm -133.23 136.17 45.44 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.366 179.58 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.581 HG11 ' HB3' ' A' ' 16' ' ' LYS . 19.3 m -132.64 111.45 17.31 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.36 0 C-N-CA 121.148 -0.221 . . . . 0.0 110.666 -179.97 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.4 ' O ' ' N ' ' A' ' 30' ' ' ASP . 23.8 pttt -108.74 166.25 10.94 Favored 'General case' 0 CA--C 1.522 -0.122 0 N-CA-C 110.4 -0.222 . . . . 0.0 110.4 179.601 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 90.1 m-85 -46.92 -36.78 8.01 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-O 121.103 0.478 . . . . 0.0 110.019 179.719 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.44 ' HA ' HD12 ' A' ' 32' ' ' LEU . . . -56.73 -23.76 44.8 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.889 -0.596 . . . . 0.0 109.909 179.159 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.4 ' N ' ' O ' ' A' ' 27' ' ' LYS . 50.4 t0 -61.96 -49.78 74.73 Favored 'General case' 0 C--O 1.223 -0.291 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.974 -179.694 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.511 ' H ' HD12 ' A' ' 31' ' ' LEU . 5.8 mp -63.12 -41.13 99.27 Favored 'General case' 0 C--O 1.218 -0.561 0 CA-C-O 120.867 0.365 . . . . 0.0 110.336 179.965 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.44 HD12 ' HA ' ' A' ' 29' ' ' ALA . 51.2 mt -53.34 -46.07 69.36 Favored 'General case' 0 C--N 1.31 -1.109 0 C-N-CA 119.297 -0.961 . . . . 0.0 111.008 -178.985 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.495 ' O ' ' CD1' ' A' ' 37' ' ' PHE . 87.0 tttt -82.22 -53.16 6.29 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 112.151 0.426 . . . . 0.0 112.151 -179.003 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . 0.711 ' O ' HG22 ' A' ' 38' ' ' VAL . 10.2 m-85 -63.09 -50.44 70.53 Favored 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 120.405 -0.518 . . . . 0.0 111.52 -178.866 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.49 ' CB ' ' O ' ' A' ' 31' ' ' LEU . 22.4 t80 -58.21 -47.76 82.46 Favored 'General case' 0 C--N 1.323 -0.56 0 C-N-CA 120.752 -0.379 . . . . 0.0 110.577 -178.584 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 85.2 m-20 -71.33 -21.5 62.04 Favored 'General case' 0 C--N 1.339 0.122 0 C-N-CA 120.11 -0.636 . . . . 0.0 111.052 -179.43 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.635 ' O ' HG23 ' A' ' 41' ' ' THR . 2.7 m-85 -76.36 -63.43 1.33 Allowed 'General case' 0 C--O 1.224 -0.238 0 C-N-CA 120.508 -0.477 . . . . 0.0 111.92 -178.666 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.711 HG22 ' O ' ' A' ' 34' ' ' PHE . 0.3 OUTLIER -63.41 -38.54 82.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-O 120.927 0.394 . . . . 0.0 110.805 -179.24 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 89.0 tttt -63.03 -45.18 93.51 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.36 -179.56 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.428 ' OD1' ' N ' ' A' ' 40' ' ' ASP . 4.4 m-20 -85.06 -33.58 22.44 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 120.951 -0.299 . . . . 0.0 111.46 -179.664 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.635 HG23 ' O ' ' A' ' 37' ' ' PHE . 34.8 p -86.96 -25.83 24.14 Favored 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 120.746 -0.382 . . . . 0.0 111.255 -178.969 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . 0.525 ' N ' ' O ' ' A' ' 38' ' ' VAL . 1.7 m 23.15 67.46 0.36 Allowed Pre-proline 0 N--CA 1.466 0.362 0 O-C-N 123.954 0.784 . . . . 0.0 110.539 -178.378 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 16.8 Cg_exo -64.0 -43.38 15.79 Favored 'Trans proline' 0 C--N 1.306 -1.689 0 C-N-CA 121.814 1.676 . . . . 0.0 115.056 -175.914 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . 0.555 ' HE1' ' C ' ' A' ' 50' ' ' THR . 5.7 p90 -125.97 17.05 7.93 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.685 0.755 . . . . 0.0 110.128 179.89 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.64 ' CD2' ' NE2' ' A' ' 105' ' ' GLN . 4.3 t80 74.96 56.91 0.26 Allowed Pre-proline 0 C--N 1.32 -0.711 0 CA-C-N 114.786 -1.097 . . . . 0.0 111.16 -179.233 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.564 ' HD3' ' N ' ' A' ' 45' ' ' PHE . 11.3 Cg_exo -68.66 -19.83 41.29 Favored 'Trans proline' 0 N--CA 1.495 1.614 0 C-N-CA 123.018 2.479 . . . . 0.0 112.491 179.83 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 58.2 tt0 -54.24 -40.49 67.78 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.903 -179.002 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 31.6 tp10 -68.45 -32.25 72.13 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.825 -0.435 . . . . 0.0 109.825 179.637 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . 0.73 ' O ' H111 ' A' ' 201' ' ' MYR . . . 116.62 -17.93 13.45 Favored Glycine 0 CA--C 1.521 0.431 0 N-CA-C 110.448 -1.061 . . . . 0.0 110.448 -179.27 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . 0.555 ' C ' ' HE1' ' A' ' 44' ' ' TRP . 6.2 t -56.38 159.49 3.6 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 109.284 -0.635 . . . . 0.0 109.284 179.411 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.478 ' HA ' ' NE1' ' A' ' 44' ' ' TRP . 0.7 OUTLIER -128.28 132.29 68.39 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.488 0 CA-C-O 120.743 0.306 . . . . 0.0 110.49 -179.977 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 48.3 t0 -123.18 117.69 25.94 Favored 'General case' 0 C--N 1.312 -1.039 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.9 177.88 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 25.3 mm -72.95 -43.4 59.3 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.882 -179.561 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -62.74 -55.62 24.99 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 121.241 0.543 . . . . 0.0 111.168 -178.374 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 91.2 mtt180 -64.48 -34.92 79.35 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.305 179.201 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' TRP . . . . . 0.43 ' HE1' ' HB2' ' A' ' 83' ' ' TRP . 33.6 t-105 -55.85 -37.29 68.54 Favored 'General case' 0 C--N 1.332 -0.18 0 N-CA-C 109.698 -0.482 . . . . 0.0 109.698 179.394 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.62 ' NH2' ' CH2' ' A' ' 83' ' ' TRP . 63.7 ttm-85 -67.12 -36.97 83.05 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.003 179.126 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 44.3 ttm180 -59.65 -46.22 89.68 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 120.766 -0.373 . . . . 0.0 111.427 -179.509 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 3.1 p -69.08 -36.56 74.08 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 CA-C-O 120.774 0.321 . . . . 0.0 110.436 179.266 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -67.15 -50.53 45.04 Favored Glycine 0 CA--C 1.526 0.754 0 N-CA-C 111.296 -0.722 . . . . 0.0 111.296 179.827 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -63.83 -40.65 97.11 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.624 0.25 . . . . 0.0 111.207 -179.744 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 3.1 m -58.68 -51.56 69.43 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.993 0.425 . . . . 0.0 110.694 -179.464 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . 0.494 ' CE2' ' CE2' ' A' ' 37' ' ' PHE . 14.1 m-85 -68.3 -33.79 74.97 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.362 179.386 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 72.2 tp60 -60.1 -45.25 93.58 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.639 -179.755 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 16.3 t0 -60.63 -51.85 67.64 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.025 0.441 . . . . 0.0 110.603 179.971 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 49.3 m-85 -63.71 -33.19 75.08 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.103 179.65 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 76.4 t80 -61.74 -40.43 95.06 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.105 179.703 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 98.5 m-20 -62.64 -38.11 88.97 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.065 -179.705 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 43.5 p -47.23 -32.58 4.64 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 120.458 -0.497 . . . . 0.0 110.472 -179.084 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 60.2 m-85 -67.35 -38.35 84.7 Favored 'General case' 0 C--N 1.32 -0.69 0 C-N-CA 120.211 -0.596 . . . . 0.0 111.209 179.774 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . 0.51 ' H ' ' HD3' ' A' ' 72' ' ' PRO . . . 100.68 58.24 0.85 Allowed Glycine 0 CA--C 1.528 0.866 0 N-CA-C 110.715 -0.954 . . . . 0.0 110.715 -179.37 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . 0.51 ' HD3' ' H ' ' A' ' 71' ' ' GLY . 66.4 Cg_endo -76.36 116.64 4.38 Favored 'Trans proline' 0 C--N 1.31 -1.454 0 C-N-CA 122.781 2.321 . . . . 0.0 111.59 -179.941 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 79.4 tt0 -85.18 -21.23 29.26 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.248 -179.8 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.743 ' CD ' ' H ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -98.44 -29.14 13.29 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.867 -0.606 . . . . 0.0 112.392 -179.765 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.511 ' O ' HG12 ' A' ' 75' ' ' VAL . 24.4 t 39.3 92.68 0.05 OUTLIER Pre-proline 0 C--N 1.331 -0.231 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.736 -178.827 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -58.07 125.52 18.81 Favored 'Trans proline' 0 C--N 1.316 -1.169 0 C-N-CA 121.113 1.209 . . . . 0.0 111.049 179.792 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.443 ' O ' ' N ' ' A' ' 80' ' ' PHE . 96.0 t -84.23 -16.24 10.82 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.618 179.452 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 36.4 p -40.68 -27.07 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.637 -178.688 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . 0.426 ' N ' ' O ' ' A' ' 77' ' ' VAL . . . -59.92 -42.47 94.0 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.031 0.443 . . . . 0.0 110.313 179.648 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . 0.475 ' CZ ' ' OD1' ' A' ' 84' ' ' ASN . 55.4 t80 -61.34 -41.54 97.21 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.54 179.682 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 17.9 m -58.05 -43.53 86.91 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.905 -179.215 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 6.4 m-85 -58.65 -53.63 56.16 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.916 0.389 . . . . 0.0 111.298 -179.504 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' TRP . . . . . 0.62 ' CH2' ' NH2' ' A' ' 57' ' ' ARG . 15.2 t90 -59.58 -38.43 81.15 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.103 179.966 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . 0.475 ' OD1' ' CZ ' ' A' ' 80' ' ' PHE . 5.3 m120 -61.55 -44.46 97.0 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 120.67 -0.412 . . . . 0.0 110.796 -179.611 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.406 HD23 HD11 ' A' ' 15' ' ' LEU . 53.9 tp -71.47 -53.72 13.0 Favored 'General case' 0 C--O 1.218 -0.575 0 C-N-CA 120.343 -0.543 . . . . 0.0 110.119 179.511 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -58.9 -24.85 27.67 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 C-N-CA 120.8 -0.36 . . . . 0.0 110.883 179.763 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 70.0 tttt -67.97 -49.68 60.26 Favored 'General case' 0 C--N 1.313 -1.0 0 C-N-CA 120.351 -0.54 . . . . 0.0 110.144 179.647 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.2 pp20? -79.97 -20.57 45.23 Favored 'General case' 0 C--N 1.32 -0.682 0 C-N-CA 120.321 -0.552 . . . . 0.0 110.366 -179.883 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 14.0 tp -62.19 -44.87 95.63 Favored 'General case' 0 N--CA 1.445 -0.705 0 C-N-CA 120.338 -0.545 . . . . 0.0 109.879 179.918 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -64.16 -43.42 97.38 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.228 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.936 179.57 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 99.4 m-20 -43.74 -37.51 2.72 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.025 -178.545 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . 0.609 ' HB2' HG22 ' A' ' 95' ' ' VAL . 97.5 mttt -47.36 144.09 3.09 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 120.72 -0.392 . . . . 0.0 110.499 179.629 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 89.0 tttt -71.91 -49.16 40.21 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.874 0.369 . . . . 0.0 111.207 -179.662 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -108.31 54.21 0.67 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.583 -179.286 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.609 HG22 ' HB2' ' A' ' 92' ' ' LYS . 11.5 t -45.21 -73.88 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.242 -179.159 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' ASN . . . . . 0.548 ' ND2' HG12 ' A' ' 95' ' ' VAL . 0.0 OUTLIER -153.42 160.5 30.87 Favored Pre-proline 0 C--N 1.325 -0.496 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.598 -179.965 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -59.31 -13.35 19.79 Favored 'Trans proline' 0 C--N 1.306 -1.659 0 C-N-CA 122.672 2.248 . . . . 0.0 111.87 179.063 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . 0.436 ' OE1' ' O ' ' A' ' 49' ' ' GLY . 9.5 pt20 -57.06 -19.88 21.61 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.89 -179.962 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 52.0 t -61.77 -49.63 83.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.62 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 97.9 mmm -73.07 -40.85 64.69 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.817 179.769 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -61.87 -24.36 66.87 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.485 -179.794 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -59.1 -17.29 25.05 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.197 179.709 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.587 ' O ' HG12 ' A' ' 103' ' ' VAL . 97.8 t -66.74 -2.65 1.59 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.396 179.124 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -60.05 -39.52 86.26 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.678 -179.748 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . 0.64 ' NE2' ' CD2' ' A' ' 45' ' ' PHE . 86.6 mt-30 -73.69 105.63 5.09 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.819 0.342 . . . . 0.0 110.655 179.568 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 65.0 p -68.24 -35.09 77.39 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.584 179.916 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 85.4 mt-10 -137.13 179.4 6.41 Favored 'General case' 0 CA--C 1.52 -0.206 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.29 179.974 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . 0.48 ' C ' ' N ' ' A' ' 110' ' ' LEU . 95.4 mt-10 -105.62 128.55 53.7 Favored 'General case' 0 CA--C 1.513 -0.463 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.003 179.198 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 44.8 pt -50.16 -12.18 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-N 115.938 -0.574 . . . . 0.0 109.962 179.805 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.48 ' N ' ' C ' ' A' ' 108' ' ' GLU . 31.2 mt -65.51 -40.45 93.04 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.609 179.606 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . 0.417 ' O ' ' O ' ' A' ' 114' ' ' SER . 86.8 tttt -68.09 -19.35 64.84 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.991 179.828 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 6.3 t -57.25 -44.2 83.64 Favored 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 120.615 -0.434 . . . . 0.0 110.611 -179.263 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 10.1 m120 -64.06 -41.51 97.34 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.88 179.939 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . 0.417 ' O ' ' O ' ' A' ' 111' ' ' LYS . 29.6 p -157.6 167.46 30.07 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.491 -179.695 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 86.8 mt-30 -40.96 -28.99 0.09 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.846 0.355 . . . . 0.0 110.887 -179.773 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 2.8 t -166.9 176.49 6.98 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.528 -179.759 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 63.4 t0 -59.22 -45.19 91.77 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.305 -179.912 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 80.5 mt -118.81 111.96 19.1 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.171 179.755 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 95.1 mt-10 -54.0 126.43 22.52 Favored 'General case' 0 C--O 1.23 0.07 0 CA-C-O 120.872 0.367 . . . . 0.0 110.306 179.951 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 89.8 m-70 -59.21 -47.41 85.43 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.508 -179.698 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 50.0 t-80 -127.13 124.12 38.38 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.155 179.694 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 122' ' ' HIS . . . . . 0.422 ' ND1' ' O ' ' A' ' 124' ' ' HIS . 19.4 t-80 -91.93 124.76 36.29 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.348 179.97 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 5.4 m80 -58.45 -40.8 83.6 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.362 -179.818 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 124' ' ' HIS . . . . . 0.422 ' O ' ' ND1' ' A' ' 122' ' ' HIS . 97.8 m-70 -111.18 127.76 55.69 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.634 179.845 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 99.6 m-70 . . . . . 0 C--O 1.22 -0.466 0 CA-C-O 118.02 -0.991 . . . . 0.0 110.513 179.989 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 201' ' ' MYR . . . . . 0.793 H121 ' CZ ' ' A' ' 11' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . 0.406 ' C ' ' N ' ' A' ' 4' ' ' GLU . . . . . . . . 0 CA--C 1.526 0.765 0 N-CA-C 110.992 -0.843 . . . . 0.0 110.992 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 85.0 mt-30 -44.15 -23.29 0.09 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.977 0.417 . . . . 0.0 110.507 -179.853 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.483 ' OE1' ' H52' ' A' ' 201' ' ' MYR . 95.0 mt-10 -53.05 -20.95 4.0 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.77 179.799 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 27.3 tp -40.85 -35.67 0.54 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.413 -178.716 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 78.1 p -54.61 -40.68 69.13 Favored 'General case' 0 C--N 1.325 -0.481 0 C-N-CA 120.432 -0.507 . . . . 0.0 110.011 179.532 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . 0.465 ' N ' ' O ' ' A' ' 4' ' ' GLU . 76.7 mt-30 -64.66 -32.31 73.92 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.612 179.735 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 63.3 t-80 -57.37 -45.32 84.56 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 121.12 0.486 . . . . 0.0 109.851 -179.925 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -61.31 -41.69 97.41 Favored 'General case' 0 C--O 1.24 0.588 0 CA-C-O 121.265 0.555 . . . . 0.0 109.625 179.498 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.463 ' O ' ' N ' ' A' ' 14' ' ' GLN . 93.8 mtt-85 -65.13 -38.8 91.78 Favored 'General case' 0 C--O 1.212 -0.904 0 C-N-CA 119.983 -0.687 . . . . 0.0 109.253 179.632 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.762 ' CE1' H143 ' A' ' 201' ' ' MYR . 0.0 OUTLIER -52.59 -40.06 62.25 Favored 'General case' 0 C--N 1.32 -0.692 0 C-N-CA 120.194 -0.603 . . . . 0.0 110.451 -179.848 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 5.6 t -62.32 -53.83 42.3 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 C-N-CA 120.154 -0.618 . . . . 0.0 111.366 -179.808 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 91.4 mt-10 -79.22 -48.13 14.73 Favored 'General case' 0 N--CA 1.466 0.356 0 C-N-CA 120.104 -0.639 . . . . 0.0 111.907 -179.258 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . 0.463 ' N ' ' O ' ' A' ' 10' ' ' ARG . 70.5 tp60 -49.34 -55.74 11.86 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.056 -179.461 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.57 HD13 ' O ' ' A' ' 15' ' ' LEU . 0.2 OUTLIER -62.02 -47.66 83.75 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.85 -0.426 . . . . 0.0 109.85 -179.629 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 92.4 mttt -55.46 -32.06 62.47 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 120.728 -0.389 . . . . 0.0 110.206 179.217 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 83.8 mt-30 -77.98 -36.58 48.78 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.512 178.967 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -56.7 -32.08 65.11 Favored 'General case' 0 C--O 1.226 -0.165 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.019 -179.907 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.463 ' O ' ' N ' ' A' ' 22' ' ' ARG . 3.5 mt -85.49 -37.42 19.72 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.248 0.547 . . . . 0.0 109.939 178.826 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 64.6 tttm -42.88 -45.62 5.01 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.447 -178.944 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.553 ' C ' ' H ' ' A' ' 23' ' ' GLY . 0.5 OUTLIER -68.39 -30.67 69.64 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.708 179.895 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.463 ' N ' ' O ' ' A' ' 19' ' ' LEU . 86.8 mmt-85 -69.81 24.06 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.634 -179.778 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . 0.553 ' H ' ' C ' ' A' ' 21' ' ' THR . . . 82.4 17.09 69.68 Favored Glycine 0 N--CA 1.468 0.83 0 N-CA-C 110.994 -0.842 . . . . 0.0 110.994 179.606 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.647 HG12 ' N ' ' A' ' 25' ' ' LYS . 26.2 t -105.5 169.03 2.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-O 120.742 0.306 . . . . 0.0 110.599 -179.93 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.647 ' N ' HG12 ' A' ' 24' ' ' VAL . 98.7 mttt -137.98 133.56 33.8 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.162 179.167 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 3.7 m -124.19 129.6 74.02 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.349 0 CA-C-O 120.558 0.218 . . . . 0.0 110.666 -179.977 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.444 ' HG2' ' H ' ' A' ' 28' ' ' TYR . 19.0 ttmt -111.35 162.12 15.36 Favored 'General case' 0 CA--C 1.529 0.136 0 N-CA-C 110.253 -0.277 . . . . 0.0 110.253 179.628 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.444 ' H ' ' HG2' ' A' ' 27' ' ' LYS . 97.7 m-85 -51.22 -30.44 17.36 Favored 'General case' 0 C--O 1.238 0.482 0 CA-C-O 121.257 0.551 . . . . 0.0 110.017 179.228 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.4 ' HA ' HD12 ' A' ' 32' ' ' LEU . . . -57.24 -23.25 46.79 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.21 179.434 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.415 ' O ' ' CB ' ' A' ' 34' ' ' PHE . 87.8 m-20 -61.0 -47.43 86.47 Favored 'General case' 0 C--O 1.22 -0.496 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.47 -179.44 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.516 ' H ' HD12 ' A' ' 31' ' ' LEU . 5.6 mp -65.68 -40.35 92.28 Favored 'General case' 0 C--O 1.216 -0.681 0 C-N-CA 120.769 -0.372 . . . . 0.0 110.277 179.373 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.4 HD12 ' HA ' ' A' ' 29' ' ' ALA . 41.5 mt -58.21 -45.39 87.74 Favored 'General case' 0 C--N 1.313 -0.99 0 C-N-CA 119.429 -0.908 . . . . 0.0 111.164 -178.381 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.589 ' NZ ' ' CZ ' ' A' ' 37' ' ' PHE . 64.8 tttm -86.0 -48.49 8.62 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 121.072 0.463 . . . . 0.0 111.802 -179.222 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . 0.415 ' CB ' ' O ' ' A' ' 30' ' ' ASP . 60.2 t80 -61.1 -49.01 79.03 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.844 -179.0 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.486 ' CB ' ' O ' ' A' ' 31' ' ' LEU . 13.8 t80 -63.17 -46.62 86.27 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.576 -179.639 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 99.1 m-20 -64.48 -34.39 78.09 Favored 'General case' 0 C--N 1.341 0.227 0 CA-C-O 120.862 0.363 . . . . 0.0 110.965 -179.668 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.589 ' CZ ' ' NZ ' ' A' ' 33' ' ' LYS . 1.6 m-85 -59.35 -48.02 83.23 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.114 -179.597 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.575 ' O ' ' N ' ' A' ' 42' ' ' CYS . 14.8 m -74.81 -36.35 39.39 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.68 179.878 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -55.54 -27.7 50.5 Favored 'General case' 0 C--N 1.322 -0.606 0 C-N-CA 120.733 -0.387 . . . . 0.0 110.15 -179.792 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 85.0 m-20 -54.1 -62.27 1.76 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.797 -179.719 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.44 ' C ' ' SG ' ' A' ' 42' ' ' CYS . 7.8 p -114.33 -27.37 7.62 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 120.864 0.364 . . . . 0.0 111.392 -179.801 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . 0.575 ' N ' ' O ' ' A' ' 38' ' ' VAL . 2.3 m 71.46 55.57 0.4 Allowed Pre-proline 0 C--N 1.326 -0.436 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.468 -179.151 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.512 ' C ' ' H ' ' A' ' 45' ' ' PHE . 73.0 Cg_endo -77.18 -37.32 1.08 Allowed 'Trans proline' 0 N--CA 1.494 1.512 0 C-N-CA 122.753 2.302 . . . . 0.0 113.054 -179.536 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . 0.748 ' NE1' H141 ' A' ' 201' ' ' MYR . 0.0 OUTLIER -62.83 4.68 0.16 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.787 -179.974 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.539 ' N ' ' HD3' ' A' ' 46' ' ' PRO . 0.2 OUTLIER 55.17 53.54 9.19 Favored Pre-proline 0 CA--C 1.539 0.533 0 CA-C-O 121.49 0.662 . . . . 0.0 110.233 -178.85 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.539 ' HD3' ' N ' ' A' ' 45' ' ' PHE . 48.0 Cg_exo -52.46 -28.93 37.73 Favored 'Trans proline' 0 N--CA 1.493 1.453 0 C-N-CA 122.09 1.86 . . . . 0.0 111.84 179.327 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -70.45 -42.87 70.91 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.132 -179.44 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.592 ' O ' ' H51' ' A' ' 201' ' ' MYR . 14.1 tt0 -84.71 -15.22 45.97 Favored 'General case' 0 N--CA 1.465 0.305 0 C-N-CA 120.687 -0.405 . . . . 0.0 109.978 -179.69 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . 0.634 ' O ' ' H71' ' A' ' 201' ' ' MYR . . . 63.26 56.86 17.74 Favored Glycine 0 C--O 1.229 -0.181 0 N-CA-C 110.142 -1.183 . . . . 0.0 110.142 -179.947 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . 0.743 ' O ' H132 ' A' ' 201' ' ' MYR . 6.5 t -121.11 165.88 14.72 Favored 'General case' 0 C--N 1.327 -0.397 0 O-C-N 123.586 0.227 . . . . 0.0 110.785 -179.295 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.611 ' H ' HE22 ' A' ' 98' ' ' GLN . 1.1 mt -101.24 137.95 27.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 N-CA-C 109.688 -0.486 . . . . 0.0 109.688 179.522 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . 0.652 ' H ' ' HE1' ' A' ' 44' ' ' TRP . 20.0 m-20 -115.05 120.43 39.83 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.279 179.836 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.476 ' CG1' HD12 ' A' ' 90' ' ' ILE . 23.2 mm -94.69 -56.39 5.25 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.904 179.147 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 99.8 mttt -78.44 -48.33 15.66 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.226 -179.733 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 83.0 mtp180 -60.19 -32.92 71.54 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.091 -179.844 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' TRP . . . . . 0.525 ' CE3' ' CZ3' ' A' ' 44' ' ' TRP . 17.2 t-105 -62.16 -39.24 91.98 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-O 120.998 0.428 . . . . 0.0 110.536 179.437 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 63.5 ttm-85 -62.43 -38.11 88.47 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.325 179.849 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 61.6 ttt85 -59.69 -56.65 19.14 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 120.63 -0.428 . . . . 0.0 110.909 -179.36 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.478 HG13 ' N ' ' A' ' 60' ' ' GLY . 6.6 p -66.7 -42.79 90.09 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.552 0 CA-C-O 120.803 0.335 . . . . 0.0 111.049 -179.865 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . 0.478 ' N ' HG13 ' A' ' 59' ' ' VAL . . . -63.34 -46.74 92.11 Favored Glycine 0 C--O 1.222 -0.636 0 N-CA-C 111.681 -0.568 . . . . 0.0 111.681 -179.259 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 66.7 t0 -61.0 -36.89 80.66 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.574 0.226 . . . . 0.0 110.948 -179.444 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 71.3 m -61.03 -64.83 0.82 Allowed 'General case' 0 C--N 1.325 -0.468 0 C-N-CA 120.712 -0.395 . . . . 0.0 111.304 -179.674 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 73.3 m-85 -64.77 -43.58 92.79 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.334 -0.393 . . . . 0.0 111.441 -179.666 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . 0.427 ' CB ' ' O ' ' A' ' 60' ' ' GLY . 53.0 tt0 -59.45 -40.7 87.7 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.768 -179.394 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.482 ' O ' HG23 ' A' ' 69' ' ' THR . 18.9 t0 -58.09 -55.4 35.47 Favored 'General case' 0 C--N 1.323 -0.548 0 C-N-CA 120.65 -0.42 . . . . 0.0 110.853 -179.885 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 61.9 m-85 -66.27 -38.89 88.85 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 120.617 -0.433 . . . . 0.0 110.868 179.89 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.442 ' O ' ' N ' ' A' ' 71' ' ' GLY . 59.9 t80 -58.99 -42.34 89.8 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.533 -179.496 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . 0.411 HD21 ' HG2' ' A' ' 64' ' ' GLN . 23.5 m-20 -62.99 -42.74 99.93 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.225 -179.015 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.482 HG23 ' O ' ' A' ' 65' ' ' ASP . 10.1 p -77.33 -18.92 57.06 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 120.609 -0.436 . . . . 0.0 109.958 -179.575 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 40.5 m-85 -113.41 16.47 18.89 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.797 179.715 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . 0.442 ' N ' ' O ' ' A' ' 67' ' ' TYR . . . -154.16 -109.76 0.36 Allowed Glycine 0 CA--C 1.535 1.329 0 C-N-CA 120.594 -0.813 . . . . 0.0 111.133 -179.875 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -74.34 144.82 33.34 Favored 'Trans proline' 0 N--CA 1.492 1.386 0 C-N-CA 121.906 1.738 . . . . 0.0 113.296 -179.432 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 84.7 tt0 -85.43 -43.92 13.2 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.718 -0.673 . . . . 0.0 110.659 179.773 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.655 ' CD ' ' H ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -87.21 -18.13 31.03 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.984 -179.83 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.411 ' H ' ' HD3' ' A' ' 74' ' ' LYS . 99.6 t 57.22 114.46 0.02 OUTLIER Pre-proline 0 N--CA 1.448 -0.571 0 CA-C-N 115.846 -0.616 . . . . 0.0 111.5 -179.465 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_exo -53.23 128.8 30.59 Favored 'Trans proline' 0 N--CA 1.491 1.337 0 C-N-CA 121.312 1.342 . . . . 0.0 111.58 179.847 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.428 ' O ' HG12 ' A' ' 77' ' ' VAL . 42.5 t -82.53 -7.81 10.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.59 179.483 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 75.4 p -48.21 -23.57 0.91 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.957 0.408 . . . . 0.0 110.172 -179.916 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.72 -36.57 84.73 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.797 179.461 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 -58.33 -34.59 70.78 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.119 179.934 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 49.5 m -59.32 -40.59 86.76 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.352 179.573 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 11.8 m-85 -60.97 -49.58 76.85 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 120.793 -0.363 . . . . 0.0 111.022 179.826 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' TRP . . . . . 0.491 ' N ' ' CD1' ' A' ' 83' ' ' TRP . 21.9 m0 -58.6 -35.34 72.28 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.508 -179.756 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 77.5 m-20 -63.49 -46.52 85.74 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 120.618 -0.433 . . . . 0.0 110.758 179.727 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 35.1 tp -71.24 -53.32 14.77 Favored 'General case' 0 C--O 1.219 -0.501 0 C-N-CA 120.486 -0.486 . . . . 0.0 110.274 179.344 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -56.85 -27.51 26.43 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-O 120.863 0.363 . . . . 0.0 110.466 -179.988 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 34.8 tttm -65.8 -49.68 67.41 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.72 -179.599 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . 0.536 ' OE1' ' NZ ' ' A' ' 92' ' ' LYS . 1.1 pp20? -80.08 -20.1 45.91 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.794 -179.64 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.524 ' O ' HD13 ' A' ' 89' ' ' LEU . 0.2 OUTLIER -62.48 -45.06 94.77 Favored 'General case' 0 N--CA 1.444 -0.753 0 C-N-CA 120.263 -0.575 . . . . 0.0 110.427 -179.104 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.476 HD12 ' CG1' ' A' ' 53' ' ' ILE . 3.4 mt -64.79 -43.19 96.46 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.153 0 C-N-CA 120.504 -0.478 . . . . 0.0 109.955 -179.831 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 88.7 m-20 -44.31 -42.05 6.45 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.604 -178.487 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . 0.742 ' O ' HG23 ' A' ' 95' ' ' VAL . 51.2 mttp -57.14 124.96 20.58 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.025 0.441 . . . . 0.0 110.773 179.923 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -71.43 -38.28 71.37 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.436 179.187 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 93.0 mt-10 -81.72 50.25 1.48 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.915 -179.395 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.742 HG23 ' O ' ' A' ' 92' ' ' LYS . 13.1 t -80.61 162.35 3.67 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.057 179.719 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' ASN . . . . . 0.602 ' O ' ' N ' ' A' ' 98' ' ' GLN . 0.0 OUTLIER -40.87 166.35 0.06 OUTLIER Pre-proline 0 C--N 1.328 -0.362 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.324 179.95 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 77.3 Cg_exo -40.19 -14.05 0.03 OUTLIER 'Trans proline' 0 C--N 1.313 -1.335 0 C-N-CA 122.864 2.376 . . . . 0.0 112.695 179.327 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . 0.611 HE22 ' H ' ' A' ' 51' ' ' ILE . 4.8 tt0 -46.6 -31.52 2.88 Favored 'General case' 0 C--N 1.321 -0.632 0 C-N-CA 120.742 -0.383 . . . . 0.0 110.056 179.281 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 93.9 t -61.53 -49.89 82.57 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 C-N-CA 120.382 -0.527 . . . . 0.0 110.63 -178.942 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 63.6 ttp -82.22 -43.7 17.3 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.966 179.6 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -61.06 -26.02 67.34 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.722 -179.599 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . 0.581 ' HB2' ' O ' ' A' ' 98' ' ' GLN . . . -63.47 -16.09 59.63 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.91 0.385 . . . . 0.0 110.399 179.981 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 54.4 t -63.12 -42.61 97.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.493 179.706 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . 0.45 ' O ' ' N ' ' A' ' 106' ' ' THR . . . -46.14 -29.66 1.62 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.551 -179.712 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 92.5 mm-40 40.4 -95.3 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.716 179.835 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . 0.45 ' N ' ' O ' ' A' ' 104' ' ' ALA . 30.7 p -131.34 160.02 36.22 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.325 -179.982 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -99.43 147.0 25.72 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.538 -179.846 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . 0.427 ' C ' ' N ' ' A' ' 110' ' ' LEU . 79.6 mm-40 -79.57 129.69 34.7 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.15 -0.477 . . . . 0.0 109.978 179.499 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . 0.442 ' O ' ' OG ' ' A' ' 112' ' ' SER . 39.1 pt -54.29 -12.1 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 115.922 -0.581 . . . . 0.0 109.846 -179.887 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.427 ' N ' ' C ' ' A' ' 108' ' ' GLU . 79.1 mt -73.47 -39.08 65.19 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.429 179.278 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -65.64 -33.73 76.56 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.424 -179.884 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . 0.442 ' OG ' ' O ' ' A' ' 109' ' ' ILE . 94.0 p -59.74 -44.5 93.76 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.968 -179.304 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 40.6 t30 -64.77 -41.74 95.64 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.192 179.944 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 17.1 p -167.81 157.24 9.92 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.514 179.498 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 86.7 mt-30 -99.75 10.34 41.49 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.835 0.35 . . . . 0.0 110.495 179.764 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 43.7 p -65.02 -36.75 85.39 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.471 -179.901 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 91.0 m-20 -62.8 -42.97 99.94 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.528 179.962 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 97.8 mt -129.21 62.26 1.52 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.317 179.763 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 79.6 tt0 -71.71 145.12 49.03 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.313 179.99 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 93.3 m-70 -58.54 -43.91 89.42 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.625 -179.836 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 93.9 m-70 -106.84 104.67 14.41 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.675 179.878 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 72.4 m80 -73.01 -40.67 64.99 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.74 179.88 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 48.2 t-80 -77.05 143.32 39.38 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.601 -179.877 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 124' ' ' HIS . . . . . . . . . . . . . 97.0 m-70 -111.01 136.82 49.44 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.433 -179.762 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 81.6 t60 . . . . . 0 C--O 1.22 -0.483 0 CA-C-O 118.054 -0.974 . . . . 0.0 110.626 179.895 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 201' ' ' MYR . . . . . 0.762 H143 ' CE1' ' A' ' 11' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 stop_ save_