data_2lqu_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 2lqu _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 ' 30' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.226 -0.166 0 CA-C-O 120.667 0.27 . . . . 0.0 110.441 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 9.9 m -61.84 -36.3 80.78 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.844 -179.683 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 23.4 tptm -65.11 -57.27 9.04 Favored 'General case' 0 N--CA 1.447 -0.578 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.079 -179.709 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 22.1 pt -62.39 -28.64 45.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.331 -179.578 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 78.8 ttt180 -65.35 -42.27 93.0 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.161 0.505 . . . . 0.0 110.497 179.798 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 17.0 mt -71.89 -32.86 67.85 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.065 -179.9 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 37.7 tp10 -62.48 -51.07 68.91 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.88 -179.551 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 89.3 mtm180 -67.37 -40.62 85.74 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.508 -179.507 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 26.8 t -67.83 -25.21 65.45 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.714 -179.751 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -75.66 -40.3 56.24 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.728 179.681 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -58.41 -39.66 80.34 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.817 -179.595 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 20.1 m-20 -58.14 -22.05 49.47 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 121.059 0.457 . . . . 0.0 110.766 -179.389 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 8.9 mm -64.79 -56.15 17.41 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.953 0 N-CA-C 112.244 0.461 . . . . 0.0 112.244 -178.865 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 52.5 p -76.34 -36.03 58.45 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.559 -179.878 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 95.8 m-20 -64.56 -35.14 80.02 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.688 -177.623 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 56.4 mm-40 -73.25 -57.82 3.75 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.745 -179.588 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 16.0 pt -60.03 -26.94 37.56 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.755 0 O-C-N 123.428 0.455 . . . . 0.0 110.879 -179.37 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 65.3 m-20 -66.54 -38.53 87.35 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.365 -179.567 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -53.9 -27.47 30.7 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.209 -179.288 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 66.3 mt -62.49 -47.47 92.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.118 179.689 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 63.8 mttp -58.76 -39.54 81.28 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.101 -179.465 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 71.6 mmtt -64.85 -44.22 90.48 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.558 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -67.12 -35.49 79.87 Favored 'General case' 0 C--O 1.224 -0.268 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.48 179.822 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -63.69 -29.02 70.3 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.673 -179.844 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -58.66 -35.28 72.31 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.792 -179.526 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.43 ' CD1' ' N ' ' A' ' 55' ' ' LEU . 10.0 mp . . . . . 0 C--N 1.325 -0.464 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.511 -178.521 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . 0.625 ' C ' ' H ' ' A' ' 77' ' ' PHE . 0.0 OUTLIER . . . . . 0 C--O 1.236 0.386 0 N-CA-C 111.103 0.038 . . . . 0.0 111.103 . . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_exo -51.05 0.03 0.04 OUTLIER 'Trans proline' 0 C--N 1.312 -1.374 0 C-N-CA 122.611 2.207 . . . . 0.0 111.856 -178.572 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . 0.625 ' H ' ' C ' ' A' ' 75' ' ' ASN . 67.8 t80 -61.03 -49.46 77.33 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 116.561 -0.29 . . . . 0.0 110.709 -179.542 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 66.3 mt -64.17 -51.95 62.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.368 -179.854 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.419 ' CD1' ' N ' ' A' ' 79' ' ' LEU . 10.5 mp -56.52 -53.23 59.93 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.171 -178.616 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 94.9 mt-10 -62.68 -38.92 92.28 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 123.334 0.396 . . . . 0.0 110.221 179.911 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -63.39 -41.47 98.76 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.364 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 35.9 ttmt -52.53 -18.58 1.77 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 121.19 0.519 . . . . 0.0 110.776 -179.597 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 25.4 t -85.51 -48.38 16.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.485 179.722 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 84.4 mtt85 -64.97 -30.27 71.25 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.46 -179.585 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -70.39 -45.75 65.38 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.748 -179.497 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 74.2 p -77.6 -11.97 59.92 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.458 -179.163 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 85.6 m -60.34 -52.1 66.68 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.129 -178.736 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 11.7 p -69.8 -39.55 77.98 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.77 -179.407 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -61.97 -39.17 91.24 Favored 'General case' 0 C--O 1.223 -0.341 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.107 -178.695 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 38.4 tp10 -50.23 -54.96 17.42 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.852 -179.807 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 9.2 mtmp? -52.58 -34.89 52.59 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.69 -179.504 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 43.4 t80 -59.17 -43.59 92.15 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.725 -179.248 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 90.6 t -56.76 -47.71 82.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.453 -178.696 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 67.0 mt -53.42 -38.0 31.29 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.104 -179.904 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -52.58 -43.38 65.24 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.458 -179.491 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . 0.458 ' CD1' ' N ' ' A' ' 96' ' ' ILE . 1.7 mp -62.16 -44.86 99.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.417 -179.955 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 7.7 tm-20 -61.39 -50.07 74.33 Favored 'General case' 0 C--N 1.323 -0.56 0 O-C-N 123.442 0.464 . . . . 0.0 110.214 -178.616 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 78.4 tt0 -66.06 -39.72 90.32 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.34 -179.47 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 80.2 tt0 -67.54 -32.79 73.82 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.562 -179.676 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -57.49 -40.17 78.03 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.518 -179.496 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 20.2 m -61.69 -47.62 84.49 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.54 179.871 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 64.1 mttp -74.69 -24.64 58.81 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.376 -179.724 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 37.4 tp . . . . . 0 CA--C 1.508 -0.638 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.933 -179.739 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 80.7 p . . . . . 0 C--O 1.232 0.155 0 CA-C-O 120.702 0.287 . . . . 0.0 110.86 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -61.66 -45.45 96.26 Favored Glycine 0 CA--C 1.522 0.505 0 N-CA-C 111.191 -0.764 . . . . 0.0 111.191 -179.826 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 10.5 mm-40 -70.56 -44.05 68.24 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.708 0.29 . . . . 0.0 110.709 -179.646 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 61.5 m-85 -65.52 -36.61 84.34 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.536 -179.938 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 55.1 m -53.87 -33.95 57.97 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.385 179.813 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -65.57 -28.43 69.14 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.416 179.693 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 63.0 mmm -73.78 -41.96 61.69 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.876 -179.792 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 33.6 t80 -64.99 -34.54 78.69 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.439 179.911 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 45.4 t0 -56.67 -46.52 81.08 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.169 -179.346 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 83.6 mt -55.42 -39.01 69.72 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.519 179.761 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 119' ' ' MET . . . . . 0.434 ' C ' ' SD ' ' A' ' 119' ' ' MET . 0.0 OUTLIER -60.63 -53.98 50.86 Favored 'General case' 0 C--N 1.318 -0.769 0 O-C-N 123.544 0.527 . . . . 0.0 110.393 -179.831 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 67.1 t80 -60.77 -47.5 86.02 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.901 -178.76 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 78.9 mm-40 -56.56 -39.74 73.97 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.818 -179.726 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 69.7 t -81.19 -23.69 10.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.582 179.785 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 53.2 p -70.84 -23.0 62.26 Favored 'General case' 0 C--N 1.309 -1.171 0 CA-C-N 116.572 -0.285 . . . . 0.0 110.928 -179.783 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . 0.423 ' CB ' ' HD3' ' A' ' 125' ' ' PRO . 16.8 mtmt -72.04 -56.55 4.43 Favored Pre-proline 0 C--N 1.329 -0.297 0 C-N-CA 120.755 -0.378 . . . . 0.0 111.445 -178.71 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 125' ' ' PRO . . . . . 0.423 ' HD3' ' CB ' ' A' ' 124' ' ' LYS . 54.0 Cg_exo -49.22 -44.98 31.68 Favored 'Trans proline' 0 C--N 1.304 -1.787 0 C-N-CA 122.351 2.034 . . . . 0.0 112.172 178.237 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . 0.442 ' N ' ' CD2' ' A' ' 126' ' ' LEU . 4.3 mm? -70.38 -21.92 62.81 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.24 179.764 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 4.7 tm0? -63.31 -47.37 82.55 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.746 -179.672 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 99.7 mttt -53.58 -44.73 69.58 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 -178.461 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 1.1 tt -63.72 -45.08 91.55 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 121.295 0.569 . . . . 0.0 110.556 179.566 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 99.2 90.54 2.01 Favored Glycine 0 N--CA 1.462 0.428 0 N-CA-C 110.815 -0.914 . . . . 0.0 110.815 -179.865 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 131' ' ' ILE . . . . . 0.4 ' O ' ' CG ' ' A' ' 132' ' ' GLN . 47.3 mm -105.81 -71.56 0.7 Allowed 'Isoleucine or valine' 0 CA--C 1.507 -0.699 0 N-CA-C 111.5 0.185 . . . . 0.0 111.5 179.391 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 132' ' ' GLN . . . . . 0.4 ' CG ' ' O ' ' A' ' 131' ' ' ILE . 56.7 mt-30 -159.75 -166.93 1.86 Allowed 'General case' 0 C--N 1.327 -0.393 0 O-C-N 123.511 0.507 . . . . 0.0 110.821 -179.898 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 92.8 mt-10 -88.09 44.44 1.2 Allowed 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 116.184 -0.462 . . . . 0.0 109.81 179.895 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 44.6 tpp -59.21 -58.91 6.54 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.157 -178.833 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 23.3 p -46.42 -26.79 0.91 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.522 -179.14 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 62.4 mttp -90.56 -45.12 9.12 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.007 178.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 75.7 m -61.17 -43.56 98.68 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.73 -178.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 138' ' ' VAL . . . . . 0.424 ' CG1' ' N ' ' A' ' 139' ' ' SER . 9.8 p -65.55 -40.88 89.46 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.74 -179.156 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 139' ' ' SER . . . . . 0.424 ' N ' ' CG1' ' A' ' 138' ' ' VAL . 34.2 t -75.48 -34.09 60.86 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.2 -179.278 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 64.6 t0 -64.11 -28.55 69.85 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.322 0.582 . . . . 0.0 110.642 -179.762 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -73.11 -24.91 60.68 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.945 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -59.58 -33.39 71.38 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.015 0.436 . . . . 0.0 111.0 -179.032 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 143' ' ' GLU . . . . . 0.413 ' OE1' ' N ' ' A' ' 143' ' ' GLU . 38.3 mp0 -73.08 -36.34 66.81 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.5 -0.318 . . . . 0.0 111.201 179.818 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 144' ' ' GLU . . . . . 0.439 ' O ' ' ND2' ' A' ' 145' ' ' ASN . 44.6 tp10 -64.52 -48.11 76.33 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.581 -179.699 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 145' ' ' ASN . . . . . 0.439 ' ND2' ' O ' ' A' ' 144' ' ' GLU . 31.3 m120 -148.47 77.17 9.78 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.228 -179.457 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 146' ' ' PRO . . . . . . . . . . . . . 86.8 Cg_exo -42.79 105.41 0.06 OUTLIER 'Trans proline' 0 N--CA 1.483 0.86 0 C-N-CA 122.923 2.415 . . . . 0.0 112.096 -179.781 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 147' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_exo -45.26 101.66 0.04 OUTLIER 'Trans proline' 0 C--N 1.312 -1.36 0 C-N-CA 122.375 2.05 . . . . 0.0 112.556 -179.251 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 53.4 m -120.17 -13.6 8.92 Favored 'General case' 0 CA--C 1.515 -0.379 0 CA-C-O 120.928 0.394 . . . . 0.0 110.409 179.504 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 149' ' ' THR . . . . . 0.472 ' CG2' ' N ' ' A' ' 150' ' ' ALA . 50.1 m -136.99 171.19 14.88 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.961 0.41 . . . . 0.0 110.621 179.801 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 150' ' ' ALA . . . . . 0.472 ' N ' ' CG2' ' A' ' 149' ' ' THR . . . -58.43 -40.39 82.4 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.789 179.798 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 76.1 mt-30 -66.76 -24.52 66.22 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.938 0.399 . . . . 0.0 110.831 179.804 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . -67.33 -40.27 91.82 Favored Glycine 0 CA--C 1.525 0.674 0 N-CA-C 111.155 -0.778 . . . . 0.0 111.155 -179.828 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 153' ' ' VAL . . . . . . . . . . . . . 54.3 t -68.54 -32.26 54.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-O 120.724 0.297 . . . . 0.0 110.636 -179.71 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 7.4 mp -56.56 -36.38 69.23 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.508 -179.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -60.11 -53.48 57.26 Favored 'General case' 0 C--N 1.321 -0.633 0 O-C-N 123.607 0.567 . . . . 0.0 109.863 -179.876 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 156' ' ' ILE . . . . . 0.435 ' CD1' ' N ' ' A' ' 156' ' ' ILE . 1.8 mp -60.38 -44.47 96.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 N-CA-C 109.91 -0.404 . . . . 0.0 109.91 -179.635 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -51.09 -51.72 50.64 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.029 -178.775 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 63.0 mttp -60.13 -41.1 91.94 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.934 0.397 . . . . 0.0 110.11 179.747 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 38.6 mmtm -64.94 -30.56 71.56 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.908 0.385 . . . . 0.0 110.763 179.503 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 160' ' ' MET . . . . . 0.406 ' O ' ' CB ' ' A' ' 164' ' ' LEU . 2.2 mtm -74.23 -53.93 8.77 Favored 'General case' 0 C--O 1.219 -0.505 0 C-N-CA 120.46 -0.496 . . . . 0.0 111.562 -179.757 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 60.8 ttp180 -62.51 -41.3 98.74 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.074 -179.105 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 68.2 mm-40 -62.82 -57.64 10.16 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.694 -179.431 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 163' ' ' LYS . . . . . 0.412 ' O ' ' N ' ' A' ' 166' ' ' ARG . 63.0 tttp -66.66 -52.97 38.9 Favored 'General case' 0 C--N 1.324 -0.52 0 O-C-N 123.5 0.5 . . . . 0.0 111.046 -179.122 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 164' ' ' LEU . . . . . 0.406 ' CB ' ' O ' ' A' ' 160' ' ' MET . 53.9 tp -47.81 -37.44 13.7 Favored 'General case' 0 C--O 1.212 -0.891 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.605 -178.772 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 59.2 tt0 -68.93 -27.62 65.92 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.497 -179.662 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 166' ' ' ARG . . . . . 0.412 ' N ' ' O ' ' A' ' 163' ' ' LYS . 57.4 ttm-85 -55.02 -22.67 16.31 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.888 -179.516 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 167' ' ' VAL . . . . . 0.401 ' CG2' ' N ' ' A' ' 168' ' ' HIS . 18.2 m -60.47 -42.27 90.61 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.934 0 O-C-N 124.087 0.867 . . . . 0.0 109.923 -179.526 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 168' ' ' HIS . . . . . 0.401 ' N ' ' CG2' ' A' ' 167' ' ' VAL . 3.5 t60 -77.38 -22.26 51.94 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.554 -179.428 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 169' ' ' THR . . . . . . . . . . . . . 23.7 m -66.35 -47.24 74.08 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.143 -179.921 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 68.9 mttm -63.99 -47.09 81.7 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.513 -179.588 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 171' ' ' ASN . . . . . . . . . . . . . 75.3 m-20 -64.29 -39.63 94.32 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.732 179.959 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 172' ' ' TYR . . . . . . . . . . . . . 85.1 t80 -69.76 -38.6 76.82 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.93 -179.417 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 48.2 t -78.06 -42.44 32.29 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.07 -0.513 . . . . 0.0 111.054 -178.952 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 17.4 p -59.96 -45.88 91.23 Favored 'General case' 0 C--O 1.216 -0.688 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.005 -179.293 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 76.4 mt -63.11 -31.71 72.92 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.21 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 29.9 mttt -64.35 -5.67 5.61 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.933 -179.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 177' ' ' LYS . . . . . . . . . . . . . 20.8 ptmt -58.81 -31.2 68.23 Favored 'General case' 0 C--N 1.318 -0.791 0 O-C-N 123.423 0.452 . . . . 0.0 110.315 -179.252 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 178' ' ' LYS . . . . . . . . . . . . . 16.7 mmmt . . . . . 0 N--CA 1.453 -0.301 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.806 -179.795 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.051 0 CA-C-O 120.588 0.232 . . . . 0.0 111.172 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 11.8 m -58.26 -45.6 87.52 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.647 -179.363 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 13.2 tppt? -63.37 -54.19 40.66 Favored 'General case' 0 N--CA 1.442 -0.871 0 C-N-CA 120.406 -0.517 . . . . 0.0 110.942 179.766 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 97.0 mt -59.79 -42.48 89.02 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 N-CA-C 109.373 -0.603 . . . . 0.0 109.373 -178.479 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 72.1 ttt-85 -61.88 -37.6 85.15 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.872 0.368 . . . . 0.0 110.745 -179.431 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 36.1 mt -67.44 -39.81 85.43 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.548 -0.296 . . . . 0.0 111.431 178.961 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 82.3 tt0 -68.3 -44.96 74.31 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.32 -179.766 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 71.7 ttt-85 -65.95 -44.16 85.82 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.357 179.927 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 15.4 m -69.74 -34.03 73.27 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.681 -179.911 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -72.01 -41.54 67.46 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.869 179.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -59.53 -31.33 69.3 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.527 -179.79 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 81.1 m-20 -68.15 -22.78 64.84 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.085 0.469 . . . . 0.0 110.807 -178.924 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 68.6 mt -65.89 -53.94 32.67 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.417 -179.457 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 71.0 p -76.01 -35.62 59.47 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.086 0.47 . . . . 0.0 111.274 -179.014 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 67.0 t0 -65.61 -39.97 92.11 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.745 -177.948 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 59.1 mm-40 -68.2 -51.16 48.68 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.95 -179.326 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 8.0 pt -67.68 -27.26 37.54 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.728 0 O-C-N 123.645 0.591 . . . . 0.0 110.694 -179.335 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 12.2 m-20 -62.43 -42.02 99.14 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.133 -179.892 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -52.28 -29.68 24.4 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.136 -179.179 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 57.1 mt -66.01 -43.28 92.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.239 179.363 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -56.15 -44.42 79.25 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 -179.004 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 5.9 mtpm? -64.56 -39.25 93.41 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.722 179.569 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 83.1 m-20 -58.61 -32.34 68.91 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.209 -179.099 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -67.0 -32.19 73.26 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.835 0.35 . . . . 0.0 110.657 179.481 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -57.01 -37.39 71.63 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.673 -179.239 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.426 ' N ' ' CD1' ' A' ' 55' ' ' LEU . 10.1 mp . . . . . 0 C--N 1.325 -0.471 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.524 -179.691 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 17.6 m120 . . . . . 0 N--CA 1.448 -0.552 0 N-CA-C 110.548 -0.167 . . . . 0.0 110.548 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 69.9 Cg_endo -75.66 -3.82 14.39 Favored 'Trans proline' 0 C--N 1.316 -1.138 0 C-N-CA 122.596 2.197 . . . . 0.0 111.916 179.757 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 69.6 t80 -68.88 -60.02 2.67 Favored 'General case' 0 C--N 1.319 -0.72 0 C-N-CA 120.784 -0.367 . . . . 0.0 111.383 -179.085 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 20.2 tt -76.06 -24.98 16.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.125 -179.001 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 3.3 mp -72.53 -55.0 7.64 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.742 -179.435 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -63.32 -27.94 69.66 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.24 -179.424 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -61.55 -31.47 71.51 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.584 -179.749 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 33.8 ttmt -63.45 -22.68 67.03 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.72 -179.53 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 31.2 t -70.6 -44.74 76.5 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.998 -179.785 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 81.5 mmt-85 -61.71 -35.83 79.18 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.937 -178.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -62.47 -47.9 81.96 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.237 -179.827 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 73.6 p -67.25 -27.34 67.13 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.694 -179.716 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 31.2 m -61.35 -54.21 46.67 Favored 'General case' 0 C--N 1.326 -0.436 0 C-N-CA 120.573 -0.451 . . . . 0.0 111.424 -178.709 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 46.2 t -71.51 -45.72 66.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.248 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -56.32 -39.86 73.47 Favored 'General case' 0 C--O 1.218 -0.554 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.7 -178.662 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 79.7 tt0 -55.14 -47.8 74.57 Favored 'General case' 0 C--N 1.319 -0.761 0 C-N-CA 120.842 -0.343 . . . . 0.0 110.574 -179.938 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 53.3 mtpt -53.81 -36.77 62.85 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.587 -179.07 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 73.8 t80 -60.44 -42.21 95.64 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.592 179.663 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 58.7 t -59.1 -48.42 86.81 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.517 -177.924 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 70.4 mt -54.33 -42.06 55.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.393 179.906 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -53.85 -35.02 61.05 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.419 -179.777 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 37.4 mm -62.53 -43.32 98.27 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.781 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 83.4 tt0 -61.22 -44.86 96.59 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.962 -179.469 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 4.0 mp0 -59.55 -37.74 79.22 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.71 -179.728 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 73.1 mm-40 -67.87 -39.14 83.78 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.526 -179.543 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -60.45 -33.96 73.3 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.343 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 97.2 m -62.28 -44.05 97.42 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.395 -179.821 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 65.2 mttp -67.04 -11.13 56.21 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.401 -179.351 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 61.2 mt . . . . . 0 CA--C 1.502 -0.879 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.625 -179.732 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 78.5 p . . . . . 0 C--O 1.231 0.085 0 CA-C-O 120.913 0.387 . . . . 0.0 110.756 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -64.92 -36.27 92.89 Favored Glycine 0 CA--C 1.522 0.501 0 N-CA-C 111.079 -0.808 . . . . 0.0 111.079 -179.769 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 12.5 tm-20 -62.31 -47.52 83.91 Favored 'General case' 0 C--N 1.325 -0.458 0 C-N-CA 120.784 -0.367 . . . . 0.0 110.812 -179.443 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 69.3 m-85 -65.21 -38.53 90.72 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.329 -179.386 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 67.3 m -56.42 -40.93 75.53 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.417 -179.839 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -66.09 -28.31 68.73 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.376 179.405 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 42.1 tpp -74.12 -53.66 9.44 Favored 'General case' 0 C--N 1.333 -0.15 0 C-N-CA 120.66 -0.416 . . . . 0.0 110.713 -179.145 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 41.1 t80 -51.26 -37.83 49.33 Favored 'General case' 0 N--CA 1.461 0.086 0 N-CA-C 110.1 -0.333 . . . . 0.0 110.1 -179.576 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 26.2 m-20 -61.93 -41.65 98.2 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.001 179.552 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 1.2 tt -60.1 -41.55 92.78 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-O 120.933 0.397 . . . . 0.0 110.064 -179.636 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 119' ' ' MET . . . . . 0.542 ' SD ' ' SD ' ' A' ' 160' ' ' MET . 14.7 tpt -57.53 -47.69 81.33 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.536 -0.756 . . . . 0.0 109.503 -179.86 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 74.2 t80 -59.63 -43.51 93.8 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.432 -179.514 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 97.6 mt-10 -59.08 -35.74 73.9 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.716 -179.766 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 87.7 t -82.61 -24.31 8.76 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.662 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.399 -179.855 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 15.6 m -75.53 -27.94 58.9 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-O 121.078 0.466 . . . . 0.0 111.048 -179.324 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . 0.519 ' N ' ' HD2' ' A' ' 125' ' ' PRO . 4.0 mmtm -63.02 -58.04 18.26 Favored Pre-proline 0 C--O 1.213 -0.852 0 C-N-CA 120.563 -0.455 . . . . 0.0 112.185 -179.513 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 125' ' ' PRO . . . . . 0.519 ' HD2' ' N ' ' A' ' 124' ' ' LYS . 28.5 Cg_endo -59.8 -30.23 91.47 Favored 'Trans proline' 0 C--N 1.302 -1.893 0 C-N-CA 122.647 2.231 . . . . 0.0 112.532 -178.927 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -60.72 -35.35 76.1 Favored 'General case' 0 C--N 1.312 -1.045 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.783 -179.635 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 127' ' ' GLN . . . . . 0.404 ' CG ' ' N ' ' A' ' 128' ' ' LYS . 8.3 pt20 -51.5 -38.15 52.61 Favored 'General case' 0 C--N 1.311 -1.108 0 O-C-N 123.825 0.703 . . . . 0.0 110.504 -179.257 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 128' ' ' LYS . . . . . 0.404 ' N ' ' CG ' ' A' ' 127' ' ' GLN . 55.6 mtpt -63.53 -10.4 17.81 Favored 'General case' 0 CA--C 1.514 -0.412 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.922 -178.582 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 15.8 mt -117.61 21.86 12.72 Favored 'General case' 0 CA--C 1.509 -0.625 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.936 179.883 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 130' ' ' GLY . . . . . 0.517 ' O ' ' C ' ' A' ' 131' ' ' ILE . . . 101.15 -121.76 7.35 Favored Glycine 0 CA--C 1.506 -0.474 0 N-CA-C 110.735 -0.946 . . . . 0.0 110.735 179.589 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 131' ' ' ILE . . . . . 0.562 ' CD1' ' N ' ' A' ' 131' ' ' ILE . 2.0 mp 21.79 81.78 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 CA-C-N 116.591 0.195 . . . . 0.0 111.131 -179.439 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 69.5 tp60 -106.51 74.88 1.04 Allowed 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 -178.564 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 174.81 -6.81 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 O-C-N 123.452 0.47 . . . . 0.0 110.456 179.847 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 7.5 tpt -51.21 -40.33 58.5 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.493 -179.123 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 24.8 m -73.0 -59.76 2.56 Favored 'General case' 0 C--O 1.214 -0.777 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.048 179.444 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 136' ' ' LYS . . . . . 0.41 ' H ' ' HG2' ' A' ' 136' ' ' LYS . 44.9 mmtm -43.46 -50.8 6.9 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.982 -0.377 . . . . 0.0 109.982 -178.798 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 91.5 m -58.54 -52.11 67.06 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.629 -0.428 . . . . 0.0 110.925 179.621 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 48.7 t -64.03 -44.01 97.69 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.856 179.929 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 73.9 m -64.4 -42.19 96.24 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.495 -179.397 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 19.1 m-20 -67.07 -30.53 70.61 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.46 -179.58 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -71.43 -28.29 63.87 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.826 -179.433 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 142' ' ' ALA . . . . . 0.455 ' O ' ' O ' ' A' ' 143' ' ' GLU . . . -75.07 -29.97 60.84 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.695 -179.372 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 143' ' ' GLU . . . . . 0.533 ' O ' ' N ' ' A' ' 145' ' ' ASN . 69.3 tt0 -60.48 -119.47 0.0 OUTLIER 'General case' 0 C--O 1.211 -0.956 0 CA-C-O 119.082 -0.485 . . . . 0.0 109.811 -179.382 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 144' ' ' GLU . . . . . 0.501 ' C ' ' O ' ' A' ' 143' ' ' GLU . 84.0 tt0 18.54 -82.98 0.0 OUTLIER 'General case' 0 CA--C 1.518 -0.263 0 O-C-N 123.696 0.623 . . . . 0.0 111.678 -179.599 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 145' ' ' ASN . . . . . 0.533 ' N ' ' O ' ' A' ' 143' ' ' GLU . 57.7 t30 -127.19 95.58 36.07 Favored Pre-proline 0 CA--C 1.534 0.365 0 CA-C-N 115.467 -0.788 . . . . 0.0 111.24 178.332 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 146' ' ' PRO . . . . . . . . . . . . . 69.8 Cg_exo -50.07 125.16 14.15 Favored 'Trans proline' 0 C--N 1.321 -0.915 0 C-N-CA 122.653 2.235 . . . . 0.0 112.183 179.367 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 147' ' ' PRO . . . . . 0.469 ' C ' ' H ' ' A' ' 149' ' ' THR . 68.2 Cg_endo -75.37 70.52 5.52 Favored 'Trans proline' 0 C--N 1.312 -1.395 0 C-N-CA 122.527 2.151 . . . . 0.0 112.646 -179.402 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 40.2 p -77.88 22.05 0.29 Allowed 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.352 -179.914 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 149' ' ' THR . . . . . 0.469 ' H ' ' C ' ' A' ' 147' ' ' PRO . 16.6 m -137.6 163.36 31.41 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.539 179.55 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -62.99 -41.39 99.56 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.609 179.432 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 87.9 mt-30 -68.31 -33.68 74.76 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.139 179.804 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . -63.77 -51.42 53.88 Favored Glycine 0 CA--C 1.526 0.724 0 N-CA-C 110.834 -0.906 . . . . 0.0 110.834 -179.843 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 153' ' ' VAL . . . . . . . . . . . . . 69.1 t -60.77 -25.01 34.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 N-CA-C 110.157 -0.312 . . . . 0.0 110.157 -179.589 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -59.03 -39.74 82.9 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 121.133 0.492 . . . . 0.0 109.776 -179.011 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -59.84 -50.92 71.93 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 179.86 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 156' ' ' ILE . . . . . 0.423 HG21 HD13 ' A' ' 156' ' ' ILE . 20.1 mm -54.31 -56.06 11.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 C-N-CA 120.789 -0.364 . . . . 0.0 110.452 -179.417 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -50.32 -49.03 54.98 Favored 'General case' 0 C--N 1.33 -0.277 0 O-C-N 123.502 0.501 . . . . 0.0 110.339 179.9 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 158' ' ' LYS . . . . . 0.459 ' NZ ' ' OE2' ' A' ' 162' ' ' GLU . 63.6 tttm -64.91 -37.28 87.11 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.445 179.004 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 61.5 tttp -66.87 -31.96 72.91 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.308 -179.82 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 160' ' ' MET . . . . . 0.542 ' SD ' ' SD ' ' A' ' 119' ' ' MET . 3.8 mtm -67.3 -44.73 78.48 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.36 179.475 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 78.1 ttt180 -65.59 -33.23 75.43 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.411 -179.888 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 162' ' ' GLU . . . . . 0.459 ' OE2' ' NZ ' ' A' ' 158' ' ' LYS . 95.7 mt-10 -71.25 -29.68 65.4 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.152 -0.477 . . . . 0.0 111.0 -179.711 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 163' ' ' LYS . . . . . . . . . . . . . 2.0 tmtm? -83.11 -42.74 17.04 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-O 121.804 0.811 . . . . 0.0 110.94 -179.104 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 6.0 mt -67.82 -30.74 70.23 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.695 -0.684 . . . . 0.0 112.016 -178.607 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 4.5 pp0? -64.28 -31.82 73.17 Favored 'General case' 0 C--N 1.314 -0.963 0 O-C-N 123.776 0.673 . . . . 0.0 110.575 -179.08 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 58.4 ttt85 -65.88 -31.28 72.13 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.049 -179.346 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 167' ' ' VAL . . . . . . . . . . . . . 21.3 t -70.04 -45.22 77.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.066 -179.836 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 14.4 t60 -77.91 -30.03 50.43 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.627 -178.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 169' ' ' THR . . . . . . . . . . . . . 97.0 m -71.39 -46.54 60.03 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.952 -179.697 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 36.2 ttpt -60.76 -44.0 97.3 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.91 -179.286 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 171' ' ' ASN . . . . . . . . . . . . . 10.7 m120 -62.35 -30.88 71.49 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.608 179.725 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 172' ' ' TYR . . . . . . . . . . . . . 43.7 t80 -73.33 -35.29 66.01 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.09 0.472 . . . . 0.0 110.732 -179.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 1.9 t -76.61 -31.52 57.48 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.803 -179.375 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 9.2 p -60.82 -48.89 79.73 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.193 -179.1 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 11.0 mp -69.38 -32.19 71.07 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.338 179.23 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 33.9 ttmt -58.84 -28.52 66.14 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.091 -179.693 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 177' ' ' LYS . . . . . . . . . . . . . 58.9 tttm -55.48 -28.84 56.94 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.426 179.659 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 178' ' ' LYS . . . . . . . . . . . . . 25.2 mmtp . . . . . 0 C--N 1.324 -0.539 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.441 -179.119 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.221 -0.426 0 CA-C-O 121.531 0.681 . . . . 0.0 110.822 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 88.9 m -46.2 -34.31 4.26 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.369 -178.551 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 18.6 mmtp -64.25 -24.01 67.51 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.468 179.811 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 44.2 mm -62.0 -42.53 95.2 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.887 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 -179.073 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 45.0 ttm180 -63.32 -42.77 99.03 Favored 'General case' 0 C--N 1.321 -0.668 0 O-C-N 123.488 0.493 . . . . 0.0 110.141 -179.845 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 41.5 mt -66.66 -37.11 84.13 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.441 -179.765 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 80.4 tt0 -62.58 -45.51 92.6 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.6 -179.381 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -66.59 -40.82 89.09 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.329 179.937 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 83.5 p -73.49 -22.76 60.05 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.449 179.824 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -70.09 -49.54 49.9 Favored 'General case' 0 C--O 1.224 -0.27 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.768 -179.807 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 65.3 tttp -54.78 -42.68 72.05 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.567 -179.86 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . 0.413 ' OD1' ' N ' ' A' ' 41' ' ' ASP . 2.0 m-20 -50.44 -23.51 2.48 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.642 -179.336 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 72.2 mt -63.71 -50.89 75.96 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.094 -179.703 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 76.0 p -76.03 -38.51 57.15 Favored 'General case' 0 C--O 1.223 -0.3 0 CA-C-O 121.406 0.622 . . . . 0.0 110.797 -178.686 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 48.2 t0 -61.86 -35.99 79.93 Favored 'General case' 0 CA--C 1.519 -0.239 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.66 -177.472 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 66.1 mm-40 -71.26 -53.32 14.74 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.24 -179.76 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 9.3 pt -69.34 -31.84 51.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.706 -178.879 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 35.5 t0 -63.76 -29.45 70.66 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.181 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -67.31 -36.03 80.65 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.411 -0.358 . . . . 0.0 110.709 -179.763 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 70.4 mt -59.21 -48.42 86.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.137 -179.07 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 9.4 mtmp? -64.76 -36.4 84.19 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.469 179.707 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -62.74 -44.33 96.5 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.998 -0.547 . . . . 0.0 110.536 -179.688 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 60.1 m-20 -77.14 -35.34 56.23 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 116.511 -0.313 . . . . 0.0 110.896 -179.95 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -70.26 -38.81 75.2 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.799 -179.895 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . 0.526 ' O ' ' C ' ' A' ' 55' ' ' LEU . . . -50.79 -52.67 38.72 Favored 'General case' 0 CA--C 1.501 -0.936 0 CA-C-O 118.832 -0.604 . . . . 0.0 111.093 -178.929 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.526 ' C ' ' O ' ' A' ' 54' ' ' ALA . 4.5 mm? . . . . . 0 CA--C 1.497 -1.095 0 O-C-N 124.423 1.077 . . . . 0.0 111.469 -179.744 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . 0.623 ' N ' HD21 ' A' ' 75' ' ' ASN . 0.0 OUTLIER . . . . . 0 CA--C 1.544 0.717 0 CA-C-O 119.817 -0.135 . . . . 0.0 110.858 . . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -51.14 -1.22 0.05 OUTLIER 'Trans proline' 0 C--N 1.31 -1.454 0 C-N-CA 122.564 2.176 . . . . 0.0 112.2 -179.038 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . 0.601 ' H ' ' C ' ' A' ' 75' ' ' ASN . 20.1 m-85 -66.79 -46.93 73.71 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-O 120.668 0.271 . . . . 0.0 110.662 -179.763 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 77.4 mt -72.17 -32.64 43.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-O 121.127 0.489 . . . . 0.0 110.358 -179.248 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.553 ' CD2' ' N ' ' A' ' 79' ' ' LEU . 3.2 mm? -66.88 -48.31 69.16 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.801 -178.723 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -69.31 -27.13 65.11 Favored 'General case' 0 C--N 1.317 -0.836 0 O-C-N 123.698 0.624 . . . . 0.0 109.969 179.664 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -79.24 -19.56 50.37 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.086 0.47 . . . . 0.0 110.837 179.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . 0.47 ' NZ ' ' CG2' ' A' ' 167' ' ' VAL . 53.1 tttm -70.5 -46.34 63.88 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.606 -179.499 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 16.4 m -71.59 -38.11 66.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.494 179.807 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -62.6 -38.64 90.95 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.662 -179.754 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -58.97 -42.26 89.5 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.698 -179.811 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 33.3 p -81.33 -20.0 41.65 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.706 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 85.9 m -62.09 -53.11 60.1 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 120.666 -0.413 . . . . 0.0 110.984 -178.471 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 48.9 t -69.37 -41.3 80.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 121.147 0.499 . . . . 0.0 110.639 -179.427 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -62.96 -36.81 84.71 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.769 -178.859 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 79.2 tt0 -54.94 -31.35 60.38 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.637 -179.906 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 63.8 mttp -66.51 -36.2 82.13 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.565 -179.969 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 87.6 t80 -62.35 -60.65 3.25 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.429 -178.624 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 16.5 m -51.65 -40.99 27.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-O 121.093 0.473 . . . . 0.0 110.602 -178.72 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 49.3 mt -57.04 -41.79 78.13 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 N-CA-C 109.783 -0.451 . . . . 0.0 109.783 -179.94 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.99 -36.56 79.76 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.081 -179.77 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . 0.411 HG22 HD12 ' A' ' 96' ' ' ILE . 30.5 mm -63.87 -43.94 97.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.535 -179.857 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 75.7 tt0 -58.34 -46.78 85.59 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.358 -179.404 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -70.74 -35.44 72.68 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.97 0.414 . . . . 0.0 110.793 -179.48 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 47.8 tp10 -62.75 -46.67 86.99 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.686 -179.27 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -56.12 -38.62 71.05 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.877 0.37 . . . . 0.0 110.478 -179.17 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 19.5 m -61.64 -41.86 98.09 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.653 -179.652 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -64.38 -40.76 96.45 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.912 -178.826 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 33.9 mt . . . . . 0 C--O 1.2 -1.542 0 CA-C-O 116.993 -1.479 . . . . 0.0 111.013 -178.702 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 77.9 p . . . . . 0 N--CA 1.457 -0.122 0 CA-C-O 120.79 0.329 . . . . 0.0 110.555 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -63.61 -40.69 98.92 Favored Glycine 0 CA--C 1.524 0.62 0 N-CA-C 111.127 -0.789 . . . . 0.0 111.127 -179.548 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -67.58 -41.58 83.92 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.649 0.261 . . . . 0.0 110.586 -179.801 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 40.8 m-85 -63.06 -39.57 95.12 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.35 179.923 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 36.9 t -55.2 -38.21 68.09 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.144 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -69.88 -24.08 63.36 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.624 178.923 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 36.8 tpp -76.68 -45.79 28.29 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.063 -179.841 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 37.3 t80 -64.11 -36.24 83.37 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.877 0.37 . . . . 0.0 110.26 -179.374 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -65.6 -29.34 69.92 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.382 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 3.1 tt -64.18 -49.3 72.57 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 122.134 0.969 . . . . 0.0 110.723 -179.564 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 15.8 tpt -50.54 -41.64 54.25 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.146 -179.29 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 51.9 t80 -60.29 -41.97 94.48 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.059 0.457 . . . . 0.0 111.326 -179.83 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -58.98 -51.95 67.87 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.913 -178.991 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 29.1 m -72.94 -24.0 20.77 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-O 121.096 0.474 . . . . 0.0 110.856 -179.431 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 40.5 t -61.55 -27.18 68.44 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.454 -179.906 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . 0.45 ' CB ' ' CD ' ' A' ' 125' ' ' PRO . 16.2 mmtt -64.47 -59.19 11.29 Favored Pre-proline 0 C--O 1.222 -0.391 0 C-N-CA 120.575 -0.45 . . . . 0.0 111.775 -179.19 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 125' ' ' PRO . . . . . 0.45 ' CD ' ' CB ' ' A' ' 124' ' ' LYS . 61.1 Cg_exo -41.22 -36.89 2.69 Favored 'Trans proline' 0 C--N 1.306 -1.695 0 C-N-CA 122.537 2.158 . . . . 0.0 112.199 178.039 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 31.7 mt -67.52 -22.86 65.42 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.068 -179.438 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 127' ' ' GLN . . . . . 0.528 ' C ' ' H ' ' A' ' 129' ' ' LEU . 84.3 mt-30 -66.13 -50.93 62.3 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.995 0.426 . . . . 0.0 110.922 -179.621 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 73.8 mmtt -55.01 -6.11 0.12 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.609 179.713 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . 0.528 ' H ' ' C ' ' A' ' 127' ' ' GLN . 12.1 mt -118.08 19.25 13.66 Favored 'General case' 0 N--CA 1.465 0.299 0 O-C-N 123.451 0.47 . . . . 0.0 110.826 179.328 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 130' ' ' GLY . . . . . 0.506 ' O ' ' HB ' ' A' ' 131' ' ' ILE . . . 73.02 -177.13 42.73 Favored Glycine 0 CA--C 1.493 -1.333 0 N-CA-C 109.608 -1.397 . . . . 0.0 109.608 179.623 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 131' ' ' ILE . . . . . 0.919 ' O ' ' O ' ' A' ' 132' ' ' GLN . 60.9 mt 85.7 -20.91 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.476 -1.893 0 CA-C-O 116.996 -1.478 . . . . 0.0 110.78 178.576 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 132' ' ' GLN . . . . . 0.919 ' O ' ' O ' ' A' ' 131' ' ' ILE . 67.8 mt-30 -8.19 -145.58 0.0 OUTLIER 'General case' 0 N--CA 1.479 0.976 0 O-C-N 125.544 1.778 . . . . 0.0 112.097 -179.727 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 51.53 4.44 0.02 OUTLIER 'General case' 0 C--N 1.303 -1.417 0 O-C-N 120.032 -1.667 . . . . 0.0 111.409 179.385 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 134' ' ' MET . . . . . 0.611 ' H ' ' C ' ' A' ' 132' ' ' GLN . 0.0 OUTLIER -63.19 -43.35 98.44 Favored 'General case' 0 N--CA 1.444 -0.751 0 N-CA-C 109.926 -0.398 . . . . 0.0 109.926 -179.229 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 38.6 p -71.1 -22.4 62.09 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.737 -0.665 . . . . 0.0 109.97 179.655 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 16.3 ttmm -76.6 -57.05 4.08 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.323 -178.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 96.6 m -52.04 -53.17 45.21 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 120.686 -0.406 . . . . 0.0 110.628 -179.296 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 13.8 p -62.4 -39.64 85.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.787 -179.26 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 4.5 t -57.25 -33.29 67.44 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.382 -179.345 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -60.53 -39.85 89.34 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.47 -179.775 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -58.27 -51.28 70.42 Favored 'General case' 0 CA--C 1.515 -0.368 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.433 -179.752 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -41.29 -42.08 2.08 Favored 'General case' 0 CA--C 1.533 0.315 0 O-C-N 123.176 0.298 . . . . 0.0 110.482 -179.093 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 94.4 mt-10 -85.78 66.66 9.73 Favored 'General case' 0 C--N 1.322 -0.602 0 O-C-N 123.781 0.676 . . . . 0.0 109.727 177.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -179.45 -21.76 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 O-C-N 123.546 0.529 . . . . 0.0 110.606 179.813 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 145' ' ' ASN . . . . . 0.449 HD22 ' CD1' ' A' ' 156' ' ' ILE . 3.0 p-10 -173.04 68.31 0.37 Allowed Pre-proline 0 C--N 1.327 -0.41 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.247 -179.512 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 146' ' ' PRO . . . . . 0.493 ' C ' ' H ' ' A' ' 148' ' ' THR . 94.1 Cg_exo -37.39 118.27 0.24 Allowed 'Trans proline' 0 C--N 1.317 -1.131 0 C-N-CA 123.139 2.559 . . . . 0.0 111.69 -179.845 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 147' ' ' PRO . . . . . 0.475 ' C ' ' H ' ' A' ' 149' ' ' THR . 31.2 Cg_exo -59.98 39.86 0.05 OUTLIER 'Trans proline' 0 N--CA 1.498 1.794 0 C-N-CA 122.826 2.35 . . . . 0.0 112.408 178.931 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 148' ' ' THR . . . . . 0.493 ' H ' ' C ' ' A' ' 146' ' ' PRO . 20.6 p -65.61 0.39 1.65 Allowed 'General case' 0 N--CA 1.448 -0.573 0 N-CA-C 110.031 -0.359 . . . . 0.0 110.031 179.69 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 149' ' ' THR . . . . . 0.475 ' H ' ' C ' ' A' ' 147' ' ' PRO . 24.3 p -141.54 166.33 25.03 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.392 179.693 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -68.42 -41.31 80.59 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.626 179.778 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 99.1 mm-40 -66.76 -25.71 66.62 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.209 -179.63 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . -68.77 -33.71 76.23 Favored Glycine 0 CA--C 1.521 0.444 0 N-CA-C 111.237 -0.745 . . . . 0.0 111.237 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 153' ' ' VAL . . . . . . . . . . . . . 57.5 t -60.5 -26.48 37.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-O 120.921 0.391 . . . . 0.0 110.756 -178.786 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 154' ' ' LEU . . . . . 0.486 ' CD2' ' N ' ' A' ' 154' ' ' LEU . 4.0 mm? -62.97 -37.75 88.37 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.315 -179.073 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 42.3 tp10 -64.39 -32.93 74.74 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.064 -179.708 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 156' ' ' ILE . . . . . 0.459 ' CD1' ' N ' ' A' ' 156' ' ' ILE . 1.6 mp -77.06 -45.1 30.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.659 179.334 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -55.6 -43.2 75.83 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.541 -177.953 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -55.67 -47.28 76.99 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.022 -179.714 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 32.5 mmtp -65.66 -32.6 74.26 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.475 -0.33 . . . . 0.0 110.692 179.812 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 160' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -70.98 -53.23 15.62 Favored 'General case' 0 CA--C 1.515 -0.369 0 C-N-CA 120.505 -0.478 . . . . 0.0 111.309 -179.52 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 60.2 ttp180 -65.77 -42.58 90.65 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.736 -179.524 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 52.6 tp10 -57.8 -53.96 52.29 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.94 -179.061 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 163' ' ' LYS . . . . . . . . . . . . . 52.9 tptt -57.03 -35.26 69.08 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.708 -178.813 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 23.1 mt -69.57 -38.86 77.55 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.244 0.545 . . . . 0.0 111.709 -179.449 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 84.8 mt-30 -72.71 -32.11 65.5 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.648 -178.776 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 75.0 ttt180 -66.66 -40.96 88.84 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-O 121.951 0.882 . . . . 0.0 111.298 -178.622 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 167' ' ' VAL . . . . . 0.47 ' CG2' ' NZ ' ' A' ' 82' ' ' LYS . 7.7 p -75.17 -34.27 30.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 115.723 -0.672 . . . . 0.0 110.965 -179.958 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 168' ' ' HIS . . . . . 0.429 ' C ' ' ND1' ' A' ' 168' ' ' HIS . 14.6 t-80 -76.92 -41.66 42.61 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.935 -179.076 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 169' ' ' THR . . . . . . . . . . . . . 35.3 m -66.88 -43.8 82.52 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.235 -179.928 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 64.6 tttm -59.84 -48.19 82.69 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.842 -178.542 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 171' ' ' ASN . . . . . . . . . . . . . 20.0 t-20 -67.27 -40.72 86.21 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.009 0.433 . . . . 0.0 110.836 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 172' ' ' TYR . . . . . . . . . . . . . 64.1 t80 -68.76 -25.41 64.71 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.549 -179.293 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 17.0 t -78.47 -30.15 47.19 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.822 -179.209 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 22.7 p -73.06 -34.7 66.42 Favored 'General case' 0 C--O 1.222 -0.394 0 CA-C-O 121.333 0.587 . . . . 0.0 110.615 -178.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 99.0 mt -64.72 -43.54 93.11 Favored 'General case' 0 C--N 1.317 -0.828 0 C-N-CA 120.667 -0.413 . . . . 0.0 111.793 -178.617 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 17.7 ptpt -73.76 -14.25 61.09 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.009 -179.1 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 177' ' ' LYS . . . . . . . . . . . . . 14.9 pttp -46.93 -30.15 2.4 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.477 -0.329 . . . . 0.0 110.54 -178.98 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 178' ' ' LYS . . . . . . . . . . . . . 9.1 mtmp? . . . . . 0 C--N 1.329 -0.32 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.858 -178.111 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.371 0 CA-C-O 121.086 0.47 . . . . 0.0 111.062 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 11.1 m -64.04 -32.74 74.39 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.351 -179.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 1.9 tmtp? -61.95 -50.36 72.43 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.785 179.678 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 64.8 mt -64.75 -28.94 45.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.455 -179.558 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 59.9 ttm-85 -69.27 -42.63 75.27 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.628 -179.421 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 79.4 mt -65.72 -35.0 79.49 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.637 -179.589 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 80.2 mm-40 -67.19 -50.24 61.68 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.761 179.879 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 23.3 mmm180 -63.42 -43.75 96.58 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.923 0.392 . . . . 0.0 110.832 -179.234 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 78.7 p -66.86 -38.59 86.63 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.319 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -70.62 -37.08 73.77 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.872 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 33.8 tptt -62.31 -31.92 72.6 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.846 -179.252 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 82.3 m-20 -67.02 -23.6 65.93 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.86 -179.384 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 73.3 mt -62.45 -53.39 47.89 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.365 0 C-N-CA 120.731 -0.388 . . . . 0.0 110.995 -179.391 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 52.6 p -74.1 -39.99 63.03 Favored 'General case' 0 C--O 1.226 -0.183 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.475 -178.583 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -60.26 -39.54 87.16 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.119 -0.491 . . . . 0.0 112.03 -178.435 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 43.2 tp10 -70.33 -53.5 16.47 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.092 0.473 . . . . 0.0 111.385 -178.612 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 6.5 pt -67.27 -27.05 37.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.588 -179.056 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 31.7 t0 -61.82 -40.92 96.95 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 120.576 -0.449 . . . . 0.0 110.388 179.9 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -52.96 -24.85 10.24 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.383 -178.875 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 62.3 mt -64.55 -46.56 92.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.298 179.65 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 49.0 mtmt -56.53 -41.29 76.54 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.28 -178.5 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 71.4 mmtt -65.98 -41.68 90.83 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.192 179.613 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -61.87 -41.48 97.91 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.471 -179.834 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -61.34 -31.39 71.26 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.669 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -61.89 -34.06 75.34 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.763 -179.759 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 52.3 mt . . . . . 0 C--N 1.329 -0.321 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.948 -179.374 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 6.2 m-20 . . . . . 0 CA--C 1.547 0.858 0 N-CA-C 110.33 -0.248 . . . . 0.0 110.33 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -75.59 -14.14 20.0 Favored 'Trans proline' 0 N--CA 1.496 1.628 0 C-N-CA 121.709 1.606 . . . . 0.0 112.027 -179.932 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 59.3 t80 -74.31 -51.04 16.4 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-O 120.853 0.359 . . . . 0.0 111.555 -179.611 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 71.8 mt -67.47 -30.45 48.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.691 -179.482 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 8.5 mp -75.93 -48.85 19.61 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 121.097 0.475 . . . . 0.0 110.016 179.337 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -62.14 -28.06 69.38 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.937 -0.574 . . . . 0.0 109.963 179.742 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -66.37 -37.57 85.58 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.663 179.82 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 36.6 ttpt -62.82 -26.64 68.84 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.799 -179.794 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 54.0 t -70.43 -44.96 76.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.398 179.609 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 44.0 ttm180 -64.16 -35.69 81.62 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.089 -179.529 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -63.12 -41.74 99.4 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.949 0.404 . . . . 0.0 111.176 -179.333 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 41.3 p -72.76 -23.72 60.86 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.427 179.719 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 25.2 m -60.71 -51.18 70.47 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 120.787 -0.365 . . . . 0.0 111.0 -179.473 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 21.9 t -78.54 -48.24 22.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-O 121.209 0.528 . . . . 0.0 111.92 179.791 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -54.62 -45.59 73.73 Favored 'General case' 0 C--O 1.223 -0.331 0 CA-C-N 115.397 -0.819 . . . . 0.0 111.62 -177.387 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . 0.423 ' CG ' ' N ' ' A' ' 91' ' ' LYS . 14.3 pt-20 -59.75 -42.57 93.52 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.989 0.424 . . . . 0.0 110.594 -179.569 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . 0.423 ' N ' ' CG ' ' A' ' 90' ' ' GLU . 67.6 mttm -59.09 -38.3 79.17 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.35 -179.221 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 88.2 t80 -60.81 -38.49 85.59 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.654 179.532 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 52.9 t -59.02 -44.65 91.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.247 -178.492 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 71.7 mt -54.69 -37.34 39.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.247 -179.787 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.33 -37.67 81.36 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.577 -179.867 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 38.4 mm -61.94 -43.95 98.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 120.91 0.386 . . . . 0.0 110.031 -179.751 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 81.6 tt0 -65.04 -41.83 94.87 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 120.683 -0.407 . . . . 0.0 110.707 179.489 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 40.9 tp10 -59.77 -46.46 89.11 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.924 0.392 . . . . 0.0 110.563 -178.908 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 80.2 mm-40 -60.96 -37.45 82.46 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.225 -179.743 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -64.82 -38.07 89.74 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.606 179.867 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 18.7 m -64.08 -47.7 79.05 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.062 -179.455 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -75.15 -18.94 60.11 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.3 -179.462 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 39.1 tp . . . . . 0 N--CA 1.466 0.339 0 CA-C-O 121.179 0.514 . . . . 0.0 110.218 -179.766 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' SER . . . . . 0.565 ' HG ' ' H ' ' A' ' 110' ' ' GLY . 39.9 p . . . . . 0 CA--C 1.528 0.118 0 CA-C-O 120.857 0.361 . . . . 0.0 110.318 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . 0.565 ' H ' ' HG ' ' A' ' 109' ' ' SER . . . -65.59 -30.19 76.87 Favored Glycine 0 CA--C 1.524 0.617 0 N-CA-C 110.881 -0.888 . . . . 0.0 110.881 179.819 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 78.4 tt0 -60.31 -38.13 82.72 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.69 0.281 . . . . 0.0 110.498 -179.601 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 54.7 m-85 -60.6 -44.91 95.74 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.537 -0.301 . . . . 0.0 110.557 -179.829 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 70.0 m -50.78 -30.58 14.51 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.698 -179.52 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -62.13 -32.18 72.74 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.75 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 50.6 mmm -67.76 -40.64 84.06 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-O 121.058 0.456 . . . . 0.0 110.906 -179.744 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 55.8 m-85 -62.74 -30.85 71.74 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.183 -179.938 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -55.91 -37.99 69.65 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.994 0.426 . . . . 0.0 110.618 -179.612 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . 0.441 ' CD2' ' N ' ' A' ' 118' ' ' LEU . 4.1 mm? -61.42 -40.36 94.14 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.819 -0.628 . . . . 0.0 109.682 -179.178 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 119' ' ' MET . . . . . 0.408 ' C ' ' SD ' ' A' ' 119' ' ' MET . 0.0 OUTLIER -60.46 -53.21 60.28 Favored 'General case' 0 C--N 1.319 -0.727 0 C-N-CA 119.745 -0.782 . . . . 0.0 109.906 -179.632 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 20.1 m-85 -61.52 -46.36 90.3 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.667 -179.717 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 9.7 tm-20 -58.0 -44.87 87.48 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.185 -179.062 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 86.9 t -75.95 -21.47 15.67 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.33 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.078 179.804 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 32.2 t -71.43 -26.85 62.92 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 120.467 -0.493 . . . . 0.0 111.288 179.775 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . 0.412 ' N ' ' HD2' ' A' ' 125' ' ' PRO . 2.4 mptm? -58.8 -59.29 14.19 Favored Pre-proline 0 CA--C 1.542 0.64 0 C-N-CA 120.911 -0.316 . . . . 0.0 110.738 -179.827 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 125' ' ' PRO . . . . . 0.412 ' HD2' ' N ' ' A' ' 124' ' ' LYS . 37.3 Cg_endo -61.86 -50.04 5.85 Favored 'Trans proline' 0 N--CA 1.494 1.511 0 C-N-CA 122.039 1.826 . . . . 0.0 111.493 179.183 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 8.1 mp -56.71 -43.13 80.28 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.113 -179.16 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 11.9 tm0? -64.15 -49.98 70.01 Favored 'General case' 0 C--N 1.316 -0.849 0 C-N-CA 119.975 -0.69 . . . . 0.0 109.819 179.571 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -56.29 -19.38 14.02 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.188 -179.869 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 1.7 tt -93.72 -65.65 0.98 Allowed 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.742 179.886 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -151.8 -136.85 2.51 Favored Glycine 0 N--CA 1.462 0.374 0 N-CA-C 110.944 -0.862 . . . . 0.0 110.944 -178.955 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 131' ' ' ILE . . . . . 0.484 ' O ' ' CB ' ' A' ' 132' ' ' GLN . 81.2 mt 52.01 -114.58 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.333 -0.126 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 -178.977 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 132' ' ' GLN . . . . . 0.484 ' CB ' ' O ' ' A' ' 131' ' ' ILE . 57.6 tp60 97.15 55.4 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.803 0 O-C-N 124.138 0.899 . . . . 0.0 110.705 179.137 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 25.1 tt0 -170.42 -21.38 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 120.339 -0.544 . . . . 0.0 111.038 179.786 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -52.26 -53.21 46.75 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.191 0.52 . . . . 0.0 110.618 -178.766 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 24.5 m -61.47 -28.54 69.36 Favored 'General case' 0 C--N 1.314 -0.945 0 C-N-CA 120.655 -0.418 . . . . 0.0 110.526 -179.494 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 30.3 ttpt -79.76 -57.05 3.85 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 116.14 -0.482 . . . . 0.0 112.141 -178.505 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 137' ' ' THR . . . . . 0.433 ' CG2' ' N ' ' A' ' 138' ' ' VAL . 14.1 t -59.71 -43.35 94.15 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.291 -178.298 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 138' ' ' VAL . . . . . 0.433 ' N ' ' CG2' ' A' ' 137' ' ' THR . 70.3 t -63.78 -44.77 98.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.425 -179.753 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 77.9 p -62.53 -38.25 89.24 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.845 0.355 . . . . 0.0 110.69 -179.593 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 93.8 m-20 -70.78 -30.58 67.1 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.584 179.857 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -65.11 -26.3 68.15 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.991 -179.873 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 142' ' ' ALA . . . . . 0.473 ' O ' ' O ' ' A' ' 143' ' ' GLU . . . -65.64 -29.01 69.52 Favored 'General case' 0 CA--C 1.51 -0.592 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.646 -179.3 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 143' ' ' GLU . . . . . 0.577 ' O ' ' N ' ' A' ' 145' ' ' ASN . 14.2 mm-40 -59.39 -123.49 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 -179.878 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 144' ' ' GLU . . . . . 0.406 ' C ' ' O ' ' A' ' 143' ' ' GLU . 72.0 mm-40 26.05 -81.09 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 123.574 0.749 . . . . 0.0 111.844 -179.981 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 145' ' ' ASN . . . . . 0.577 ' N ' ' O ' ' A' ' 143' ' ' GLU . 24.7 t30 -129.67 91.66 39.94 Favored Pre-proline 0 CA--C 1.55 0.964 0 CA-C-N 115.584 -0.735 . . . . 0.0 110.38 178.27 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 146' ' ' PRO . . . . . 0.487 ' O ' ' N ' ' A' ' 148' ' ' THR . 96.1 Cg_exo -43.67 106.73 0.08 OUTLIER 'Trans proline' 0 N--CA 1.501 1.939 0 C-N-CA 122.738 2.292 . . . . 0.0 112.052 -179.796 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 147' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_exo -48.48 81.78 0.02 OUTLIER 'Trans proline' 0 N--CA 1.5 1.87 0 C-N-CA 122.299 1.999 . . . . 0.0 112.661 179.848 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 148' ' ' THR . . . . . 0.487 ' N ' ' O ' ' A' ' 146' ' ' PRO . 1.2 m -97.12 14.42 25.84 Favored 'General case' 0 N--CA 1.47 0.556 0 O-C-N 122.14 -0.35 . . . . 0.0 110.112 179.994 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 149' ' ' THR . . . . . . . . . . . . . 28.4 p -140.82 167.91 21.05 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.518 -179.811 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -62.26 -44.15 97.21 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.503 -179.851 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 151' ' ' GLN . . . . . 0.415 HE21 ' C ' ' A' ' 151' ' ' GLN . 0.0 OUTLIER -66.28 -37.0 84.4 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.756 -179.763 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . -55.53 -46.9 79.79 Favored Glycine 0 CA--C 1.523 0.59 0 N-CA-C 110.985 -0.846 . . . . 0.0 110.985 -179.26 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 153' ' ' VAL . . . . . . . . . . . . . 55.0 t -64.14 -24.69 36.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-O 120.828 0.347 . . . . 0.0 110.334 -179.62 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 1.1 tt -60.46 -40.44 91.21 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 109.558 -0.534 . . . . 0.0 109.558 -178.887 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -57.54 -46.07 84.31 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.062 179.535 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 16.0 mm -61.36 -43.63 97.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 -178.521 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -54.51 -50.02 68.83 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.38 179.202 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 158' ' ' LYS . . . . . 0.492 ' NZ ' ' OE2' ' A' ' 162' ' ' GLU . 65.1 tttm -62.72 -40.96 98.81 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.05 179.862 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 65.1 mmtt -65.92 -31.97 73.2 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.217 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 160' ' ' MET . . . . . . . . . . . . . 2.0 mtp -67.71 -47.89 68.1 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.228 0.537 . . . . 0.0 110.334 -179.5 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 62.4 ttp180 -66.44 -34.04 77.05 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.604 -179.716 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 162' ' ' GLU . . . . . 0.492 ' OE2' ' NZ ' ' A' ' 158' ' ' LYS . 48.5 mt-10 -69.95 -40.0 75.72 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.995 179.927 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 163' ' ' LYS . . . . . . . . . . . . . 17.0 tptp -67.35 -40.85 85.85 Favored 'General case' 0 C--N 1.325 -0.458 0 C-N-CA 120.553 -0.459 . . . . 0.0 111.135 -179.299 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 7.9 mt -69.15 -26.33 64.82 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.269 -179.628 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 165' ' ' GLN . . . . . 0.406 ' O ' ' OG1' ' A' ' 169' ' ' THR . 50.7 tt0 -59.98 -45.3 93.17 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.728 -179.146 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 84.8 mtp180 -61.8 -29.46 70.17 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.35 0.595 . . . . 0.0 110.889 -179.723 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 167' ' ' VAL . . . . . . . . . . . . . 22.3 t -67.93 -46.85 81.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.491 -179.827 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 168' ' ' HIS . . . . . 0.463 ' O ' ' ND1' ' A' ' 168' ' ' HIS . 29.4 t-80 -79.23 -28.99 42.53 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.28 179.943 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 169' ' ' THR . . . . . 0.406 ' OG1' ' O ' ' A' ' 165' ' ' GLN . 27.8 m -72.72 -48.52 38.04 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.781 0.324 . . . . 0.0 111.351 -179.562 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 170' ' ' LYS . . . . . 0.401 ' O ' ' OG1' ' A' ' 174' ' ' THR . 56.0 mtpt -64.08 -43.39 95.57 Favored 'General case' 0 C--N 1.326 -0.436 0 C-N-CA 120.756 -0.377 . . . . 0.0 110.692 -179.52 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 171' ' ' ASN . . . . . . . . . . . . . 42.8 t-20 -65.79 -35.04 79.59 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.597 -179.866 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 172' ' ' TYR . . . . . . . . . . . . . 89.4 t80 -74.65 -45.06 47.2 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.734 -0.667 . . . . 0.0 110.639 179.699 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 16.8 t -66.82 -44.04 82.19 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.177 -179.381 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 174' ' ' THR . . . . . 0.401 ' OG1' ' O ' ' A' ' 170' ' ' LYS . 12.6 p -60.92 -46.34 91.06 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.186 -179.648 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 175' ' ' LEU . . . . . 0.4 ' C ' ' H ' ' A' ' 177' ' ' LYS . 33.8 tp -63.85 -31.98 73.34 Favored 'General case' 0 C--N 1.319 -0.741 0 C-N-CA 120.581 -0.448 . . . . 0.0 110.719 -179.227 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 2.7 tptm -65.04 -2.85 3.0 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.648 -178.729 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 177' ' ' LYS . . . . . 0.4 ' H ' ' C ' ' A' ' 175' ' ' LEU . 20.7 ptmt -61.66 -16.04 45.2 Favored 'General case' 0 C--N 1.318 -0.769 0 C-N-CA 120.651 -0.419 . . . . 0.0 111.183 -178.962 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 178' ' ' LYS . . . . . . . . . . . . . 74.5 mmtt . . . . . 0 C--N 1.325 -0.493 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.893 -179.324 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.458 -0.074 0 CA-C-O 120.953 0.406 . . . . 0.0 110.554 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 86.0 m -50.47 -39.73 48.95 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.473 -179.953 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 6.2 tmtt? -49.77 -29.35 7.61 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.673 -179.766 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 96.4 mt -52.86 -52.96 23.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.697 -179.19 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 87.9 mtm180 -62.19 -41.31 98.23 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.458 -179.472 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.492 ' N ' ' CD2' ' A' ' 35' ' ' LEU . 4.2 mm? -64.17 -52.01 61.04 Favored 'General case' 0 N--CA 1.455 -0.22 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.037 -179.705 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 83.7 tt0 -65.27 -46.17 81.55 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.598 -179.401 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 44.7 ttm180 -64.59 -45.43 87.03 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.794 -179.148 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 30.2 t -72.14 -37.11 69.51 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.916 -178.725 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -71.51 -49.69 38.6 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.231 -178.383 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 64.3 mmtt -57.77 -30.64 65.79 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.683 -178.667 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 86.1 m-20 -68.36 -24.43 64.79 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.87 -178.268 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 63.0 mt -63.03 -56.74 15.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.281 -178.278 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' THR . . . . . 0.458 ' HG1' ' N ' ' A' ' 44' ' ' ASP . 55.8 p -75.78 -38.36 58.34 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.143 -178.455 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . 0.458 ' N ' ' HG1' ' A' ' 43' ' ' THR . 96.3 m-20 -61.5 -38.53 87.69 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.978 -176.99 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 14.3 tm-20 -72.22 -58.5 3.36 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.114 -0.493 . . . . 0.0 111.248 -178.057 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 7.4 pt -61.22 -28.53 44.0 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.188 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.782 -178.539 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -66.51 -38.58 87.52 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.814 179.288 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . 0.414 ' O ' ' OD2' ' A' ' 52' ' ' ASP . . . -55.92 -25.1 41.55 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.485 -179.904 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 66.9 mt -58.39 -43.02 85.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.678 -179.631 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -60.6 -34.21 73.89 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.57 -179.8 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -61.72 -51.75 67.11 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.964 -179.036 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . 0.414 ' OD2' ' O ' ' A' ' 48' ' ' ALA . 0.4 OUTLIER -70.21 -19.8 63.14 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.753 -179.189 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -72.92 -32.92 65.65 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.734 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -58.06 -25.79 61.7 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.63 -179.786 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 79.3 mt . . . . . 0 C--N 1.33 -0.239 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.366 -179.346 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 33.6 m120 . . . . . 0 C--O 1.233 0.215 0 CA-C-O 120.553 0.216 . . . . 0.0 110.91 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -71.08 4.4 2.79 Favored 'Trans proline' 0 C--N 1.301 -1.925 0 C-N-CA 122.794 2.329 . . . . 0.0 112.353 -178.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 52.5 t80 -63.74 -51.63 64.06 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.774 -179.261 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 76.6 mt -70.08 -48.08 64.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.9 -179.158 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.452 ' CD1' ' N ' ' A' ' 79' ' ' LEU . 10.0 mp -52.23 -51.42 58.4 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.499 -179.073 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.416 ' O ' ' NH1' ' A' ' 84' ' ' ARG . 96.1 mt-10 -65.52 -31.83 73.11 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.438 -179.982 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -65.25 -38.14 89.4 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.634 -179.684 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -54.58 -24.93 23.23 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.425 -179.618 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 44.2 t -72.5 -43.85 62.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.978 -179.446 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . 0.416 ' NH1' ' O ' ' A' ' 80' ' ' GLU . 12.0 mpt_? -61.8 -29.21 70.0 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.6 -179.101 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -64.08 -44.93 90.86 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.917 -178.725 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 54.9 p -71.18 -20.18 62.31 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.769 -179.216 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 26.0 m -64.33 -53.89 41.6 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.218 -178.642 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 41.3 t -69.27 -46.5 77.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.094 -178.311 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -57.35 -37.44 72.59 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.744 -178.094 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 17.3 mm-40 -55.22 -42.24 73.1 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.701 -179.391 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 14.6 mptt -64.75 -23.37 67.23 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.639 -178.406 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 53.8 t80 -74.1 -59.57 2.66 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.316 -177.924 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 4.5 m -49.92 -38.3 13.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.674 -177.64 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.405 HD11 HG22 ' A' ' 94' ' ' ILE . 81.1 mt -58.91 -39.42 77.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.136 179.475 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -51.55 -40.77 60.33 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.569 -179.521 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . 0.472 ' CD1' ' N ' ' A' ' 96' ' ' ILE . 1.7 mp -61.99 -41.64 91.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.597 -179.809 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 75.6 mt-10 -60.54 -49.43 77.59 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.962 -178.718 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 39.7 tp10 -68.3 -42.51 79.35 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.852 -178.878 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 91.1 mt-10 -69.48 -32.27 71.05 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.762 -178.911 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -57.38 -30.95 65.31 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.566 -179.588 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 21.1 m -63.65 -52.84 59.01 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.738 -179.253 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -66.76 -28.75 68.65 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.351 179.754 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.451 -0.388 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.836 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' SER . . . . . 0.599 ' HG ' ' H ' ' A' ' 110' ' ' GLY . 18.9 p . . . . . 0 C--O 1.231 0.128 0 CA-C-O 120.756 0.312 . . . . 0.0 110.386 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . 0.599 ' H ' ' HG ' ' A' ' 109' ' ' SER . . . -75.52 -28.67 61.05 Favored Glycine 0 CA--C 1.525 0.682 0 N-CA-C 111.008 -0.837 . . . . 0.0 111.008 178.896 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . 0.459 ' N ' ' OE1' ' A' ' 111' ' ' GLU . 13.1 mp0 -56.78 -27.53 59.84 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.76 0.314 . . . . 0.0 110.536 -179.354 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 30.6 m-85 -53.28 -26.03 16.9 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.456 179.618 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 66.5 m -50.9 -34.48 28.54 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.538 179.934 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -57.41 -31.52 65.93 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.394 179.175 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 45.7 ttm -77.99 -40.45 39.1 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.936 179.448 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 30.4 t80 -64.06 -31.69 72.97 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.431 179.606 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 94.2 m-20 -59.92 -35.75 75.56 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.606 -179.409 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 81.5 mt -56.62 -38.61 72.33 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.326 179.743 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 119' ' ' MET . . . . . 0.478 ' C ' ' SD ' ' A' ' 119' ' ' MET . 0.0 OUTLIER -56.4 -50.13 72.48 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.476 179.612 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 68.6 t80 -63.84 -44.3 93.58 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.959 0.409 . . . . 0.0 110.693 -179.735 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . 0.405 ' O ' ' CD ' ' A' ' 125' ' ' PRO . 78.0 tt0 -53.98 -40.11 66.63 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.566 -179.706 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 95.1 t -83.42 -18.97 10.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.746 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 51.4 p -71.31 -30.29 66.06 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.809 -178.874 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . 0.499 ' CB ' ' HD3' ' A' ' 125' ' ' PRO . 5.6 mmtp -69.58 -55.2 9.63 Favored Pre-proline 0 C--N 1.33 -0.241 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.279 -177.509 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 125' ' ' PRO . . . . . 0.499 ' HD3' ' CB ' ' A' ' 124' ' ' LYS . 68.3 Cg_exo -50.66 -44.45 40.44 Favored 'Trans proline' 0 C--N 1.306 -1.707 0 C-N-CA 122.61 2.207 . . . . 0.0 111.887 179.06 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 75.4 mt -64.01 -21.2 66.4 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.575 -179.479 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 6.4 tm0? -62.91 -49.47 74.67 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.863 -179.627 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 70.7 mmtt -62.11 -6.75 3.23 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.443 -179.718 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 1.1 tt -108.2 -50.71 3.0 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.562 179.792 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 130' ' ' GLY . . . . . 0.593 ' O ' ' C ' ' A' ' 131' ' ' ILE . . . 170.83 -120.97 0.88 Allowed Glycine 0 CA--C 1.52 0.36 0 N-CA-C 110.935 -0.866 . . . . 0.0 110.935 -179.688 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 131' ' ' ILE . . . . . 0.593 ' C ' ' O ' ' A' ' 130' ' ' GLY . 81.1 mt 21.83 94.23 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 120.65 0.262 . . . . 0.0 110.712 179.976 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 132' ' ' GLN . . . . . 0.485 ' O ' ' HG2' ' A' ' 133' ' ' GLU . 47.0 tt0 -117.59 158.66 24.23 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.542 -179.642 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 133' ' ' GLU . . . . . 0.485 ' HG2' ' O ' ' A' ' 132' ' ' GLN . 0.6 OUTLIER 79.57 -12.17 1.1 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.539 179.173 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 26.4 ttm -58.5 -22.41 55.05 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.508 -179.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 34.9 m -67.79 -65.85 0.64 Allowed 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.689 179.559 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 136' ' ' LYS . . . . . 0.477 ' O ' ' N ' ' A' ' 140' ' ' ASP . 19.4 ttmm -51.4 -33.57 30.79 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.676 -0.491 . . . . 0.0 109.676 179.135 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 99.8 m -54.19 -66.05 0.46 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.654 -179.448 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 7.2 p -62.39 -33.38 58.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.624 -179.127 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 1.2 p -71.31 -31.93 68.02 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.613 -179.881 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 140' ' ' ASP . . . . . 0.477 ' N ' ' O ' ' A' ' 136' ' ' LYS . 49.9 t0 -68.89 -27.6 65.93 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.497 -179.816 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -69.36 -25.97 64.44 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.953 -178.84 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -64.6 -29.12 70.13 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.815 -178.513 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 80.9 mm-40 -67.19 -37.62 83.97 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.678 -179.455 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -65.56 -33.24 75.46 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.599 -179.728 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 145' ' ' ASN . . . . . . . . . . . . . 48.4 t30 -159.75 83.92 2.24 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.529 -179.358 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 146' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_exo -47.13 106.36 0.1 Allowed 'Trans proline' 0 C--N 1.305 -1.739 0 C-N-CA 122.875 2.384 . . . . 0.0 112.098 179.898 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 147' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_exo -48.72 110.57 0.36 Allowed 'Trans proline' 0 C--N 1.304 -1.815 0 C-N-CA 122.774 2.316 . . . . 0.0 112.252 -179.534 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 10.0 t -124.17 1.51 8.51 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.377 179.314 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 149' ' ' THR . . . . . 0.475 ' HG1' ' H ' ' A' ' 150' ' ' ALA . 5.1 t -162.12 -178.99 6.74 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.636 -179.843 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 150' ' ' ALA . . . . . 0.475 ' H ' ' HG1' ' A' ' 149' ' ' THR . . . -62.79 -34.27 76.93 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.583 -179.59 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 12.6 tt0 -66.21 -45.14 81.79 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.741 -179.707 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . -61.43 -44.75 97.63 Favored Glycine 0 CA--C 1.524 0.655 0 N-CA-C 110.869 -0.892 . . . . 0.0 110.869 -179.884 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 153' ' ' VAL . . . . . . . . . . . . . 99.4 t -65.77 -42.78 93.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-O 120.836 0.35 . . . . 0.0 110.468 -179.86 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 7.8 mt -51.46 -31.96 25.19 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.36 179.68 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 34.4 tp10 -64.68 -47.3 78.9 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.327 179.056 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 156' ' ' ILE . . . . . 0.433 ' CD1' ' N ' ' A' ' 156' ' ' ILE . 1.7 mp -64.12 -43.53 97.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.479 179.472 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -49.46 -46.89 48.51 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.358 -179.407 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 63.9 tttp -61.91 -41.91 98.46 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.092 178.89 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -65.42 -31.1 72.02 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.394 179.713 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 160' ' ' MET . . . . . . . . . . . . . 1.6 mtm -67.89 -51.49 47.39 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.869 179.689 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 76.1 ttt180 -67.77 -35.36 78.55 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.455 -179.939 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 81.1 tt0 -62.61 -48.7 78.24 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.89 -178.853 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 163' ' ' LYS . . . . . . . . . . . . . 41.1 tptt -65.42 -33.91 77.06 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.548 -179.43 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 14.2 mt -67.17 -30.45 70.42 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.915 -178.884 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 165' ' ' GLN . . . . . 0.421 ' O ' ' OG1' ' A' ' 169' ' ' THR . 90.1 mt-30 -66.11 -35.17 79.8 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.741 -179.146 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 92.3 mtt-85 -64.73 -34.08 77.49 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.451 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 167' ' ' VAL . . . . . . . . . . . . . 11.1 t -68.39 -43.31 84.25 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.426 0 CA-C-O 120.893 0.378 . . . . 0.0 110.762 179.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 168' ' ' HIS . . . . . 0.402 ' ND1' ' O ' ' A' ' 168' ' ' HIS . 24.9 t-80 -80.01 -33.48 39.21 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.767 -179.546 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 169' ' ' THR . . . . . 0.421 ' OG1' ' O ' ' A' ' 165' ' ' GLN . 91.5 m -70.15 -45.29 67.08 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.991 -178.542 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 58.9 mmtt -60.13 -44.27 95.03 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.612 -179.278 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 171' ' ' ASN . . . . . . . . . . . . . 48.6 t-20 -68.76 -33.05 73.25 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.992 0.425 . . . . 0.0 110.597 -179.703 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 172' ' ' TYR . . . . . 0.569 ' HH ' ' HZ1' ' A' ' 176' ' ' LYS . 53.7 t80 -62.93 -47.39 83.45 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.639 -179.442 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 68.7 m -73.75 -37.63 64.98 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.708 -179.332 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 89.5 m -62.03 -48.37 80.56 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.588 -179.315 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 12.3 tp -66.42 -34.32 77.67 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.548 -179.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 176' ' ' LYS . . . . . 0.569 ' HZ1' ' HH ' ' A' ' 172' ' ' TYR . 23.5 mmtp -78.01 -8.0 57.61 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.972 -179.266 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 177' ' ' LYS . . . . . . . . . . . . . 13.7 ptmt -62.5 -22.8 66.55 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.411 -179.696 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 178' ' ' LYS . . . . . . . . . . . . . 31.7 ttmt . . . . . 0 N--CA 1.455 -0.203 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.836 -179.328 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.527 0.088 0 CA-C-O 120.802 0.334 . . . . 0.0 110.492 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 98.0 m -61.53 -23.53 66.0 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.465 179.725 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 17.2 tptp -68.45 -47.21 67.75 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.245 0.545 . . . . 0.0 110.817 179.606 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . 0.453 ' CD1' ' N ' ' A' ' 33' ' ' ILE . 1.7 mp -57.17 -45.49 84.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 N-CA-C 109.152 -0.684 . . . . 0.0 109.152 -179.33 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 44.8 ttm180 -69.79 -27.79 65.2 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.047 0.451 . . . . 0.0 109.968 -179.703 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 44.5 tp -68.44 -47.9 65.97 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.066 -179.605 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 22.1 pt-20 -76.83 -39.8 50.04 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.612 -179.731 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 79.5 ttt180 -62.94 -42.71 99.89 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.028 -0.533 . . . . 0.0 109.997 -179.15 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 78.0 p -63.84 -26.45 68.62 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.097 0.475 . . . . 0.0 110.256 -179.755 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -83.16 -32.22 26.73 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.067 0.461 . . . . 0.0 111.105 179.366 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -63.81 -35.18 79.77 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.015 -0.538 . . . . 0.0 111.0 -179.003 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . 0.496 ' OD1' ' N ' ' A' ' 42' ' ' ILE . 15.2 p30 -61.92 -23.62 66.46 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.669 -179.261 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.496 ' N ' ' OD1' ' A' ' 41' ' ' ASP . 75.3 mt -59.84 -49.74 82.73 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.633 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.676 -179.097 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 40.3 p -72.6 -36.73 68.17 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.047 0.451 . . . . 0.0 111.305 -178.76 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 66.4 t0 -63.0 -39.94 96.26 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.96 -178.232 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 68.2 mm-40 -71.16 -55.92 7.16 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 112.233 0.456 . . . . 0.0 112.233 -179.285 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 7.0 pt -62.0 -26.33 39.73 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.107 -178.788 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -65.47 -39.09 91.57 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.91 -0.587 . . . . 0.0 110.687 -179.836 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.16 -24.33 67.12 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-O 121.059 0.457 . . . . 0.0 110.687 -178.89 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 65.2 mt -65.94 -52.82 44.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.007 -0.542 . . . . 0.0 112.365 -178.249 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 38.5 pttt -59.33 -30.19 68.18 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.857 -178.554 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 49.6 mtpt -63.89 -43.98 94.38 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.33 -179.678 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -65.42 -43.47 90.44 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.559 -179.895 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -58.34 -30.45 66.74 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.754 -179.578 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -66.47 -35.61 80.69 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.006 -179.858 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 53.7 mt . . . . . 0 C--N 1.325 -0.468 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.31 -178.945 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 17.1 m120 . . . . . 0 CA--C 1.532 0.284 0 N-CA-C 110.265 -0.272 . . . . 0.0 110.265 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -73.52 -8.23 21.38 Favored 'Trans proline' 0 N--CA 1.489 1.236 0 C-N-CA 122.79 2.327 . . . . 0.0 112.003 -179.343 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 53.4 t80 -76.96 -50.94 12.06 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.04 0.448 . . . . 0.0 110.275 -179.92 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 16.8 tt -75.48 -27.58 19.26 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.144 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.307 -179.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 3.1 mp -74.0 -37.96 64.25 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.6 179.776 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 10.5 mm-40 -63.14 -25.19 68.24 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.377 -179.858 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -65.98 -45.21 82.47 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.747 -179.35 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 6.5 ttpm? -55.97 -25.75 45.22 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.627 -179.735 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 26.9 t -74.49 -46.17 43.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.724 179.685 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 91.2 mtm180 -67.25 -28.03 67.71 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.167 0.508 . . . . 0.0 110.377 -179.705 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -58.41 -41.37 84.78 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.012 -179.204 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 68.7 p -76.86 -24.1 52.65 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.716 -179.906 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 86.2 m -60.23 -51.92 67.51 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.805 -178.947 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 56.1 t -67.92 -43.34 85.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.693 -179.396 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -64.13 -31.8 73.13 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.854 -179.065 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -55.43 -41.81 73.31 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.004 -179.579 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -58.09 -34.04 69.75 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.595 -179.325 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 46.0 t80 -71.29 -45.48 63.0 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.902 -179.91 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 57.3 t -53.18 -56.87 6.14 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.793 -177.627 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 23.3 pt -54.14 -30.71 20.68 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.661 -179.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -52.56 -41.89 63.97 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.351 -179.641 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . 0.469 ' CD1' ' N ' ' A' ' 96' ' ' ILE . 1.6 mp -63.87 -41.81 93.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 116.073 -0.512 . . . . 0.0 109.945 179.255 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 79.4 tt0 -61.18 -49.89 75.38 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.073 -178.452 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 80.9 mm-40 -68.04 -41.41 82.13 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.42 -179.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 48.5 tp10 -62.1 -43.07 99.64 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.284 -179.88 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -62.36 -35.66 79.84 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.877 0.37 . . . . 0.0 110.572 -179.545 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 99.3 m -59.3 -43.4 92.62 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.164 -179.698 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 60.1 mttp -55.69 -36.43 67.13 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.237 -0.438 . . . . 0.0 109.849 -179.459 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . 0.483 ' CD2' ' N ' ' A' ' 103' ' ' LEU . 4.2 mm? . . . . . 0 CA--C 1.511 -0.556 0 N-CA-C 109.916 -0.402 . . . . 0.0 109.916 179.112 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.462 0.166 0 CA-C-O 120.924 0.392 . . . . 0.0 110.449 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . 0.401 ' O ' ' OG ' ' A' ' 113' ' ' SER . . . -66.97 -28.03 73.64 Favored Glycine 0 CA--C 1.523 0.559 0 N-CA-C 110.686 -0.966 . . . . 0.0 110.686 -179.9 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 82.0 tt0 -61.23 -43.29 99.12 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.794 0.33 . . . . 0.0 110.544 -179.312 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 70.2 m-85 -65.43 -40.15 92.98 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.608 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 113' ' ' SER . . . . . 0.401 ' OG ' ' O ' ' A' ' 110' ' ' GLY . 59.8 p -57.12 -31.91 65.8 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.33 -179.509 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -63.9 -29.58 70.75 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.445 179.592 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 37.3 mtp -74.95 -51.93 12.48 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.485 -179.221 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 41.6 t80 -50.15 -35.88 27.85 Favored 'General case' 0 N--CA 1.463 0.194 0 N-CA-C 110.042 -0.355 . . . . 0.0 110.042 -179.427 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 97.2 m-20 -61.8 -41.89 98.32 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.184 -0.462 . . . . 0.0 109.841 179.352 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 1.4 tt -59.66 -40.56 88.16 Favored 'General case' 0 C--O 1.222 -0.343 0 CA-C-O 121.369 0.604 . . . . 0.0 109.685 -179.761 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 119' ' ' MET . . . . . 0.444 ' C ' ' SD ' ' A' ' 119' ' ' MET . 0.1 OUTLIER -53.15 -45.96 68.63 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.187 0.518 . . . . 0.0 109.858 -179.456 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 50.5 t80 -63.43 -41.21 98.69 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.176 0.512 . . . . 0.0 110.652 -179.013 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 14.5 mm-40 -55.48 -48.48 74.48 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.289 -178.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 31.1 m -71.27 -16.93 19.58 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.524 0 O-C-N 123.429 0.456 . . . . 0.0 110.819 -179.491 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 9.4 m -72.34 -24.98 61.37 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-O 121.191 0.519 . . . . 0.0 110.748 179.593 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . 0.521 ' N ' ' HD2' ' A' ' 125' ' ' PRO . 2.5 mptp? -65.05 -57.8 14.56 Favored Pre-proline 0 C--N 1.323 -0.578 0 CA-C-N 116.194 -0.457 . . . . 0.0 112.113 -179.376 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 125' ' ' PRO . . . . . 0.521 ' HD2' ' N ' ' A' ' 124' ' ' LYS . 30.2 Cg_endo -60.32 -30.63 91.48 Favored 'Trans proline' 0 C--N 1.307 -1.644 0 C-N-CA 122.441 2.094 . . . . 0.0 112.453 -179.01 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 92.6 mt -70.69 -24.82 62.74 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.71 179.854 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 55.2 tt0 -65.21 -39.43 92.77 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.148 -179.99 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 17.0 tptm -50.27 -44.37 53.7 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 120.576 -0.449 . . . . 0.0 110.546 -178.249 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 18.5 mt -57.52 -110.37 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.824 178.727 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 130' ' ' GLY . . . . . 0.42 ' C ' ' NE2' ' A' ' 132' ' ' GLN . . . -147.85 17.25 1.41 Allowed Glycine 0 C--N 1.332 0.356 0 N-CA-C 110.876 -0.889 . . . . 0.0 110.876 -179.489 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 76.3 mt -111.71 115.22 49.26 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.393 0 CA-C-O 120.904 0.383 . . . . 0.0 110.247 179.816 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 132' ' ' GLN . . . . . 0.497 ' C ' ' H ' ' A' ' 134' ' ' MET . 8.1 mp0 -139.93 -178.71 5.56 Favored 'General case' 0 CA--C 1.508 -0.645 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.077 -179.701 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 133' ' ' GLU . . . . . 0.47 ' HB2' ' O ' ' A' ' 132' ' ' GLN . 75.0 mt-10 75.48 -21.91 0.29 Allowed 'General case' 0 CA--C 1.52 -0.195 0 O-C-N 123.895 0.747 . . . . 0.0 110.622 179.497 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 134' ' ' MET . . . . . 0.497 ' H ' ' C ' ' A' ' 132' ' ' GLN . 48.5 mtp -51.27 -23.25 3.34 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.165 179.662 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 34.7 p -63.0 -63.82 1.09 Allowed 'General case' 0 C--O 1.221 -0.411 0 CA-C-O 121.486 0.66 . . . . 0.0 109.251 179.625 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 136' ' ' LYS . . . . . 0.483 ' O ' ' N ' ' A' ' 140' ' ' ASP . 59.0 mmtt -51.38 -38.3 52.63 Favored 'General case' 0 C--N 1.318 -0.791 0 O-C-N 121.661 -0.649 . . . . 0.0 109.827 179.549 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 46.1 m -54.84 -66.01 0.48 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.548 -179.547 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 14.8 p -63.33 -34.65 68.4 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.146 -178.902 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 5.8 p -73.22 -33.55 65.41 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.758 -178.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 140' ' ' ASP . . . . . 0.483 ' N ' ' O ' ' A' ' 136' ' ' LYS . 8.9 t70 -65.1 -30.73 71.7 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.427 -179.614 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -62.91 -27.22 69.22 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.778 -179.176 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -59.85 -28.91 67.91 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.67 -179.169 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 70.0 mm-40 -81.53 66.16 6.97 Favored 'General case' 0 CA--C 1.517 -0.291 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.543 -179.777 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER 175.78 -37.93 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.783 -179.981 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 145' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -143.62 73.83 17.04 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.138 -179.318 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 146' ' ' PRO . . . . . 0.656 ' C ' ' H ' ' A' ' 148' ' ' THR . 86.8 Cg_exo -38.7 106.47 0.05 OUTLIER 'Trans proline' 0 C--N 1.32 -0.956 0 C-N-CA 122.945 2.43 . . . . 0.0 111.8 179.89 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 147' ' ' PRO . . . . . 0.583 ' C ' ' H ' ' A' ' 149' ' ' THR . 49.6 Cg_exo -55.17 10.27 0.03 OUTLIER 'Trans proline' 0 C--N 1.309 -1.551 0 C-N-CA 122.665 2.243 . . . . 0.0 112.4 179.224 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 148' ' ' THR . . . . . 0.656 ' H ' ' C ' ' A' ' 146' ' ' PRO . 61.8 m -55.38 -2.65 0.05 OUTLIER 'General case' 0 N--CA 1.445 -0.713 0 CA-C-O 120.744 0.307 . . . . 0.0 110.714 179.303 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 149' ' ' THR . . . . . 0.583 ' H ' ' C ' ' A' ' 147' ' ' PRO . 62.5 p -124.28 162.55 23.51 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-O 121.012 0.434 . . . . 0.0 110.223 179.458 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -68.05 -47.53 68.11 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.716 -179.814 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 87.1 mt-30 -66.14 -30.27 70.73 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.621 -179.812 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . -59.98 -34.29 82.67 Favored Glycine 0 CA--C 1.523 0.553 0 N-CA-C 111.085 -0.806 . . . . 0.0 111.085 -179.287 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 153' ' ' VAL . . . . . . . . . . . . . 62.4 t -65.61 -41.68 91.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 120.783 0.325 . . . . 0.0 110.688 -179.798 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 78.9 mt -45.31 -37.58 4.94 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.598 -179.108 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -62.3 -58.82 6.31 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.136 178.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 156' ' ' ILE . . . . . 0.438 HG22 HD11 ' A' ' 156' ' ' ILE . 24.0 mm -53.68 -42.63 51.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.735 -179.439 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -56.71 -47.58 79.63 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 123.562 0.539 . . . . 0.0 110.548 178.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 34.8 tptt -61.66 -36.61 81.32 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.376 -179.797 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -72.32 -30.19 64.53 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.476 -179.658 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 160' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -66.11 -50.95 62.25 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.266 179.742 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 61.6 ttp180 -65.0 -31.24 72.38 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.099 179.522 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 40.9 tp10 -64.34 -61.31 2.31 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.124 -178.77 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 163' ' ' LYS . . . . . . . . . . . . . 23.9 tptp -60.36 -34.36 73.75 Favored 'General case' 0 N--CA 1.447 -0.605 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.533 -179.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 38.3 tp -66.21 -37.84 86.52 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.249 -179.881 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 65.9 mm-40 -70.14 -28.37 65.31 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.909 -179.64 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 166' ' ' ARG . . . . . 0.629 ' HE ' ' HZ2' ' A' ' 170' ' ' LYS . 76.0 ttt180 -63.76 -34.13 77.21 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.399 -179.91 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 167' ' ' VAL . . . . . . . . . . . . . 70.1 t -67.04 -43.69 88.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.321 -179.667 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 12.6 t60 -78.59 -31.57 47.24 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.816 -179.277 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 169' ' ' THR . . . . . . . . . . . . . 92.6 m -68.5 -47.03 68.07 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.849 -179.49 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 170' ' ' LYS . . . . . 0.629 ' HZ2' ' HE ' ' A' ' 166' ' ' ARG . 28.1 mmtp -60.74 -45.39 94.48 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.694 -179.539 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 171' ' ' ASN . . . . . . . . . . . . . 6.8 m120 -66.61 -36.82 83.53 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.51 179.58 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 172' ' ' TYR . . . . . . . . . . . . . 84.4 t80 -66.53 -41.6 88.51 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.67 -179.434 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 41.0 t -67.75 -39.64 84.2 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.685 -179.444 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 31.4 p -66.01 -34.94 79.23 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.794 -179.62 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 175' ' ' LEU . . . . . 0.422 ' C ' ' H ' ' A' ' 177' ' ' LYS . 6.3 mt -64.17 -38.45 91.11 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.032 179.497 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 66.3 mmtt -62.4 -5.76 2.74 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.527 179.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 177' ' ' LYS . . . . . 0.422 ' H ' ' C ' ' A' ' 175' ' ' LEU . 62.9 tttp -63.76 -42.16 97.86 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.823 179.548 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 178' ' ' LYS . . . . . . . . . . . . . 98.9 mttt . . . . . 0 C--N 1.326 -0.443 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.649 -179.827 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.172 0 CA-C-O 120.892 0.377 . . . . 0.0 110.648 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 24.8 m -64.14 -31.18 72.27 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.1 179.568 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 55.7 tptt -63.36 -50.19 70.91 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 120.315 -0.554 . . . . 0.0 110.646 -179.478 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 71.4 mt -63.16 -27.95 44.12 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.003 -178.921 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 41.4 ttm180 -71.41 -39.46 71.11 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.889 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 64.9 mt -68.93 -37.71 79.07 Favored 'General case' 0 CA--C 1.514 -0.415 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.73 -179.583 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 47.0 tp10 -73.21 -43.37 61.41 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.496 -179.741 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 43.7 ttm180 -63.4 -43.75 96.64 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.588 -179.324 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 37.9 m -69.0 -29.68 67.92 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.273 -179.961 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -75.05 -36.27 61.84 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.902 179.855 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -65.42 -31.42 72.51 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.832 -179.556 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 10.9 m-20 -66.93 -24.67 66.11 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.967 -179.635 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 98.3 mt -64.37 -48.42 85.37 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.311 0 C-N-CA 120.678 -0.409 . . . . 0.0 111.088 -179.19 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 77.2 p -73.23 -38.66 65.97 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.102 -178.712 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 65.6 t0 -64.0 -37.89 89.09 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.663 -179.364 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 9.9 tm-20 -67.36 -49.53 63.59 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.922 0.391 . . . . 0.0 111.434 -179.352 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 8.4 pt -72.18 -26.71 25.3 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.732 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.46 -179.614 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -62.33 -42.31 99.28 Favored 'General case' 0 C--N 1.322 -0.609 0 C-N-CA 120.729 -0.389 . . . . 0.0 110.525 179.337 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -53.22 -27.68 23.15 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.215 -178.918 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 66.2 mt -63.11 -45.76 97.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.077 179.62 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 23.3 mmtp -54.57 -41.31 69.7 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.153 -179.17 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 28.3 mmtp -65.51 -43.73 89.18 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.588 179.624 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 47.3 t0 -62.06 -43.86 97.92 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.386 -179.731 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -58.99 -30.73 68.19 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.909 -179.809 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -56.09 -37.45 69.38 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.054 -179.392 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.417 ' N ' ' CD1' ' A' ' 55' ' ' LEU . 10.0 mp . . . . . 0 C--N 1.326 -0.455 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.131 -178.487 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . 0.452 ' N ' ' OD1' ' A' ' 75' ' ' ASN . 1.4 m-20 . . . . . 0 CA--C 1.535 0.388 0 N-CA-C 110.664 -0.124 . . . . 0.0 110.664 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -70.19 6.07 1.6 Allowed 'Trans proline' 0 N--CA 1.494 1.53 0 C-N-CA 122.156 1.904 . . . . 0.0 112.156 -179.26 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 68.0 t80 -77.52 -58.99 2.97 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.948 0.404 . . . . 0.0 111.515 -179.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 19.6 tt -75.64 -27.98 19.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.768 -179.643 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 82.9 mt -73.54 -49.95 23.84 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.463 -178.855 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 99.2 mt-10 -64.45 -22.79 67.07 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.298 179.859 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -59.69 -28.44 67.3 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.867 0.365 . . . . 0.0 110.912 -179.862 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -69.44 -20.48 63.77 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.536 -179.921 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 50.3 t -73.66 -45.08 51.75 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-O 120.998 0.428 . . . . 0.0 110.805 179.621 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 84.3 mtp180 -66.95 -35.39 79.87 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.553 -179.799 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -66.15 -39.36 89.77 Favored 'General case' 0 CA--C 1.517 -0.324 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.58 -179.701 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 34.0 p -78.91 -14.5 59.19 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.716 -179.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 33.4 m -62.07 -54.5 40.46 Favored 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 120.417 -0.513 . . . . 0.0 111.456 -179.224 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 13.2 p -79.76 -44.55 23.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-O 121.35 0.595 . . . . 0.0 111.491 179.008 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -53.58 -49.36 67.9 Favored 'General case' 0 CA--C 1.52 -0.208 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.324 -176.672 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . 0.451 ' CG ' ' N ' ' A' ' 91' ' ' LYS . 16.0 pt-20 -58.74 -45.67 89.14 Favored 'General case' 0 C--N 1.315 -0.911 0 C-N-CA 120.793 -0.363 . . . . 0.0 110.807 -179.91 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . 0.451 ' N ' ' CG ' ' A' ' 90' ' ' GLU . 98.3 mttt -58.23 -36.51 73.28 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.064 -0.517 . . . . 0.0 109.856 -179.194 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 56.4 t80 -62.43 -41.6 98.84 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.834 179.612 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 81.0 t -58.27 -45.08 89.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.203 -179.142 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 65.4 mt -53.93 -42.12 52.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-O 120.802 0.334 . . . . 0.0 110.331 -179.818 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -52.47 -36.99 56.06 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.22 -179.679 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 34.9 mm -65.45 -43.54 94.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.301 -179.773 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -64.87 -49.24 71.3 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.752 -179.674 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 80.8 tt0 -63.54 -38.98 93.19 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.011 0.434 . . . . 0.0 110.413 -179.364 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -71.19 -28.98 64.62 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.296 -179.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -65.84 -52.38 50.93 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.657 -179.181 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 1.7 t -58.27 -35.41 71.74 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.812 -179.535 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 47.3 mttp -63.77 -29.06 70.31 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.666 179.806 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 67.1 mt . . . . . 0 C--N 1.33 -0.264 0 CA-C-O 120.732 0.301 . . . . 0.0 110.691 -179.476 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 69.0 p . . . . . 0 N--CA 1.466 0.341 0 CA-C-O 120.904 0.383 . . . . 0.0 110.432 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -72.25 -28.31 68.35 Favored Glycine 0 CA--C 1.525 0.657 0 N-CA-C 111.341 -0.704 . . . . 0.0 111.341 179.666 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 79.9 tt0 -54.38 -34.29 60.92 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.71 0.291 . . . . 0.0 110.753 -179.129 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 61.4 m-85 -61.25 -39.04 88.84 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.607 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 40.0 t -58.84 -39.9 82.63 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.34 -179.793 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -63.7 -35.71 81.47 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.79 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 96.1 mtp -68.1 -40.35 82.62 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.131 -179.901 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 29.7 t80 -58.67 -28.13 65.45 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.313 179.87 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 66.3 t0 -57.54 -35.26 70.08 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.91 0.386 . . . . 0.0 110.48 -179.112 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 21.3 mt -58.5 -40.48 82.92 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.052 0.453 . . . . 0.0 110.034 -179.62 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.26 -53.6 52.75 Favored 'General case' 0 C--N 1.313 -0.996 0 C-N-CA 120.083 -0.647 . . . . 0.0 110.058 -179.335 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 52.8 t80 -59.36 -47.05 86.91 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.112 -179.316 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 51.3 tp10 -60.16 -35.38 75.19 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.089 -179.496 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 42.8 t -83.45 -19.85 9.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 N-CA-C 110.001 -0.37 . . . . 0.0 110.001 179.841 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 60.0 p -74.88 -27.2 60.15 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.931 0.396 . . . . 0.0 111.213 -179.612 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . 0.48 ' N ' ' HD2' ' A' ' 125' ' ' PRO . 8.0 mmtp -66.29 -57.25 13.28 Favored Pre-proline 0 C--N 1.323 -0.585 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.53 -179.541 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 125' ' ' PRO . . . . . 0.48 ' HD2' ' N ' ' A' ' 124' ' ' LYS . 23.8 Cg_endo -58.44 -31.66 94.63 Favored 'Trans proline' 0 C--N 1.314 -1.242 0 C-N-CA 122.24 1.96 . . . . 0.0 111.837 -179.358 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 81.2 mt -68.34 -32.53 72.71 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.676 -179.942 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -59.24 -47.05 86.78 Favored 'General case' 0 C--N 1.317 -0.82 0 C-N-CA 120.406 -0.517 . . . . 0.0 110.421 -179.29 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -69.67 -11.74 61.08 Favored 'General case' 0 CA--C 1.509 -0.619 0 CA-C-N 116.041 -0.527 . . . . 0.0 109.799 -179.614 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -87.45 -55.93 3.58 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.168 0.509 . . . . 0.0 110.5 -179.741 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -175.67 -137.68 2.62 Favored Glycine 0 N--CA 1.451 -0.353 0 N-CA-C 110.675 -0.97 . . . . 0.0 110.675 -179.084 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 131' ' ' ILE . . . . . 0.492 ' CG2' ' H ' ' A' ' 132' ' ' GLN . 1.7 mt 54.26 -150.38 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 N-CA-C 109.944 -0.391 . . . . 0.0 109.944 179.309 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 132' ' ' GLN . . . . . 0.492 ' H ' ' CG2' ' A' ' 131' ' ' ILE . 4.6 tt0 179.99 138.15 0.12 Allowed 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.424 179.785 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 51.06 24.74 2.0 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.882 0.372 . . . . 0.0 110.848 178.479 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 10.4 tpt -58.95 -40.19 83.94 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.895 -0.593 . . . . 0.0 109.985 -179.605 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 21.7 m -74.19 -61.34 1.89 Allowed 'General case' 0 N--CA 1.467 0.413 0 CA-C-O 121.606 0.717 . . . . 0.0 110.284 -179.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 2.2 tppp? -49.31 -42.17 40.58 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-O 121.518 0.675 . . . . 0.0 110.451 -178.354 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 137' ' ' THR . . . . . 0.717 ' HG1' ' HZ2' ' A' ' 163' ' ' LYS . 23.0 m -56.11 -68.49 0.2 Allowed 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.298 -0.864 . . . . 0.0 111.194 -179.241 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 14.6 p -55.92 -34.74 38.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 C-N-CA 120.723 -0.391 . . . . 0.0 110.681 -178.629 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 139' ' ' SER . . . . . 0.632 ' HG ' ' N ' ' A' ' 140' ' ' ASP . 25.0 p -63.91 -36.89 85.44 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.622 -179.863 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 140' ' ' ASP . . . . . 0.632 ' N ' ' HG ' ' A' ' 139' ' ' SER . 57.0 t0 -66.19 -28.06 68.48 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.594 179.811 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -67.23 -42.34 84.18 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-O 120.837 0.351 . . . . 0.0 111.1 -179.655 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -62.94 -30.13 71.33 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.396 -179.513 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 77.5 tt0 -68.31 -39.98 81.85 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.768 0.318 . . . . 0.0 110.71 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 78.7 tt0 -70.27 -41.32 73.58 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.904 -179.591 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 145' ' ' ASN . . . . . . . . . . . . . 30.0 m120 -135.27 76.57 56.54 Favored Pre-proline 0 N--CA 1.468 0.45 0 CA-C-N 116.607 -0.269 . . . . 0.0 110.556 -179.459 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 146' ' ' PRO . . . . . . . . . . . . . 78.5 Cg_exo -48.72 109.59 0.27 Allowed 'Trans proline' 0 N--CA 1.492 1.4 0 C-N-CA 122.601 2.201 . . . . 0.0 111.45 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 147' ' ' PRO . . . . . . . . . . . . . 85.1 Cg_exo -46.86 116.93 1.87 Allowed 'Trans proline' 0 N--CA 1.494 1.505 0 C-N-CA 121.813 1.675 . . . . 0.0 112.472 -179.759 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 9.1 m -130.7 -7.64 4.06 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.637 179.247 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 149' ' ' THR . . . . . 0.44 ' CG2' ' N ' ' A' ' 150' ' ' ALA . 85.3 m -159.51 167.34 28.84 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.849 0.357 . . . . 0.0 110.266 179.506 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 150' ' ' ALA . . . . . 0.44 ' N ' ' CG2' ' A' ' 149' ' ' THR . . . -51.91 -28.91 17.92 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.131 179.769 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 84.7 mt-30 -73.07 -40.48 65.0 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.476 179.501 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . -59.53 -46.09 94.53 Favored Glycine 0 C--O 1.223 -0.555 0 N-CA-C 111.015 -0.834 . . . . 0.0 111.015 -179.593 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 153' ' ' VAL . . . . . . . . . . . . . 58.3 t -63.4 -42.25 95.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-O 120.831 0.348 . . . . 0.0 110.459 -179.807 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -51.28 -36.17 40.92 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.254 -178.881 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 97.3 mt-10 -67.51 -33.79 75.8 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.082 -179.952 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 11.6 mm -77.82 -39.08 25.81 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.275 0 CA-C-O 121.028 0.442 . . . . 0.0 111.024 179.496 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -62.4 -40.69 97.31 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.641 -179.127 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -60.11 -45.87 91.51 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.045 0.45 . . . . 0.0 110.041 -179.802 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 61.8 tttm -66.65 -27.56 67.77 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.92 -179.716 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 160' ' ' MET . . . . . . . . . . . . . 22.6 mtp -74.17 -51.63 14.95 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.883 0.373 . . . . 0.0 110.451 -179.492 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 28.7 ttm180 -64.56 -37.47 87.67 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.671 -179.196 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 51.4 mm-40 -62.21 -42.73 99.56 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.854 -179.214 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 163' ' ' LYS . . . . . 0.717 ' HZ2' ' HG1' ' A' ' 137' ' ' THR . 86.5 tttt -65.44 -55.22 19.17 Favored 'General case' 0 C--N 1.323 -0.547 0 C-N-CA 120.316 -0.553 . . . . 0.0 110.653 -179.191 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 9.1 mp -53.34 -32.45 49.17 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.948 0.404 . . . . 0.0 110.152 -179.333 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 61.2 tp60 -62.09 -45.92 91.39 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.439 -179.412 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 69.2 ttp85 -64.3 -30.76 71.79 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.24 0.543 . . . . 0.0 111.041 -179.845 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 167' ' ' VAL . . . . . . . . . . . . . 56.0 t -69.56 -44.84 79.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 115.41 -0.814 . . . . 0.0 110.511 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 168' ' ' HIS . . . . . 0.423 ' O ' ' ND1' ' A' ' 168' ' ' HIS . 31.0 t-80 -77.7 -30.3 51.76 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.081 179.995 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 169' ' ' THR . . . . . 0.442 ' O ' ' SG ' ' A' ' 173' ' ' CYS . 91.3 m -69.26 -49.84 52.5 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.841 -179.913 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 28.5 mmtp -63.73 -45.05 91.65 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.828 0.346 . . . . 0.0 111.068 -179.263 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 171' ' ' ASN . . . . . . . . . . . . . 97.9 m-20 -65.21 -39.71 93.14 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.121 -179.753 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 172' ' ' TYR . . . . . . . . . . . . . 66.2 t80 -75.04 -34.42 61.86 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.799 179.83 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 173' ' ' CYS . . . . . 0.442 ' SG ' ' O ' ' A' ' 169' ' ' THR . 66.9 m -71.62 -23.05 61.64 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.482 179.95 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 19.3 m -62.25 -42.77 99.62 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.689 -179.815 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 175' ' ' LEU . . . . . 0.402 ' N ' ' CD1' ' A' ' 175' ' ' LEU . 10.1 mp -65.83 -34.61 78.55 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.575 -179.238 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -55.49 -30.79 61.27 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.322 -179.553 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 177' ' ' LYS . . . . . . . . . . . . . 85.8 tttt -61.08 -33.75 73.83 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.57 179.543 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 178' ' ' LYS . . . . . . . . . . . . . 55.7 mtpt . . . . . 0 C--N 1.32 -0.68 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.085 -179.912 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.144 0 CA-C-O 120.957 0.408 . . . . 0.0 110.315 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 19.6 m -65.4 -35.38 80.76 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.585 179.653 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 64.0 tttp -62.72 -53.14 58.95 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.046 0.45 . . . . 0.0 110.685 -179.57 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 71.1 mt -63.1 -30.23 49.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.093 -179.842 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 40.5 ttm180 -67.23 -41.97 84.82 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.754 -179.85 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 46.8 mt -73.47 -36.37 65.82 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.504 -0.316 . . . . 0.0 111.132 -179.61 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 78.6 tt0 -63.18 -50.77 69.03 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.537 -179.112 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -69.93 -44.61 69.23 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.841 0.353 . . . . 0.0 110.628 -179.671 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 70.3 m -62.68 -35.81 80.87 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.614 -179.974 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -73.69 -39.65 64.23 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.351 -179.913 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 37.4 ttmt -61.44 -31.94 71.9 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.66 -179.051 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -68.18 -23.52 64.86 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.73 -179.437 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 63.5 mt -64.91 -50.38 75.36 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 C-N-CA 120.627 -0.429 . . . . 0.0 111.333 -179.143 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 71.9 p -75.24 -42.28 55.64 Favored 'General case' 0 C--O 1.223 -0.321 0 CA-C-O 121.043 0.449 . . . . 0.0 111.762 -178.662 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 82.2 m-20 -62.11 -34.34 76.15 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.773 -178.322 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 55.5 mm-40 -72.76 -56.1 5.76 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.874 0.369 . . . . 0.0 111.571 -179.529 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 9.7 pt -63.81 -27.75 43.52 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.069 -178.838 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 88.4 m-20 -70.72 -35.08 72.54 Favored 'General case' 0 N--CA 1.465 0.275 0 O-C-N 123.342 0.401 . . . . 0.0 110.907 179.841 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -52.66 -21.18 3.69 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.45 -179.501 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . 0.418 ' CG2' ' N ' ' A' ' 50' ' ' LYS . 16.9 tt -60.61 -40.55 84.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.837 -179.501 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.418 ' N ' ' CG2' ' A' ' 49' ' ' ILE . 56.0 mtpt -51.6 -34.92 39.43 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.505 -178.744 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 34.4 mmtp -66.87 -39.5 87.55 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.61 179.865 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 50.5 t0 -70.35 -51.82 27.15 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.776 0.322 . . . . 0.0 110.844 -179.756 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -55.07 -34.34 63.51 Favored 'General case' 0 C--O 1.222 -0.351 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.445 -179.5 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -58.66 -31.69 68.41 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.887 0.375 . . . . 0.0 110.819 179.956 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 61.0 mt . . . . . 0 C--N 1.326 -0.426 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.937 -179.268 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . 0.605 ' C ' ' H ' ' A' ' 77' ' ' PHE . 8.0 m120 . . . . . 0 N--CA 1.472 0.653 0 N-CA-C 109.465 -0.569 . . . . 0.0 109.465 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_exo -59.3 18.62 0.03 OUTLIER 'Trans proline' 0 N--CA 1.498 1.789 0 C-N-CA 122.642 2.228 . . . . 0.0 112.401 179.656 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . 0.605 ' H ' ' C ' ' A' ' 75' ' ' ASN . 75.3 t80 -75.06 -52.75 10.28 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.017 0.437 . . . . 0.0 110.925 179.803 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 15.1 tt -76.33 -27.57 17.66 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.244 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.319 -179.879 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 56.6 mt -72.99 -43.69 61.92 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.032 0.444 . . . . 0.0 111.377 -179.684 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 92.0 mt-10 -67.6 -24.17 65.45 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.54 179.477 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -64.92 -34.33 78.16 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.878 0.37 . . . . 0.0 111.004 -179.9 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 48.7 mtmt -72.89 -20.64 61.05 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.698 -179.663 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 48.3 t -72.81 -44.89 57.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 121.016 0.436 . . . . 0.0 110.61 179.865 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 91.4 mtt-85 -71.14 -30.03 65.98 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.361 -179.874 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -65.07 -46.4 81.31 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.047 0.451 . . . . 0.0 111.568 -179.146 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 5.7 t -75.43 -20.87 58.6 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.288 179.966 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 96.3 m -62.05 -53.54 54.13 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.528 -0.469 . . . . 0.0 111.244 -179.218 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 35.4 t -70.41 -44.32 77.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-O 121.092 0.473 . . . . 0.0 110.829 -179.591 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -59.17 -36.7 75.78 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.971 -0.558 . . . . 0.0 110.601 -179.052 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 84.3 tt0 -56.68 -44.93 81.93 Favored 'General case' 0 C--N 1.323 -0.577 0 C-N-CA 120.565 -0.454 . . . . 0.0 110.515 -179.933 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 9.7 mtpm? -56.66 -39.18 73.29 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.371 -179.3 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 76.9 t80 -59.3 -45.97 89.84 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.806 -179.855 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 65.2 t -56.03 -44.86 79.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-O 120.83 0.348 . . . . 0.0 110.401 -178.817 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 96.7 mt -58.94 -41.17 82.26 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 -179.335 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -56.1 -44.7 79.32 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.464 -0.334 . . . . 0.0 110.751 -179.452 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 44.4 mm -61.42 -41.78 91.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.177 -179.682 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 83.7 tt0 -60.61 -48.57 81.2 Favored 'General case' 0 C--N 1.323 -0.58 0 C-N-CA 120.651 -0.42 . . . . 0.0 110.586 -179.825 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 14.8 mm-40 -66.22 -32.22 73.52 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.561 -179.55 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -59.7 -39.65 85.32 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.417 -179.152 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -59.28 -27.59 65.96 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.037 -0.528 . . . . 0.0 110.302 -179.416 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 8.5 m -60.65 -43.33 97.71 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.504 -179.48 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -71.22 -16.57 62.51 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.472 -179.603 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 77.8 mt . . . . . 0 CA--C 1.5 -0.966 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.406 -179.341 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 15.0 m . . . . . 0 CA--C 1.527 0.091 0 CA-C-O 120.844 0.354 . . . . 0.0 110.449 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -59.04 -33.36 73.99 Favored Glycine 0 CA--C 1.522 0.487 0 N-CA-C 110.792 -0.923 . . . . 0.0 110.792 -179.658 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 42.7 tp10 -66.73 -43.34 84.5 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 120.77 -0.372 . . . . 0.0 110.3 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 112' ' ' PHE . . . . . 0.436 ' O ' ' N ' ' A' ' 115' ' ' MET . 48.3 m-85 -67.62 -37.57 82.68 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.625 -179.956 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 59.9 p -47.31 -34.71 7.08 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.967 0.413 . . . . 0.0 110.67 -179.039 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -76.44 -28.85 56.74 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.778 178.854 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 115' ' ' MET . . . . . 0.436 ' N ' ' O ' ' A' ' 112' ' ' PHE . 60.9 mmm -73.38 -44.71 58.0 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.234 -179.844 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 7.4 m-85 -60.24 -49.43 77.64 Favored 'General case' 0 CA--C 1.513 -0.445 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 -179.388 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 66.8 t0 -47.75 -32.15 5.58 Favored 'General case' 0 N--CA 1.453 -0.28 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 -179.084 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.23 -44.81 95.72 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.73 -179.992 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 119' ' ' MET . . . . . 0.415 ' C ' ' SD ' ' A' ' 119' ' ' MET . 0.0 OUTLIER -52.16 -42.91 63.79 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.238 -0.892 . . . . 0.0 109.724 -178.988 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 85.4 m-85 -68.06 -39.61 82.97 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.06 -179.828 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 87.7 mt-10 -59.61 -45.76 90.96 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.779 -179.344 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 7.7 p -75.08 -24.66 17.88 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.822 0 O-C-N 123.314 0.384 . . . . 0.0 110.042 179.344 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 23.0 t -75.5 -25.75 57.55 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.832 0.348 . . . . 0.0 111.037 179.862 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . 0.463 ' N ' ' HD2' ' A' ' 125' ' ' PRO . 43.6 tptt -59.55 -57.25 28.32 Favored Pre-proline 0 CA--C 1.549 0.92 0 C-N-CA 120.557 -0.457 . . . . 0.0 110.777 179.797 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 125' ' ' PRO . . . . . 0.463 ' HD2' ' N ' ' A' ' 124' ' ' LYS . 31.8 Cg_endo -60.28 -25.78 81.02 Favored 'Trans proline' 0 N--CA 1.489 1.208 0 C-N-CA 122.597 2.198 . . . . 0.0 111.783 -178.387 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -64.65 -32.77 74.57 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.69 -179.211 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 78.6 mt-30 -57.28 -38.22 73.58 Favored 'General case' 0 C--N 1.31 -1.129 0 C-N-CA 120.403 -0.519 . . . . 0.0 110.306 -179.859 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 32.4 mmtp -61.61 -10.98 9.45 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.752 -179.614 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 15.4 mt -114.47 -2.52 13.18 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.973 179.743 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 130' ' ' GLY . . . . . 0.525 ' O ' ' C ' ' A' ' 131' ' ' ILE . . . 114.43 -94.78 0.7 Allowed Glycine 0 CA--C 1.503 -0.687 0 N-CA-C 109.82 -1.312 . . . . 0.0 109.82 179.942 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 131' ' ' ILE . . . . . 0.525 ' C ' ' O ' ' A' ' 130' ' ' GLY . 4.8 mp -3.46 88.46 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.084 0 O-C-N 124.902 1.001 . . . . 0.0 110.703 179.837 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 132' ' ' GLN . . . . . 0.463 ' O ' ' HB2' ' A' ' 133' ' ' GLU . 19.4 tt0 -123.51 162.62 22.54 Favored 'General case' 0 CA--C 1.486 -1.514 0 N-CA-C 107.294 -1.372 . . . . 0.0 107.294 -178.583 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 133' ' ' GLU . . . . . 0.463 ' HB2' ' O ' ' A' ' 132' ' ' GLN . 92.4 mt-10 106.22 -19.4 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.972 0 O-C-N 125.785 1.928 . . . . 0.0 109.757 179.536 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 5.0 mtp -52.85 -48.2 67.22 Favored 'General case' 0 C--N 1.319 -0.735 0 C-N-CA 120.36 -0.536 . . . . 0.0 110.899 -179.277 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 65.7 p -52.58 -21.62 4.07 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.57 178.796 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 70.3 mmtt -83.31 -48.09 10.8 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 115.626 -0.715 . . . . 0.0 111.304 -179.651 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 46.5 p -54.05 -50.22 67.2 Favored 'General case' 0 C--N 1.324 -0.505 0 C-N-CA 120.827 -0.349 . . . . 0.0 110.745 -178.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 58.3 t -68.72 -44.35 82.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.088 -179.881 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 47.6 t -65.34 -41.29 94.07 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.954 0.407 . . . . 0.0 111.14 -179.846 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -64.21 -42.1 96.76 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.665 -179.539 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -63.54 -47.59 80.96 Favored 'General case' 0 CA--C 1.519 -0.248 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.998 -179.626 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -46.54 -35.46 5.8 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.944 -179.292 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -90.61 77.15 6.43 Favored 'General case' 0 CA--C 1.517 -0.301 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 179.509 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 79.2 tt0 -177.64 -61.23 0.01 OUTLIER 'General case' 0 C--N 1.334 -0.077 0 O-C-N 123.593 0.558 . . . . 0.0 110.434 179.644 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 145' ' ' ASN . . . . . . . . . . . . . 7.2 p-10 -143.01 64.63 14.71 Favored Pre-proline 0 N--CA 1.467 0.402 0 CA-C-N 116.196 -0.457 . . . . 0.0 109.897 -179.575 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 146' ' ' PRO . . . . . 0.547 ' O ' ' N ' ' A' ' 148' ' ' THR . 80.7 Cg_exo -34.24 98.78 0.02 OUTLIER 'Trans proline' 0 N--CA 1.491 1.329 0 C-N-CA 123.304 2.669 . . . . 0.0 111.722 -179.503 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 147' ' ' PRO . . . . . 0.546 ' C ' ' H ' ' A' ' 149' ' ' THR . 59.6 Cg_exo -51.48 74.2 0.02 OUTLIER 'Trans proline' 0 N--CA 1.496 1.671 0 C-N-CA 122.354 2.036 . . . . 0.0 113.14 -179.294 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 148' ' ' THR . . . . . 0.547 ' N ' ' O ' ' A' ' 146' ' ' PRO . 8.1 p -73.17 21.43 0.08 Allowed 'General case' 0 C--N 1.329 -0.309 0 O-C-N 121.997 -0.439 . . . . 0.0 109.981 179.883 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 149' ' ' THR . . . . . 0.546 ' H ' ' C ' ' A' ' 147' ' ' PRO . 1.2 t -148.52 156.36 42.34 Favored 'General case' 0 CA--C 1.52 -0.176 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.161 -179.881 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -64.75 -33.78 76.78 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.958 -179.784 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 7.2 tt0 -68.74 -44.41 73.85 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.881 0.372 . . . . 0.0 110.753 -179.784 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . -56.53 -38.3 79.97 Favored Glycine 0 CA--C 1.52 0.366 0 N-CA-C 110.871 -0.892 . . . . 0.0 110.871 -179.198 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 153' ' ' VAL . . . . . . . . . . . . . 75.9 t -53.51 -32.53 20.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 C-N-CA 120.923 -0.311 . . . . 0.0 110.503 -179.392 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 72.5 mt -56.85 -27.47 60.37 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.94 0.4 . . . . 0.0 110.112 -179.505 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 67.3 mm-40 -66.92 -32.82 74.33 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.258 179.583 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 156' ' ' ILE . . . . . 0.407 HD13 HG21 ' A' ' 156' ' ' ILE . 14.7 mm -75.23 -41.53 44.07 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.182 0 CA-C-O 120.931 0.396 . . . . 0.0 110.88 179.605 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -50.8 -39.22 52.3 Favored 'General case' 0 CA--C 1.516 -0.341 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.379 -179.646 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 158' ' ' LYS . . . . . 0.436 ' O ' ' CB ' ' A' ' 162' ' ' GLU . 99.6 mttt -56.38 -56.63 18.76 Favored 'General case' 0 C--O 1.216 -0.664 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.447 179.787 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 42.7 mmtm -57.96 -36.49 72.66 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.757 0.313 . . . . 0.0 111.007 -179.375 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 160' ' ' MET . . . . . . . . . . . . . 6.2 mtp -67.44 -57.4 6.61 Favored 'General case' 0 C--N 1.322 -0.588 0 C-N-CA 120.398 -0.521 . . . . 0.0 110.826 -179.526 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 61.4 ttp180 -68.71 -35.86 77.71 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.881 -179.483 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 162' ' ' GLU . . . . . 0.436 ' CB ' ' O ' ' A' ' 158' ' ' LYS . 81.2 tt0 -65.14 -35.54 81.42 Favored 'General case' 0 CA--C 1.512 -0.495 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.536 -179.275 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 163' ' ' LYS . . . . . . . . . . . . . 23.3 tptm -70.58 -56.5 6.37 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 119.992 -0.683 . . . . 0.0 110.845 -179.131 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 4.8 mt -55.17 -28.96 56.67 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.187 0.518 . . . . 0.0 110.081 -178.519 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 54.3 tt0 -61.71 -47.82 83.56 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.718 -0.673 . . . . 0.0 110.388 -179.71 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -62.09 -30.52 71.06 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.4 0.619 . . . . 0.0 110.731 -179.595 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 167' ' ' VAL . . . . . . . . . . . . . 51.8 t -67.2 -46.57 83.89 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-N 115.038 -0.983 . . . . 0.0 110.693 -179.694 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 168' ' ' HIS . . . . . 0.469 ' O ' ' ND1' ' A' ' 168' ' ' HIS . 23.6 t-80 -79.68 -30.52 41.15 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.193 -179.791 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 169' ' ' THR . . . . . . . . . . . . . 27.5 m -72.99 -45.35 58.41 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.409 -179.904 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 64.7 tttm -61.9 -42.26 98.87 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.663 -179.047 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 171' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -69.84 -31.47 69.35 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.609 179.829 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 172' ' ' TYR . . . . . . . . . . . . . 74.2 t80 -70.05 -32.26 70.29 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.887 -179.833 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 86.5 m -76.24 -32.93 59.15 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.734 -179.822 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 21.4 p -63.62 -37.17 86.33 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.842 0.353 . . . . 0.0 110.477 -179.856 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 94.9 mt -65.49 -34.78 79.07 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.39 -179.928 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 72.6 mmtt -63.44 -8.63 9.64 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.477 -179.818 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 177' ' ' LYS . . . . . . . . . . . . . 62.7 tttm -63.42 -35.86 81.84 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.658 179.124 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 178' ' ' LYS . . . . . . . . . . . . . 99.5 mttt . . . . . 0 C--N 1.325 -0.491 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.863 179.897 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.55 0 CA-C-O 120.988 0.423 . . . . 0.0 109.963 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 25.4 m -49.18 -29.32 5.36 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.55 -178.86 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 21.0 pttp -61.94 -26.3 68.11 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.5 179.596 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 96.6 mt -59.07 -45.12 92.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 -178.549 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 10.1 tpt180 -65.61 -53.07 46.73 Favored 'General case' 0 C--N 1.324 -0.506 0 C-N-CA 120.158 -0.617 . . . . 0.0 110.365 -179.69 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 11.0 mp -59.87 -44.9 93.92 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.054 -0.521 . . . . 0.0 109.696 -178.635 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 80.9 tt0 -58.94 -51.01 71.89 Favored 'General case' 0 C--N 1.32 -0.717 0 C-N-CA 120.479 -0.488 . . . . 0.0 110.234 -179.505 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 16.5 mmm180 -68.69 -42.43 77.8 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.962 0.411 . . . . 0.0 110.968 -179.766 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 52.0 m -67.52 -40.08 85.08 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.609 -179.89 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -61.01 -49.49 77.23 Favored 'General case' 0 C--O 1.219 -0.51 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.491 -179.536 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -54.4 -42.75 70.79 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 120.683 -0.407 . . . . 0.0 110.25 -179.09 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 23.9 m-20 -52.93 -22.87 6.11 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.713 179.594 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 81.1 mt -65.81 -59.01 4.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 C-N-CA 120.184 -0.606 . . . . 0.0 110.98 -179.819 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 82.8 p -76.71 -37.22 56.47 Favored 'General case' 0 C--O 1.225 -0.188 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.657 -179.009 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 52.6 t0 -61.94 -41.04 97.5 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.836 -0.62 . . . . 0.0 112.427 -178.088 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 64.8 mm-40 -69.1 -51.76 35.28 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.873 0.368 . . . . 0.0 111.419 -179.194 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 10.2 pt -66.91 -28.59 43.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.531 -179.333 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -61.43 -40.47 94.56 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 110.036 -0.357 . . . . 0.0 110.036 -179.785 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -53.41 -30.07 38.29 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.331 -179.15 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 62.8 mt -67.6 -43.42 86.96 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.333 179.454 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 69.0 mttm -58.21 -46.28 86.12 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.159 -179.087 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 52.1 mtmt -65.62 -41.07 93.11 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.662 179.401 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 96.6 m-20 -61.59 -39.37 90.93 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.029 -179.377 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -60.86 -31.97 71.4 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.596 -179.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -59.35 -30.82 68.67 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.892 0.377 . . . . 0.0 110.921 -179.701 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 57.3 mt . . . . . 0 C--N 1.325 -0.494 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.609 -179.349 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 69.8 m-20 . . . . . 0 CA--C 1.534 0.347 0 N-CA-C 110.321 -0.252 . . . . 0.0 110.321 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -74.53 -5.67 17.21 Favored 'Trans proline' 0 N--CA 1.495 1.58 0 C-N-CA 122.443 2.095 . . . . 0.0 111.971 179.903 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 53.5 t80 -72.36 -50.95 22.92 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.907 0.384 . . . . 0.0 111.513 -179.413 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 64.7 mt -69.74 -29.0 39.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.935 -179.296 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.42 ' N ' ' CD1' ' A' ' 79' ' ' LEU . 8.1 mp -77.01 -48.71 17.18 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 120.862 0.363 . . . . 0.0 110.174 179.778 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -65.44 -29.33 69.99 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.095 -0.502 . . . . 0.0 109.922 179.937 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -66.78 -37.28 84.27 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.706 179.662 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 37.0 ttpt -63.78 -24.2 67.67 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.744 -179.596 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 32.3 t -70.69 -46.6 68.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.668 179.859 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 57.8 ttt85 -62.28 -33.18 74.14 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.32 -179.642 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -59.28 -37.6 78.08 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.121 0.486 . . . . 0.0 110.895 -179.427 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 61.3 p -72.11 -27.7 62.8 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.36 179.638 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 25.0 m -57.61 -53.77 54.4 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 120.443 -0.503 . . . . 0.0 111.252 -178.778 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 26.8 m -72.46 -50.8 32.57 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-O 120.92 0.39 . . . . 0.0 111.338 179.668 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -55.57 -44.25 76.71 Favored 'General case' 0 C--O 1.222 -0.376 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.341 -178.323 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 77.8 tt0 -58.2 -45.45 87.57 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.193 0.52 . . . . 0.0 110.584 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 57.3 mtpt -60.87 -29.65 69.67 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.63 -179.206 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 82.7 t80 -71.05 -59.38 2.81 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.987 -178.859 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 8.4 m -49.4 -40.29 14.23 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.448 0 N-CA-C 109.921 -0.4 . . . . 0.0 109.921 -178.801 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 88.9 mt -61.94 -43.06 96.97 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 N-CA-C 109.888 -0.412 . . . . 0.0 109.888 179.52 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -57.52 -30.98 65.6 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 120.876 -0.33 . . . . 0.0 110.801 -179.112 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 40.7 mm -59.87 -36.51 67.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.44 -179.512 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -65.78 -34.41 78.12 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.938 179.907 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -65.05 -39.53 93.43 Favored 'General case' 0 C--N 1.326 -0.45 0 C-N-CA 120.851 -0.34 . . . . 0.0 110.358 -179.469 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 80.7 mm-40 -67.38 -39.0 85.59 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.908 0.385 . . . . 0.0 110.744 -179.832 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -53.27 -48.34 68.39 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.956 0.408 . . . . 0.0 110.81 -179.634 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 11.9 m -60.1 -48.24 82.57 Favored 'General case' 0 C--N 1.321 -0.652 0 C-N-CA 120.472 -0.491 . . . . 0.0 110.847 -179.392 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 5.8 mptp? -67.21 -31.57 72.03 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.802 0.334 . . . . 0.0 111.009 179.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 27.1 mt . . . . . 0 C--N 1.321 -0.635 0 CA-C-O 120.869 0.366 . . . . 0.0 110.679 -178.803 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 91.4 p . . . . . 0 N--CA 1.469 0.493 0 CA-C-O 120.675 0.274 . . . . 0.0 110.366 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -71.76 -52.79 10.97 Favored Glycine 0 CA--C 1.526 0.754 0 N-CA-C 111.355 -0.698 . . . . 0.0 111.355 179.89 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . 0.452 ' CD ' ' H ' ' A' ' 111' ' ' GLU . 2.5 mp0 -68.31 -22.62 64.7 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.916 0.389 . . . . 0.0 110.876 -179.491 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -59.42 -43.79 92.98 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.24 -178.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 43.8 t -60.1 -43.44 95.56 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.212 -179.891 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -65.11 -28.89 69.75 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.733 179.642 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 50.1 tpp -76.11 -52.54 9.92 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.245 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 36.9 t80 -62.08 -50.18 72.97 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 109.777 -0.453 . . . . 0.0 109.777 -179.685 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 52.2 t0 -48.58 -27.73 2.97 Favored 'General case' 0 CA--C 1.517 -0.29 0 N-CA-C 109.652 -0.499 . . . . 0.0 109.652 -179.073 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.68 -46.14 83.7 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.498 0.666 . . . . 0.0 109.893 -179.926 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 14.4 tpt -57.96 -34.26 69.74 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 114.987 -1.006 . . . . 0.0 109.638 -179.305 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 68.1 t80 -71.0 -41.1 71.38 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.317 -0.401 . . . . 0.0 112.046 -179.41 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 65.5 mm-40 -63.45 -44.87 93.24 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.87 -178.937 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 28.9 m -75.22 -23.97 17.37 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.405 0 O-C-N 123.326 0.391 . . . . 0.0 110.749 -179.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 21.2 t -68.0 -33.16 74.08 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.631 179.69 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 17.1 mttp -60.24 -56.68 33.06 Favored Pre-proline 0 CA--C 1.541 0.626 0 C-N-CA 121.05 -0.26 . . . . 0.0 110.833 -179.421 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 75.8 Cg_exo -43.58 -36.5 7.18 Favored 'Trans proline' 0 C--N 1.317 -1.113 0 C-N-CA 122.14 1.893 . . . . 0.0 112.442 178.402 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 10.1 mp -70.29 -35.13 73.51 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.981 -179.862 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 40.9 mm-40 -61.51 -52.41 64.6 Favored 'General case' 0 C--N 1.32 -0.683 0 C-N-CA 120.248 -0.581 . . . . 0.0 110.728 -179.427 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 50.1 mtmt -63.78 -10.98 22.82 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.18 -179.57 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 2.5 tt -97.86 -67.62 0.84 Allowed 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.278 -179.778 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -155.51 -138.51 2.58 Favored Glycine 0 CA--C 1.518 0.259 0 N-CA-C 110.688 -0.965 . . . . 0.0 110.688 -179.231 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 131' ' ' ILE . . . . . 0.754 ' CG2' ' H ' ' A' ' 132' ' ' GLN . 3.3 mp 53.28 -158.41 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.517 -0.298 0 N-CA-C 109.654 -0.499 . . . . 0.0 109.654 -179.771 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 132' ' ' GLN . . . . . 0.754 ' H ' ' CG2' ' A' ' 131' ' ' ILE . 6.0 tp60 177.43 139.52 0.08 Allowed 'General case' 0 N--CA 1.446 -0.654 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 179.866 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 94.1 mt-10 59.28 26.12 14.88 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-O 120.966 0.412 . . . . 0.0 111.455 178.135 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 9.3 tpt -57.79 -39.93 78.69 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.087 -179.798 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 135' ' ' THR . . . . . 0.465 ' HG1' ' H ' ' A' ' 136' ' ' LYS . 56.8 p -75.22 -61.72 1.8 Allowed 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 121.363 0.602 . . . . 0.0 110.696 -179.699 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 136' ' ' LYS . . . . . 0.465 ' H ' ' HG1' ' A' ' 135' ' ' THR . 17.7 ttmm -49.24 -44.27 43.41 Favored 'General case' 0 C--N 1.32 -0.679 0 C-N-CA 120.455 -0.498 . . . . 0.0 110.524 -178.327 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 76.8 m -55.52 -68.44 0.2 Allowed 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.323 -179.299 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 11.7 p -59.86 -38.89 78.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.993 0.425 . . . . 0.0 110.469 -178.891 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 139' ' ' SER . . . . . 0.44 ' OG ' ' O ' ' A' ' 135' ' ' THR . 15.9 m -63.23 -38.5 91.4 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.753 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -63.09 -31.42 72.56 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.009 -0.542 . . . . 0.0 110.522 -179.859 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -64.43 -46.03 84.93 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.86 0.362 . . . . 0.0 111.119 -179.598 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -57.75 -31.18 66.24 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.713 -179.207 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 14.3 mm-40 -75.13 -44.59 46.18 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.861 0.362 . . . . 0.0 111.117 -179.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 46.3 tp10 -72.12 -45.79 59.17 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.022 -179.106 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 145' ' ' ASN . . . . . 0.514 HD22 ' CD1' ' A' ' 156' ' ' ILE . 3.5 p-10 -128.54 68.98 78.81 Favored Pre-proline 0 N--CA 1.469 0.513 0 CA-C-N 116.376 -0.374 . . . . 0.0 110.09 -179.045 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 146' ' ' PRO . . . . . . . . . . . . . 23.2 Cg_endo -60.28 112.69 1.39 Allowed 'Trans proline' 0 N--CA 1.492 1.418 0 C-N-CA 122.38 2.053 . . . . 0.0 111.303 -179.7 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 147' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -79.3 136.36 12.62 Favored 'Trans proline' 0 N--CA 1.491 1.378 0 C-N-CA 122.115 1.876 . . . . 0.0 111.768 -179.902 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 36.5 p -129.53 18.96 5.76 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.236 179.327 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 149' ' ' THR . . . . . . . . . . . . . 8.5 m -151.96 152.46 32.52 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 120.661 0.267 . . . . 0.0 110.354 179.578 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -49.47 -36.11 21.71 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.795 0.331 . . . . 0.0 110.559 -179.077 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 14.9 pt20 -77.74 -40.64 40.41 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.649 179.216 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . -56.4 -36.97 71.92 Favored Glycine 0 CA--C 1.519 0.302 0 N-CA-C 110.887 -0.885 . . . . 0.0 110.887 -178.839 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 153' ' ' VAL . . . . . 0.44 ' O ' ' N ' ' A' ' 156' ' ' ILE . 86.1 t -60.88 -42.07 91.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 C-N-CA 121.21 -0.196 . . . . 0.0 110.508 -179.839 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 79.3 mt -43.56 -23.42 0.07 Allowed 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 120.912 0.387 . . . . 0.0 110.86 -179.295 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 155' ' ' GLU . . . . . 0.411 ' N ' ' C ' ' A' ' 153' ' ' VAL . 95.2 mt-10 -64.86 -40.4 95.08 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.004 179.268 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 156' ' ' ILE . . . . . 0.514 ' CD1' HD22 ' A' ' 145' ' ' ASN . 10.2 mm -71.48 -35.74 57.94 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.154 -179.709 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -60.13 -41.75 93.34 Favored 'General case' 0 N--CA 1.453 -0.278 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.864 -179.686 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 17.3 ttmm -60.74 -44.68 96.37 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.496 -179.405 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 53.6 tttm -73.77 -30.09 62.57 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.83 -179.371 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 160' ' ' MET . . . . . . . . . . . . . 12.0 mtp -67.49 -54.05 23.48 Favored 'General case' 0 C--O 1.221 -0.436 0 C-N-CA 120.508 -0.477 . . . . 0.0 110.174 -178.976 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 80.8 mtp180 -61.99 -31.75 72.15 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.394 179.922 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -58.4 -46.34 86.59 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.222 -179.269 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 163' ' ' LYS . . . . . . . . . . . . . 54.0 tttp -65.08 -52.28 56.52 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 120.357 -0.537 . . . . 0.0 110.78 -179.064 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -51.98 -36.08 48.54 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.998 0.427 . . . . 0.0 110.285 -179.071 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 165' ' ' GLN . . . . . 0.412 ' O ' ' OG1' ' A' ' 169' ' ' THR . 57.6 tt0 -62.09 -40.04 94.48 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.325 179.896 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 20.3 mmt85 -65.89 -34.66 78.65 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.453 0.644 . . . . 0.0 111.434 -179.585 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 167' ' ' VAL . . . . . . . . . . . . . 38.6 t -66.76 -47.44 82.93 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.769 0 CA-C-N 115.139 -0.937 . . . . 0.0 110.284 -179.53 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 42.8 t-80 -79.44 -31.11 42.5 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.519 -179.471 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 169' ' ' THR . . . . . 0.412 ' OG1' ' O ' ' A' ' 165' ' ' GLN . 90.2 m -71.64 -44.43 64.35 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.126 -179.828 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 59.8 mmtt -62.01 -41.76 98.43 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.99 0.424 . . . . 0.0 110.733 -179.021 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 171' ' ' ASN . . . . . . . . . . . . . 10.3 m120 -68.63 -34.92 76.57 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.628 179.473 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 172' ' ' TYR . . . . . 0.466 ' CZ ' ' NZ ' ' A' ' 176' ' ' LYS . 86.8 t80 -63.85 -40.46 96.64 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.115 -179.524 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 7.2 t -76.11 -46.85 26.83 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.783 -178.679 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 24.5 p -58.2 -47.83 82.23 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.078 -178.808 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -64.1 -35.14 79.78 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-O 120.808 0.337 . . . . 0.0 110.721 -179.911 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 176' ' ' LYS . . . . . 0.466 ' NZ ' ' CZ ' ' A' ' 172' ' ' TYR . 14.2 tptt -54.71 -19.3 5.93 Favored 'General case' 0 C--N 1.313 -1.003 0 C-N-CA 120.274 -0.57 . . . . 0.0 110.461 -179.158 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 177' ' ' LYS . . . . . . . . . . . . . 61.0 tttm -68.98 -39.77 79.21 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 121.712 0.768 . . . . 0.0 111.368 179.846 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 178' ' ' LYS . . . . . . . . . . . . . 20.0 mtpp . . . . . 0 C--N 1.31 -1.138 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.024 -178.721 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.156 0 CA-C-O 120.796 0.331 . . . . 0.0 110.583 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 24.7 m -64.63 -30.29 71.3 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.351 -179.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 63.9 tttp -68.48 -50.7 50.44 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.807 179.973 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 65.0 mt -60.38 -42.48 91.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.361 -179.196 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 -56.35 -42.64 78.08 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.75 -179.517 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 26.8 mt -68.97 -34.18 74.9 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.55 0.214 . . . . 0.0 111.319 -179.147 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -64.93 -52.76 54.61 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.868 -179.43 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 50.3 ptt85 -71.81 -39.71 69.65 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.882 0.372 . . . . 0.0 110.799 -179.625 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 39.4 t -64.85 -39.25 93.27 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.965 -179.595 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -76.53 -34.0 58.56 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.1 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 64.8 tttm -66.36 -33.01 74.77 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.905 -179.623 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 39.7 m-20 -67.35 -27.04 66.8 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.821 -179.307 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 52.8 mt -61.47 -50.19 81.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 C-N-CA 120.885 -0.326 . . . . 0.0 110.846 -179.08 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 68.4 p -73.73 -36.5 65.2 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.801 0.334 . . . . 0.0 111.46 -178.294 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 85.7 m-20 -66.2 -35.09 79.54 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.561 -178.306 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 68.8 mm-40 -74.4 -57.77 3.73 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.933 0.397 . . . . 0.0 111.513 -178.935 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 6.7 pt -58.56 -23.14 22.12 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.637 -178.92 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -62.94 -39.24 94.01 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.072 0.463 . . . . 0.0 110.502 179.459 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -55.24 -22.5 18.33 Favored 'General case' 0 C--N 1.319 -0.728 0 C-N-CA 120.669 -0.412 . . . . 0.0 110.676 -179.924 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 81.4 mt -60.25 -52.72 58.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.462 -178.549 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 5.1 ptmm? -65.85 -30.92 71.61 Favored 'General case' 0 C--N 1.324 -0.542 0 C-N-CA 120.693 -0.403 . . . . 0.0 110.366 -179.167 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 37.7 ttmt -63.83 -47.72 79.69 Favored 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 120.756 -0.378 . . . . 0.0 110.227 179.859 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 95.1 m-20 -65.47 -33.3 75.6 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.17 179.816 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -64.01 -28.39 69.77 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.835 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -60.05 -32.51 70.99 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.891 -179.673 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 55.0 mt . . . . . 0 C--N 1.325 -0.475 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.438 -179.216 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . 0.428 ' O ' ' N ' ' A' ' 77' ' ' PHE . 2.0 p30 . . . . . 0 CA--C 1.541 0.623 0 N-CA-C 109.41 -0.589 . . . . 0.0 109.41 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 77.0 Cg_exo -43.79 -19.94 0.23 Allowed 'Trans proline' 0 N--CA 1.496 1.659 0 C-N-CA 122.505 2.137 . . . . 0.0 112.226 -179.46 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . 0.428 ' N ' ' O ' ' A' ' 75' ' ' ASN . 58.0 t80 -62.26 -52.78 62.36 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.632 -0.427 . . . . 0.0 110.711 -179.872 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 94.4 mt -69.35 -46.16 77.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.427 179.819 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.479 ' O ' ' ND2' ' A' ' 171' ' ' ASN . 39.9 mt -55.57 -51.63 66.45 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.095 -178.442 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 95.6 mt-10 -63.49 -36.0 82.32 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.191 179.475 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -64.46 -40.43 95.7 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.499 179.967 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 33.9 ttmt -54.88 -19.37 6.45 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.088 0.471 . . . . 0.0 110.528 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 5.6 t -79.43 -44.65 23.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.818 179.943 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 84.7 mtp180 -62.96 -31.4 72.49 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.413 -179.672 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -67.32 -42.77 83.07 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.91 0.386 . . . . 0.0 111.274 -179.341 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 38.3 p -67.77 -21.51 65.25 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.245 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 24.5 m -59.0 -54.03 51.75 Favored 'General case' 0 C--N 1.323 -0.571 0 C-N-CA 120.506 -0.478 . . . . 0.0 111.027 -179.051 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 45.2 t -73.13 -49.18 40.12 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-O 121.057 0.456 . . . . 0.0 111.3 -179.445 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -57.18 -43.15 82.37 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.672 -178.896 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 7.1 tm-20 -56.28 -47.83 77.83 Favored 'General case' 0 C--N 1.317 -0.84 0 C-N-CA 120.404 -0.518 . . . . 0.0 110.718 -179.613 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 70.0 mmtt -59.0 -36.75 75.43 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.895 -178.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 87.7 t80 -56.99 -38.88 73.67 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.506 -179.926 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 49.0 t -58.03 -41.93 81.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-O 120.926 0.393 . . . . 0.0 110.173 -179.02 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 64.3 mt -54.51 -39.91 47.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.327 179.944 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -53.3 -45.32 68.93 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.631 -179.762 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . 0.445 ' CD1' ' N ' ' A' ' 96' ' ' ILE . 1.6 mp -60.63 -44.37 96.76 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 116.311 -0.404 . . . . 0.0 109.986 -179.586 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 14.1 tm-20 -64.43 -49.36 71.81 Favored 'General case' 0 C--N 1.32 -0.71 0 C-N-CA 120.576 -0.45 . . . . 0.0 110.649 -178.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 83.0 tt0 -63.15 -46.48 86.99 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.58 -179.166 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 79.3 mm-40 -65.86 -35.13 79.81 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.743 -179.794 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -60.68 -41.63 95.49 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.57 -179.853 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 33.0 m -63.32 -49.07 75.43 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.643 -179.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 35.3 ttmt -69.32 -19.67 63.88 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.508 -179.924 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 41.1 tp . . . . . 0 C--N 1.326 -0.452 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.433 -179.402 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 54.4 p . . . . . 0 N--CA 1.456 -0.154 0 CA-C-O 120.816 0.341 . . . . 0.0 110.507 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -62.55 -31.38 79.58 Favored Glycine 0 CA--C 1.521 0.425 0 N-CA-C 110.876 -0.89 . . . . 0.0 110.876 -179.961 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 44.9 tp10 -53.72 -45.61 70.52 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.864 0.364 . . . . 0.0 110.368 -179.544 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 65.1 m-85 -65.23 -41.17 94.65 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.575 -179.869 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 6.1 t -57.17 -33.28 67.27 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.499 -179.725 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -61.9 -35.89 79.69 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.452 -179.92 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 28.9 tpp -66.4 -47.65 72.61 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.958 0.409 . . . . 0.0 110.91 -179.871 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 37.1 t80 -51.12 -32.17 21.82 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.548 -179.542 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 63.6 t0 -60.05 -44.71 94.5 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.756 -179.889 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 10.8 mp -58.33 -39.21 78.84 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.289 -0.414 . . . . 0.0 109.922 -179.222 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 13.4 tpt -61.84 -32.29 72.61 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.365 179.941 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . 0.582 ' CZ ' ' NZ ' ' A' ' 124' ' ' LYS . 14.6 t80 -77.42 -46.01 24.01 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.353 0.597 . . . . 0.0 111.035 -179.851 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -59.91 -42.46 93.92 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.699 -178.424 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 11.1 p -74.53 -25.86 19.62 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.385 0 CA-C-O 120.942 0.401 . . . . 0.0 110.687 -179.785 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 11.5 t -65.47 -21.08 66.6 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 116.611 -0.268 . . . . 0.0 111.193 179.912 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . 0.582 ' NZ ' ' CZ ' ' A' ' 120' ' ' PHE . 5.1 mptt -71.3 -59.31 3.33 Favored Pre-proline 0 C--N 1.324 -0.511 0 N-CA-C 112.139 0.422 . . . . 0.0 112.139 -178.906 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 125' ' ' PRO . . . . . 0.467 ' HD2' ' N ' ' A' ' 124' ' ' LYS . 18.6 Cg_endo -56.6 -32.01 88.84 Favored 'Trans proline' 0 C--N 1.309 -1.506 0 C-N-CA 122.204 1.936 . . . . 0.0 112.106 -178.036 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 7.4 mp -60.98 -39.61 90.28 Favored 'General case' 0 CA--C 1.51 -0.57 0 CA-C-N 116.431 -0.349 . . . . 0.0 110.552 -179.839 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -44.69 -28.71 0.65 Allowed 'General case' 0 C--N 1.318 -0.791 0 CA-C-O 120.922 0.391 . . . . 0.0 110.923 179.858 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -64.99 -8.55 16.35 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.83 -179.399 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . 0.422 ' N ' ' CD2' ' A' ' 129' ' ' LEU . 4.2 mm? -102.75 -10.35 19.24 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.604 -179.663 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 130' ' ' GLY . . . . . 0.411 ' C ' ' H ' ' A' ' 132' ' ' GLN . . . 83.65 17.61 65.64 Favored Glycine 0 CA--C 1.52 0.381 0 N-CA-C 110.438 -1.065 . . . . 0.0 110.438 179.684 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 131' ' ' ILE . . . . . 0.531 ' O ' ' C ' ' A' ' 132' ' ' GLN . 81.4 mt -77.82 15.36 0.25 Allowed 'Isoleucine or valine' 0 CA--C 1.518 -0.27 0 N-CA-C 110.038 -0.356 . . . . 0.0 110.038 -179.835 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 132' ' ' GLN . . . . . 0.547 HE21 ' HZ1' ' A' ' 136' ' ' LYS . 59.1 tt0 -25.84 122.9 0.07 Allowed 'General case' 0 CA--C 1.507 -0.694 0 CA-C-O 118.941 -0.552 . . . . 0.0 109.666 179.968 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 133' ' ' GLU . . . . . 0.503 ' CB ' ' O ' ' A' ' 132' ' ' GLN . 8.6 mm-40 148.22 -21.95 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.201 0 O-C-N 124.677 1.236 . . . . 0.0 110.343 -178.858 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 24.6 mmt -62.01 -61.92 2.15 Favored 'General case' 0 C--N 1.319 -0.724 0 C-N-CA 120.849 -0.341 . . . . 0.0 111.138 -178.378 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 71.4 p -56.96 -30.38 64.02 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.834 -178.799 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 136' ' ' LYS . . . . . 0.547 ' HZ1' HE21 ' A' ' 132' ' ' GLN . 50.8 mtmt -82.69 -52.81 6.44 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.347 -179.745 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 137' ' ' THR . . . . . 0.42 ' CG2' ' NZ ' ' A' ' 159' ' ' LYS . 30.2 m -60.57 -46.12 91.41 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.857 -179.023 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 138' ' ' VAL . . . . . 0.424 ' CG1' ' N ' ' A' ' 139' ' ' SER . 9.0 p -61.4 -40.61 86.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-O 121.051 0.453 . . . . 0.0 110.68 -178.92 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 139' ' ' SER . . . . . 0.424 ' N ' ' CG1' ' A' ' 138' ' ' VAL . 23.7 t -72.5 -36.37 68.36 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.648 -179.841 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 84.7 m-20 -64.74 -30.18 71.18 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.64 -179.589 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -74.97 -28.23 60.49 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.81 -179.924 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -64.57 -34.09 77.44 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.114 -179.283 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 94.9 mt-10 -70.8 -36.91 73.22 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.743 0.306 . . . . 0.0 110.834 -179.422 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 47.6 tp10 -74.05 -43.49 57.64 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.012 -179.475 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 145' ' ' ASN . . . . . . . . . . . . . 70.3 m-80 -144.28 82.68 10.53 Favored Pre-proline 0 N--CA 1.466 0.349 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.197 -179.53 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 146' ' ' PRO . . . . . 0.456 ' O ' ' N ' ' A' ' 148' ' ' THR . 24.4 Cg_endo -61.02 113.05 1.56 Allowed 'Trans proline' 0 N--CA 1.493 1.446 0 C-N-CA 122.394 2.063 . . . . 0.0 111.694 -178.846 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 147' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_exo -45.79 87.61 0.02 OUTLIER 'Trans proline' 0 N--CA 1.493 1.489 0 C-N-CA 122.397 2.065 . . . . 0.0 112.786 -179.364 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 148' ' ' THR . . . . . 0.456 ' N ' ' O ' ' A' ' 146' ' ' PRO . 31.2 m -111.56 -15.43 13.5 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.335 179.284 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 149' ' ' THR . . . . . 0.478 ' CG2' ' H ' ' A' ' 150' ' ' ALA . 30.8 m -138.8 172.27 13.11 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.639 179.845 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 150' ' ' ALA . . . . . 0.478 ' H ' ' CG2' ' A' ' 149' ' ' THR . . . -58.88 -47.72 83.95 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.304 179.986 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 76.4 mt-30 -62.76 -29.61 70.82 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.021 0.439 . . . . 0.0 110.394 -179.851 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . -58.38 -42.28 95.59 Favored Glycine 0 CA--C 1.524 0.6 0 N-CA-C 110.691 -0.964 . . . . 0.0 110.691 179.792 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 153' ' ' VAL . . . . . . . . . . . . . 47.3 t -67.67 -41.48 85.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-O 120.834 0.349 . . . . 0.0 110.505 -179.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 8.4 mp -50.95 -38.51 51.02 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.256 -179.374 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -60.96 -47.57 85.83 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 179.12 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 15.3 mm -65.36 -43.57 94.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.034 -179.777 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -53.03 -51.46 61.66 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.247 179.923 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -62.58 -43.99 97.42 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.164 179.495 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 159' ' ' LYS . . . . . 0.42 ' NZ ' ' CG2' ' A' ' 137' ' ' THR . 63.2 tttm -65.11 -29.77 70.66 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.371 179.945 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 160' ' ' MET . . . . . . . . . . . . . 5.4 mtp -71.01 -53.27 15.36 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.48 -179.49 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 73.5 ttt-85 -67.8 -35.65 79.03 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.473 179.847 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 80.1 tt0 -66.97 -47.87 70.25 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.817 -179.08 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 163' ' ' LYS . . . . . . . . . . . . . 1.2 tmtp? -65.97 -33.97 77.02 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.18 -179.394 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 5.8 mt -70.28 -26.61 63.89 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.657 179.942 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 46.5 tp60 -67.21 -35.73 80.22 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.472 -179.155 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 10.7 tpt180 -62.49 -28.49 69.86 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.37 0.605 . . . . 0.0 110.575 -179.187 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 167' ' ' VAL . . . . . . . . . . . . . 48.3 t -68.18 -44.01 84.52 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 CA-C-N 115.242 -0.89 . . . . 0.0 110.39 -179.708 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 168' ' ' HIS . . . . . 0.503 ' O ' ' ND1' ' A' ' 168' ' ' HIS . 20.6 t-80 -78.15 -28.83 48.44 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.636 -179.967 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 169' ' ' THR . . . . . . . . . . . . . 23.7 m -73.2 -46.68 49.06 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.301 -0.408 . . . . 0.0 111.156 -179.697 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -58.83 -43.86 90.79 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.555 -179.077 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 171' ' ' ASN . . . . . 0.479 ' ND2' ' O ' ' A' ' 79' ' ' LEU . 20.1 t-20 -72.03 -33.11 67.76 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.62 179.916 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 172' ' ' TYR . . . . . . . . . . . . . 80.7 t80 -75.18 -29.33 60.36 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.786 -179.629 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 11.5 t -74.35 -34.55 63.42 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.046 -179.511 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 26.2 p -73.04 -35.68 66.77 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.967 -179.268 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 87.0 mt -77.72 -53.1 7.93 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.521 -178.843 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 16.2 ptmt -56.24 -21.72 25.28 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 121.183 0.516 . . . . 0.0 110.37 -179.265 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 177' ' ' LYS . . . . . . . . . . . . . 56.2 tttp -66.38 -13.67 60.98 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.236 -179.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 178' ' ' LYS . . . . . . . . . . . . . 99.2 mttt . . . . . 0 C--N 1.322 -0.589 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.857 -179.922 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 33.0 t . . . . . 0 N--CA 1.49 1.547 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -68.21 82.29 0.23 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.717 -179.86 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . 0.435 ' O ' ' NZ ' ' A' ' 32' ' ' LYS . . . 176.17 113.24 0.33 Allowed Glycine 0 CA--C 1.516 0.155 0 N-CA-C 110.781 -0.928 . . . . 0.0 110.781 179.817 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.437 ' C ' ' HG1' ' A' ' 28' ' ' THR . 1.0 OUTLIER -141.2 -44.9 0.38 Allowed 'General case' 0 C--N 1.334 -0.107 0 CA-C-O 120.835 0.35 . . . . 0.0 110.627 179.525 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' THR . . . . . 0.437 ' HG1' ' C ' ' A' ' 27' ' ' LEU . 46.9 p 40.37 -149.1 0.02 OUTLIER 'General case' 0 C--O 1.234 0.253 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.803 -179.282 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -77.52 -130.08 0.47 Allowed Glycine 0 CA--C 1.521 0.455 0 N-CA-C 110.952 -0.859 . . . . 0.0 110.952 179.387 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -83.48 3.54 31.73 Favored 'General case' 0 C--N 1.329 -0.294 0 O-C-N 122.716 -0.285 . . . . 0.0 110.441 -179.832 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 9.9 m -61.84 -36.3 80.78 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.844 -179.683 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.435 ' NZ ' ' O ' ' A' ' 26' ' ' GLY . 23.4 tptm -65.11 -57.27 9.04 Favored 'General case' 0 N--CA 1.447 -0.578 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.079 -179.709 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 22.1 pt -62.39 -28.64 45.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.331 -179.578 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 78.8 ttt180 -65.35 -42.27 93.0 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.161 0.505 . . . . 0.0 110.497 179.798 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 17.0 mt -71.89 -32.86 67.85 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.065 -179.9 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 37.7 tp10 -62.48 -51.07 68.91 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.88 -179.551 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 89.3 mtm180 -67.37 -40.62 85.74 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.508 -179.507 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 26.8 t -67.83 -25.21 65.45 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.714 -179.751 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -75.66 -40.3 56.24 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.728 179.681 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -58.41 -39.66 80.34 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.817 -179.595 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 20.1 m-20 -58.14 -22.05 49.47 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 121.059 0.457 . . . . 0.0 110.766 -179.389 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 8.9 mm -64.79 -56.15 17.41 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.953 0 N-CA-C 112.244 0.461 . . . . 0.0 112.244 -178.865 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 52.5 p -76.34 -36.03 58.45 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.559 -179.878 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 95.8 m-20 -64.56 -35.14 80.02 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.688 -177.623 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 56.4 mm-40 -73.25 -57.82 3.75 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.745 -179.588 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 16.0 pt -60.03 -26.94 37.56 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.755 0 O-C-N 123.428 0.455 . . . . 0.0 110.879 -179.37 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 65.3 m-20 -66.54 -38.53 87.35 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.365 -179.567 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -53.9 -27.47 30.7 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.209 -179.288 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 66.3 mt -62.49 -47.47 92.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.118 179.689 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 63.8 mttp -58.76 -39.54 81.28 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.101 -179.465 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 71.6 mmtt -64.85 -44.22 90.48 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.558 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -67.12 -35.49 79.87 Favored 'General case' 0 C--O 1.224 -0.268 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.48 179.822 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . 0.444 ' O ' ' O ' ' A' ' 56' ' ' LYS . . . -63.69 -29.02 70.3 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.673 -179.844 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -58.66 -35.28 72.31 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.792 -179.526 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.43 ' CD1' ' N ' ' A' ' 55' ' ' LEU . 10.0 mp -56.21 -44.75 79.79 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.511 -178.521 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.444 ' O ' ' O ' ' A' ' 53' ' ' ALA . 20.7 mtpp -109.02 139.79 43.41 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-O 121.113 0.482 . . . . 0.0 110.332 179.876 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -70.25 102.06 0.97 Allowed Glycine 0 CA--C 1.516 0.096 0 N-CA-C 110.795 -0.922 . . . . 0.0 110.795 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 5.5 p -132.6 142.71 41.78 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.374 0 CA-C-O 120.974 0.416 . . . . 0.0 110.46 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 8.5 p30 -60.68 -44.35 96.61 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.927 179.765 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 81.3 t80 52.88 72.93 0.38 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.428 179.826 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . 0.469 ' CG ' ' H ' ' A' ' 62' ' ' ALA . 4.0 p30 172.23 -99.0 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.011 0.434 . . . . 0.0 110.189 -179.861 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.469 ' H ' ' CG ' ' A' ' 61' ' ' ASP . . . 47.1 31.61 1.68 Allowed 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.932 -179.863 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . 0.473 ' CZ ' ' O ' ' A' ' 129' ' ' LEU . 56.8 m-85 -89.09 9.99 23.38 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.134 -179.855 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 53.3 mtmt -61.7 125.46 23.9 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.615 -179.758 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 32.8 t70 49.79 -94.79 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.621 -179.883 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -140.89 138.48 33.93 Favored 'General case' 0 CA--C 1.52 -0.196 0 CA-C-O 121.19 0.519 . . . . 0.0 110.377 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 10.1 ptpp? -88.43 146.67 25.09 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.497 179.698 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 82.7 m -136.97 131.24 32.69 Favored 'General case' 0 CA--C 1.519 -0.249 0 CA-C-O 121.042 0.449 . . . . 0.0 110.473 179.794 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 150.38 -37.82 0.9 Allowed Glycine 0 CA--C 1.523 0.546 0 N-CA-C 110.805 -0.918 . . . . 0.0 110.805 179.613 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 23.3 m 53.43 80.7 0.1 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.81 0.338 . . . . 0.0 110.518 -179.72 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 72.21 -57.64 1.51 Allowed Glycine 0 CA--C 1.528 0.885 0 N-CA-C 110.763 -0.935 . . . . 0.0 110.763 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.448 ' CG2' ' HZ3' ' A' ' 177' ' ' LYS . 47.5 t -61.11 133.13 26.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 O-C-N 122.689 -0.3 . . . . 0.0 110.303 -179.597 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 1.4 m 70.61 -59.24 0.53 Allowed 'General case' 0 C--N 1.334 -0.101 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.378 -179.584 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . 0.552 ' O ' ' C ' ' A' ' 75' ' ' ASN . 41.6 tp10 -68.75 91.92 0.46 Allowed 'General case' 0 N--CA 1.446 -0.645 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.715 -179.265 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . 0.625 ' C ' ' H ' ' A' ' 77' ' ' PHE . 0.0 OUTLIER -18.82 98.33 0.05 OUTLIER Pre-proline 0 C--O 1.236 0.386 0 O-C-N 123.84 0.712 . . . . 0.0 111.103 179.166 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_exo -51.05 0.03 0.04 OUTLIER 'Trans proline' 0 C--N 1.312 -1.374 0 C-N-CA 122.611 2.207 . . . . 0.0 111.856 -178.572 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . 0.625 ' H ' ' C ' ' A' ' 75' ' ' ASN . 67.8 t80 -61.03 -49.46 77.33 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 116.561 -0.29 . . . . 0.0 110.709 -179.542 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 66.3 mt -64.17 -51.95 62.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.368 -179.854 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.419 ' CD1' ' N ' ' A' ' 79' ' ' LEU . 10.5 mp -56.52 -53.23 59.93 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.171 -178.616 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 94.9 mt-10 -62.68 -38.92 92.28 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 123.334 0.396 . . . . 0.0 110.221 179.911 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -63.39 -41.47 98.76 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.364 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 35.9 ttmt -52.53 -18.58 1.77 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 121.19 0.519 . . . . 0.0 110.776 -179.597 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 25.4 t -85.51 -48.38 16.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.485 179.722 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 84.4 mtt85 -64.97 -30.27 71.25 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.46 -179.585 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -70.39 -45.75 65.38 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.748 -179.497 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 74.2 p -77.6 -11.97 59.92 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.458 -179.163 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 85.6 m -60.34 -52.1 66.68 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.129 -178.736 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 11.7 p -69.8 -39.55 77.98 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.77 -179.407 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -61.97 -39.17 91.24 Favored 'General case' 0 C--O 1.223 -0.341 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.107 -178.695 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 38.4 tp10 -50.23 -54.96 17.42 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.852 -179.807 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 9.2 mtmp? -52.58 -34.89 52.59 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.69 -179.504 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 43.4 t80 -59.17 -43.59 92.15 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.725 -179.248 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 90.6 t -56.76 -47.71 82.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.453 -178.696 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 67.0 mt -53.42 -38.0 31.29 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.104 -179.904 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -52.58 -43.38 65.24 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.458 -179.491 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . 0.458 ' CD1' ' N ' ' A' ' 96' ' ' ILE . 1.7 mp -62.16 -44.86 99.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.417 -179.955 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 7.7 tm-20 -61.39 -50.07 74.33 Favored 'General case' 0 C--N 1.323 -0.56 0 O-C-N 123.442 0.464 . . . . 0.0 110.214 -178.616 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 78.4 tt0 -66.06 -39.72 90.32 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.34 -179.47 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 80.2 tt0 -67.54 -32.79 73.82 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.562 -179.676 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -57.49 -40.17 78.03 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.518 -179.496 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 20.2 m -61.69 -47.62 84.49 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.54 179.871 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 64.1 mttp -74.69 -24.64 58.81 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.376 -179.724 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . 0.496 ' O ' ' C ' ' A' ' 104' ' ' LYS . 37.4 tp -73.53 -27.87 61.58 Favored 'General case' 0 CA--C 1.508 -0.638 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.933 -179.739 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.496 ' C ' ' O ' ' A' ' 103' ' ' LEU . 64.0 tttm -25.52 -50.31 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.616 0 O-C-N 123.499 0.5 . . . . 0.0 111.063 -179.637 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . 0.59 ' O ' ' N ' ' A' ' 107' ' ' GLY . 80.9 mm-40 -47.72 165.34 0.04 OUTLIER 'General case' 0 C--O 1.219 -0.511 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.905 178.682 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' THR . . . . . 0.499 ' OG1' ' N ' ' A' ' 107' ' ' GLY . 32.0 p 55.29 -75.9 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.014 0.435 . . . . 0.0 110.762 -179.613 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . 0.59 ' N ' ' O ' ' A' ' 105' ' ' GLU . . . 82.17 -136.63 15.92 Favored Glycine 0 C--O 1.226 -0.381 0 N-CA-C 110.761 -0.936 . . . . 0.0 110.761 179.627 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 1.1 m 70.31 138.06 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 110.202 -0.296 . . . . 0.0 110.202 -179.594 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 80.7 p -57.65 -24.67 57.85 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.86 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -61.66 -45.45 96.26 Favored Glycine 0 CA--C 1.522 0.505 0 N-CA-C 111.191 -0.764 . . . . 0.0 111.191 -179.826 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 10.5 mm-40 -70.56 -44.05 68.24 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.708 0.29 . . . . 0.0 110.709 -179.646 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 61.5 m-85 -65.52 -36.61 84.34 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.536 -179.938 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 55.1 m -53.87 -33.95 57.97 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.385 179.813 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -65.57 -28.43 69.14 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.416 179.693 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 63.0 mmm -73.78 -41.96 61.69 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.876 -179.792 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 33.6 t80 -64.99 -34.54 78.69 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.439 179.911 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 45.4 t0 -56.67 -46.52 81.08 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.169 -179.346 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 83.6 mt -55.42 -39.01 69.72 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.519 179.761 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' MET . . . . . 0.434 ' C ' ' SD ' ' A' ' 119' ' ' MET . 0.0 OUTLIER -60.63 -53.98 50.86 Favored 'General case' 0 C--N 1.318 -0.769 0 O-C-N 123.544 0.527 . . . . 0.0 110.393 -179.831 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 67.1 t80 -60.77 -47.5 86.02 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.901 -178.76 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 78.9 mm-40 -56.56 -39.74 73.97 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.818 -179.726 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 69.7 t -81.19 -23.69 10.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.582 179.785 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 53.2 p -70.84 -23.0 62.26 Favored 'General case' 0 C--N 1.309 -1.171 0 CA-C-N 116.572 -0.285 . . . . 0.0 110.928 -179.783 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . 0.423 ' CB ' ' HD3' ' A' ' 125' ' ' PRO . 16.8 mtmt -72.04 -56.55 4.43 Favored Pre-proline 0 C--N 1.329 -0.297 0 C-N-CA 120.755 -0.378 . . . . 0.0 111.445 -178.71 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . 0.423 ' HD3' ' CB ' ' A' ' 124' ' ' LYS . 54.0 Cg_exo -49.22 -44.98 31.68 Favored 'Trans proline' 0 C--N 1.304 -1.787 0 C-N-CA 122.351 2.034 . . . . 0.0 112.172 178.237 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . 0.442 ' N ' ' CD2' ' A' ' 126' ' ' LEU . 4.3 mm? -70.38 -21.92 62.81 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.24 179.764 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 4.7 tm0? -63.31 -47.37 82.55 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.746 -179.672 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 99.7 mttt -53.58 -44.73 69.58 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 -178.461 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . 0.473 ' O ' ' CZ ' ' A' ' 63' ' ' PHE . 1.1 tt -63.72 -45.08 91.55 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 121.295 0.569 . . . . 0.0 110.556 179.566 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 99.2 90.54 2.01 Favored Glycine 0 N--CA 1.462 0.428 0 N-CA-C 110.815 -0.914 . . . . 0.0 110.815 -179.865 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 131' ' ' ILE . . . . . 0.4 ' O ' ' CG ' ' A' ' 132' ' ' GLN . 47.3 mm -105.81 -71.56 0.7 Allowed 'Isoleucine or valine' 0 CA--C 1.507 -0.699 0 N-CA-C 111.5 0.185 . . . . 0.0 111.5 179.391 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . 0.4 ' CG ' ' O ' ' A' ' 131' ' ' ILE . 56.7 mt-30 -159.75 -166.93 1.86 Allowed 'General case' 0 C--N 1.327 -0.393 0 O-C-N 123.511 0.507 . . . . 0.0 110.821 -179.898 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 92.8 mt-10 -88.09 44.44 1.2 Allowed 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 116.184 -0.462 . . . . 0.0 109.81 179.895 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 44.6 tpp -59.21 -58.91 6.54 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.157 -178.833 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 23.3 p -46.42 -26.79 0.91 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.522 -179.14 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 62.4 mttp -90.56 -45.12 9.12 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.007 178.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 75.7 m -61.17 -43.56 98.68 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.73 -178.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 138' ' ' VAL . . . . . 0.424 ' CG1' ' N ' ' A' ' 139' ' ' SER . 9.8 p -65.55 -40.88 89.46 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.74 -179.156 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 139' ' ' SER . . . . . 0.424 ' N ' ' CG1' ' A' ' 138' ' ' VAL . 34.2 t -75.48 -34.09 60.86 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.2 -179.278 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 64.6 t0 -64.11 -28.55 69.85 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.322 0.582 . . . . 0.0 110.642 -179.762 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -73.11 -24.91 60.68 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.945 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -59.58 -33.39 71.38 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.015 0.436 . . . . 0.0 111.0 -179.032 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . 0.413 ' OE1' ' N ' ' A' ' 143' ' ' GLU . 38.3 mp0 -73.08 -36.34 66.81 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.5 -0.318 . . . . 0.0 111.201 179.818 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 144' ' ' GLU . . . . . 0.439 ' O ' ' ND2' ' A' ' 145' ' ' ASN . 44.6 tp10 -64.52 -48.11 76.33 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.581 -179.699 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 145' ' ' ASN . . . . . 0.439 ' ND2' ' O ' ' A' ' 144' ' ' GLU . 31.3 m120 -148.47 77.17 9.78 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.228 -179.457 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 146' ' ' PRO . . . . . . . . . . . . . 86.8 Cg_exo -42.79 105.41 0.06 OUTLIER 'Trans proline' 0 N--CA 1.483 0.86 0 C-N-CA 122.923 2.415 . . . . 0.0 112.096 -179.781 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 147' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_exo -45.26 101.66 0.04 OUTLIER 'Trans proline' 0 C--N 1.312 -1.36 0 C-N-CA 122.375 2.05 . . . . 0.0 112.556 -179.251 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 53.4 m -120.17 -13.6 8.92 Favored 'General case' 0 CA--C 1.515 -0.379 0 CA-C-O 120.928 0.394 . . . . 0.0 110.409 179.504 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 149' ' ' THR . . . . . 0.472 ' CG2' ' N ' ' A' ' 150' ' ' ALA . 50.1 m -136.99 171.19 14.88 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.961 0.41 . . . . 0.0 110.621 179.801 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 150' ' ' ALA . . . . . 0.472 ' N ' ' CG2' ' A' ' 149' ' ' THR . . . -58.43 -40.39 82.4 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.789 179.798 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 76.1 mt-30 -66.76 -24.52 66.22 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.938 0.399 . . . . 0.0 110.831 179.804 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . -67.33 -40.27 91.82 Favored Glycine 0 CA--C 1.525 0.674 0 N-CA-C 111.155 -0.778 . . . . 0.0 111.155 -179.828 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 153' ' ' VAL . . . . . . . . . . . . . 54.3 t -68.54 -32.26 54.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-O 120.724 0.297 . . . . 0.0 110.636 -179.71 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 7.4 mp -56.56 -36.38 69.23 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.508 -179.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -60.11 -53.48 57.26 Favored 'General case' 0 C--N 1.321 -0.633 0 O-C-N 123.607 0.567 . . . . 0.0 109.863 -179.876 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 156' ' ' ILE . . . . . 0.435 ' CD1' ' N ' ' A' ' 156' ' ' ILE . 1.8 mp -60.38 -44.47 96.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 N-CA-C 109.91 -0.404 . . . . 0.0 109.91 -179.635 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -51.09 -51.72 50.64 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.029 -178.775 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 63.0 mttp -60.13 -41.1 91.94 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.934 0.397 . . . . 0.0 110.11 179.747 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 38.6 mmtm -64.94 -30.56 71.56 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.908 0.385 . . . . 0.0 110.763 179.503 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 160' ' ' MET . . . . . 0.406 ' O ' ' CB ' ' A' ' 164' ' ' LEU . 2.2 mtm -74.23 -53.93 8.77 Favored 'General case' 0 C--O 1.219 -0.505 0 C-N-CA 120.46 -0.496 . . . . 0.0 111.562 -179.757 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 60.8 ttp180 -62.51 -41.3 98.74 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.074 -179.105 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 68.2 mm-40 -62.82 -57.64 10.16 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.694 -179.431 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 163' ' ' LYS . . . . . 0.412 ' O ' ' N ' ' A' ' 166' ' ' ARG . 63.0 tttp -66.66 -52.97 38.9 Favored 'General case' 0 C--N 1.324 -0.52 0 O-C-N 123.5 0.5 . . . . 0.0 111.046 -179.122 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 164' ' ' LEU . . . . . 0.406 ' CB ' ' O ' ' A' ' 160' ' ' MET . 53.9 tp -47.81 -37.44 13.7 Favored 'General case' 0 C--O 1.212 -0.891 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.605 -178.772 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 59.2 tt0 -68.93 -27.62 65.92 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.497 -179.662 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 166' ' ' ARG . . . . . 0.412 ' N ' ' O ' ' A' ' 163' ' ' LYS . 57.4 ttm-85 -55.02 -22.67 16.31 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.888 -179.516 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 167' ' ' VAL . . . . . 0.401 ' CG2' ' N ' ' A' ' 168' ' ' HIS . 18.2 m -60.47 -42.27 90.61 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.934 0 O-C-N 124.087 0.867 . . . . 0.0 109.923 -179.526 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 168' ' ' HIS . . . . . 0.401 ' N ' ' CG2' ' A' ' 167' ' ' VAL . 3.5 t60 -77.38 -22.26 51.94 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.554 -179.428 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 169' ' ' THR . . . . . . . . . . . . . 23.7 m -66.35 -47.24 74.08 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.143 -179.921 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 68.9 mttm -63.99 -47.09 81.7 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.513 -179.588 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 171' ' ' ASN . . . . . . . . . . . . . 75.3 m-20 -64.29 -39.63 94.32 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.732 179.959 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 172' ' ' TYR . . . . . . . . . . . . . 85.1 t80 -69.76 -38.6 76.82 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.93 -179.417 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 48.2 t -78.06 -42.44 32.29 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.07 -0.513 . . . . 0.0 111.054 -178.952 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 17.4 p -59.96 -45.88 91.23 Favored 'General case' 0 C--O 1.216 -0.688 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.005 -179.293 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 76.4 mt -63.11 -31.71 72.92 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.21 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 29.9 mttt -64.35 -5.67 5.61 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.933 -179.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 177' ' ' LYS . . . . . 0.448 ' HZ3' ' CG2' ' A' ' 72' ' ' VAL . 20.8 ptmt -58.81 -31.2 68.23 Favored 'General case' 0 C--N 1.318 -0.791 0 O-C-N 123.423 0.452 . . . . 0.0 110.315 -179.252 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 178' ' ' LYS . . . . . . . . . . . . . 16.7 mmmt -63.54 -44.86 92.96 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.806 -179.795 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 97.3 mt-10 -70.12 -42.75 72.21 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.297 -179.919 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 180' ' ' ASN . . . . . . . . . . . . . 94.2 m-20 -65.78 -40.75 92.27 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.377 179.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 36.8 t 51.07 -97.08 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.724 -179.673 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 182' ' ' THR . . . . . 0.432 ' OG1' ' N ' ' A' ' 183' ' ' PHE . 59.7 p -72.04 -115.85 0.0 OUTLIER 'General case' 0 N--CA 1.453 -0.278 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.33 -179.926 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 183' ' ' PHE . . . . . 0.432 ' N ' ' OG1' ' A' ' 182' ' ' THR . 36.1 m-85 41.75 83.69 0.02 OUTLIER 'General case' 0 C--N 1.334 -0.102 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.079 -179.392 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 37.6 p -80.08 35.72 0.33 Allowed 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.317 -0.401 . . . . 0.0 109.924 179.938 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 185' ' ' ASP . . . . . 0.43 ' H ' ' C ' ' A' ' 183' ' ' PHE . 32.1 t70 -157.32 79.89 0.89 Allowed 'General case' 0 CA--C 1.517 -0.319 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.535 179.831 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 186' ' ' GLU . . . . . . . . . . . . . 69.5 mm-40 -134.05 94.84 3.31 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-O 120.952 0.406 . . . . 0.0 110.425 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 86.4 tttt -64.59 -32.21 73.76 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.512 179.902 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 188' ' ' CYS . . . . . . . . . . . . . 13.4 t 60.38 69.53 0.68 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.625 -179.7 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 189' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -130.6 81.29 1.99 Allowed 'General case' 0 CA--C 1.517 -0.296 0 CA-C-O 120.963 0.411 . . . . 0.0 110.415 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 190' ' ' ASN . . . . . . . . . . . . . 52.8 p30 -92.92 9.01 37.31 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.297 179.52 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 191' ' ' ASN . . . . . . . . . . . . . 56.8 t-20 . . . . . 0 C--O 1.22 -0.5 0 CA-C-O 118.013 -0.994 . . . . 0.0 110.57 179.939 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 68.6 m . . . . . 0 N--CA 1.49 1.567 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . 54.33 50.24 16.73 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.585 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -152.98 43.51 0.63 Allowed Glycine 0 N--CA 1.464 0.543 0 N-CA-C 110.861 -0.896 . . . . 0.0 110.861 -179.888 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.49 ' CD1' ' N ' ' A' ' 27' ' ' LEU . 8.6 mp -88.67 38.79 0.89 Allowed 'General case' 0 CA--C 1.513 -0.456 0 O-C-N 122.719 -0.283 . . . . 0.0 110.37 -179.801 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' THR . . . . . 0.419 ' C ' ' O ' ' A' ' 27' ' ' LEU . 49.5 p -35.8 -32.83 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.419 0 CA-C-O 120.904 0.383 . . . . 0.0 110.848 -179.917 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . 0.447 ' N ' ' O ' ' A' ' 27' ' ' LEU . . . 118.79 -100.08 0.81 Allowed Glycine 0 N--CA 1.464 0.557 0 N-CA-C 111.133 -0.787 . . . . 0.0 111.133 178.373 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -47.52 -55.09 9.86 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 121.029 -0.269 . . . . 0.0 111.172 -179.001 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 11.8 m -58.26 -45.6 87.52 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.647 -179.363 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 13.2 tppt? -63.37 -54.19 40.66 Favored 'General case' 0 N--CA 1.442 -0.871 0 C-N-CA 120.406 -0.517 . . . . 0.0 110.942 179.766 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 97.0 mt -59.79 -42.48 89.02 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 N-CA-C 109.373 -0.603 . . . . 0.0 109.373 -178.479 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 72.1 ttt-85 -61.88 -37.6 85.15 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.872 0.368 . . . . 0.0 110.745 -179.431 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 36.1 mt -67.44 -39.81 85.43 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.548 -0.296 . . . . 0.0 111.431 178.961 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 82.3 tt0 -68.3 -44.96 74.31 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.32 -179.766 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 71.7 ttt-85 -65.95 -44.16 85.82 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.357 179.927 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 15.4 m -69.74 -34.03 73.27 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.681 -179.911 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -72.01 -41.54 67.46 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.869 179.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -59.53 -31.33 69.3 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.527 -179.79 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 81.1 m-20 -68.15 -22.78 64.84 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.085 0.469 . . . . 0.0 110.807 -178.924 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 68.6 mt -65.89 -53.94 32.67 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.417 -179.457 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 71.0 p -76.01 -35.62 59.47 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.086 0.47 . . . . 0.0 111.274 -179.014 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 67.0 t0 -65.61 -39.97 92.11 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.745 -177.948 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 59.1 mm-40 -68.2 -51.16 48.68 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.95 -179.326 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 8.0 pt -67.68 -27.26 37.54 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.728 0 O-C-N 123.645 0.591 . . . . 0.0 110.694 -179.335 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 12.2 m-20 -62.43 -42.02 99.14 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.133 -179.892 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -52.28 -29.68 24.4 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.136 -179.179 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 57.1 mt -66.01 -43.28 92.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.239 179.363 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -56.15 -44.42 79.25 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 -179.004 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 5.9 mtpm? -64.56 -39.25 93.41 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.722 179.569 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 83.1 m-20 -58.61 -32.34 68.91 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.209 -179.099 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -67.0 -32.19 73.26 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.835 0.35 . . . . 0.0 110.657 179.481 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -57.01 -37.39 71.63 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.673 -179.239 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.426 ' CD1' ' N ' ' A' ' 55' ' ' LEU . 10.1 mp -52.47 -18.45 1.68 Allowed 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.524 -179.691 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 27.7 mtmm -129.71 146.08 51.5 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-O 120.919 0.39 . . . . 0.0 110.356 -179.744 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -73.24 47.19 1.32 Allowed Glycine 0 C--N 1.33 0.228 0 N-CA-C 111.035 -0.826 . . . . 0.0 111.035 -179.747 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 12.5 p -112.96 131.48 64.43 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.429 0 CA-C-O 121.17 0.509 . . . . 0.0 110.369 -179.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . 0.482 ' C ' ' H ' ' A' ' 61' ' ' ASP . 10.3 m120 -86.74 179.08 6.83 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.088 0.47 . . . . 0.0 110.407 179.622 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . 0.597 ' O ' ' N ' ' A' ' 62' ' ' ALA . 0.2 OUTLIER -72.91 10.87 0.78 Allowed 'General case' 0 C--O 1.22 -0.499 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.175 179.061 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . 0.482 ' H ' ' C ' ' A' ' 59' ' ' ASN . 4.8 m-20 60.99 -51.21 0.1 Allowed 'General case' 0 C--N 1.321 -0.662 0 O-C-N 123.897 0.748 . . . . 0.0 110.918 -179.483 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.597 ' N ' ' O ' ' A' ' 60' ' ' PHE . . . 60.99 81.88 0.18 Allowed 'General case' 0 N--CA 1.446 -0.634 0 CA-C-N 116.52 -0.309 . . . . 0.0 110.356 179.76 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 25.9 m-85 -46.67 146.93 1.38 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.701 -179.562 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.452 ' HG3' ' H ' ' A' ' 65' ' ' ASP . 6.4 pttm -149.84 -60.18 0.2 Allowed 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.23 -179.325 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.452 ' H ' ' HG3' ' A' ' 64' ' ' LYS . 51.3 t0 -159.73 -23.64 0.07 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.508 -179.35 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 5.5 tmtt? -60.11 -49.12 78.89 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-O 121.202 0.525 . . . . 0.0 110.279 -178.869 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 26.3 ttpp -64.4 129.36 39.59 Favored 'General case' 0 CA--C 1.515 -0.377 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.459 179.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 75.5 p -105.19 -85.88 0.47 Allowed 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.181 179.888 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -78.86 -113.27 0.21 Allowed Glycine 0 CA--C 1.525 0.674 0 N-CA-C 110.619 -0.992 . . . . 0.0 110.619 179.905 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 6.9 t -174.68 135.02 0.39 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.805 0.335 . . . . 0.0 110.538 179.879 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . 0.592 ' H ' ' CD2' ' A' ' 79' ' ' LEU . . . 76.7 3.2 78.66 Favored Glycine 0 N--CA 1.46 0.271 0 N-CA-C 110.716 -0.953 . . . . 0.0 110.716 179.497 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 41.2 t -116.77 -88.1 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.297 0 CA-C-O 120.806 0.336 . . . . 0.0 110.42 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 23.2 t -78.63 75.76 5.14 Favored 'General case' 0 CA--C 1.511 -0.55 0 N-CA-C 109.938 -0.393 . . . . 0.0 109.938 -179.403 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 168.0 -175.11 0.02 OUTLIER 'General case' 0 CA--C 1.517 -0.303 0 O-C-N 123.473 0.483 . . . . 0.0 110.453 -179.403 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 17.6 m120 -100.13 137.09 19.98 Favored Pre-proline 0 N--CA 1.448 -0.552 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.548 179.81 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 69.9 Cg_endo -75.66 -3.82 14.39 Favored 'Trans proline' 0 C--N 1.316 -1.138 0 C-N-CA 122.596 2.197 . . . . 0.0 111.916 179.757 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 69.6 t80 -68.88 -60.02 2.67 Favored 'General case' 0 C--N 1.319 -0.72 0 C-N-CA 120.784 -0.367 . . . . 0.0 111.383 -179.085 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . 0.509 ' CD1' ' O ' ' A' ' 60' ' ' PHE . 20.2 tt -76.06 -24.98 16.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.125 -179.001 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.592 ' CD2' ' H ' ' A' ' 71' ' ' GLY . 3.3 mp -72.53 -55.0 7.64 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.742 -179.435 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -63.32 -27.94 69.66 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.24 -179.424 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -61.55 -31.47 71.51 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.584 -179.749 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 33.8 ttmt -63.45 -22.68 67.03 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.72 -179.53 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 31.2 t -70.6 -44.74 76.5 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.998 -179.785 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 81.5 mmt-85 -61.71 -35.83 79.18 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.937 -178.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -62.47 -47.9 81.96 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.237 -179.827 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 73.6 p -67.25 -27.34 67.13 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.694 -179.716 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 31.2 m -61.35 -54.21 46.67 Favored 'General case' 0 C--N 1.326 -0.436 0 C-N-CA 120.573 -0.451 . . . . 0.0 111.424 -178.709 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 46.2 t -71.51 -45.72 66.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.248 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -56.32 -39.86 73.47 Favored 'General case' 0 C--O 1.218 -0.554 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.7 -178.662 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 79.7 tt0 -55.14 -47.8 74.57 Favored 'General case' 0 C--N 1.319 -0.761 0 C-N-CA 120.842 -0.343 . . . . 0.0 110.574 -179.938 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 53.3 mtpt -53.81 -36.77 62.85 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.587 -179.07 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 73.8 t80 -60.44 -42.21 95.64 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.592 179.663 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 58.7 t -59.1 -48.42 86.81 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.517 -177.924 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 70.4 mt -54.33 -42.06 55.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.393 179.906 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -53.85 -35.02 61.05 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.419 -179.777 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 37.4 mm -62.53 -43.32 98.27 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.781 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 83.4 tt0 -61.22 -44.86 96.59 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.962 -179.469 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 4.0 mp0 -59.55 -37.74 79.22 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.71 -179.728 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 73.1 mm-40 -67.87 -39.14 83.78 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.526 -179.543 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . 0.417 ' O ' ' N ' ' A' ' 104' ' ' LYS . . . -60.45 -33.96 73.3 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.343 -179.953 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 97.2 m -62.28 -44.05 97.42 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.395 -179.821 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 65.2 mttp -67.04 -11.13 56.21 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.401 -179.351 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . 0.503 ' O ' ' C ' ' A' ' 104' ' ' LYS . 61.2 mt -115.23 -11.59 11.95 Favored 'General case' 0 CA--C 1.502 -0.879 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.625 -179.732 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.503 ' C ' ' O ' ' A' ' 103' ' ' LEU . 36.4 ttpt -23.31 -47.0 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.694 0 O-C-N 123.705 0.628 . . . . 0.0 111.107 179.881 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . 0.501 ' O ' ' O ' ' A' ' 104' ' ' LYS . 1.9 mp0 -53.96 -154.27 0.0 OUTLIER 'General case' 0 C--O 1.225 -0.208 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.998 177.697 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' THR . . . . . 0.569 ' CG2' ' H ' ' A' ' 107' ' ' GLY . 5.1 t -46.25 -58.88 3.28 Favored 'General case' 0 C--N 1.322 -0.625 0 O-C-N 122.122 -0.361 . . . . 0.0 110.924 179.77 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . 0.569 ' H ' ' CG2' ' A' ' 106' ' ' THR . . . 72.62 148.61 0.88 Allowed Glycine 0 CA--C 1.522 0.506 0 N-CA-C 110.554 -1.018 . . . . 0.0 110.554 -179.632 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 11.4 t -97.04 136.37 37.7 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 120.913 0.387 . . . . 0.0 110.361 179.721 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 78.5 p -63.73 -35.47 80.69 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.756 -179.888 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -64.92 -36.27 92.89 Favored Glycine 0 CA--C 1.522 0.501 0 N-CA-C 111.079 -0.808 . . . . 0.0 111.079 -179.769 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 12.5 tm-20 -62.31 -47.52 83.91 Favored 'General case' 0 C--N 1.325 -0.458 0 C-N-CA 120.784 -0.367 . . . . 0.0 110.812 -179.443 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 69.3 m-85 -65.21 -38.53 90.72 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.329 -179.386 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 67.3 m -56.42 -40.93 75.53 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.417 -179.839 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -66.09 -28.31 68.73 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.376 179.405 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 42.1 tpp -74.12 -53.66 9.44 Favored 'General case' 0 C--N 1.333 -0.15 0 C-N-CA 120.66 -0.416 . . . . 0.0 110.713 -179.145 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 41.1 t80 -51.26 -37.83 49.33 Favored 'General case' 0 N--CA 1.461 0.086 0 N-CA-C 110.1 -0.333 . . . . 0.0 110.1 -179.576 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 26.2 m-20 -61.93 -41.65 98.2 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.001 179.552 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 1.2 tt -60.1 -41.55 92.78 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-O 120.933 0.397 . . . . 0.0 110.064 -179.636 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' MET . . . . . 0.542 ' SD ' ' SD ' ' A' ' 160' ' ' MET . 14.7 tpt -57.53 -47.69 81.33 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.536 -0.756 . . . . 0.0 109.503 -179.86 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 74.2 t80 -59.63 -43.51 93.8 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.432 -179.514 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 97.6 mt-10 -59.08 -35.74 73.9 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.716 -179.766 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 87.7 t -82.61 -24.31 8.76 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.662 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.399 -179.855 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 15.6 m -75.53 -27.94 58.9 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-O 121.078 0.466 . . . . 0.0 111.048 -179.324 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . 0.519 ' N ' ' HD2' ' A' ' 125' ' ' PRO . 4.0 mmtm -63.02 -58.04 18.26 Favored Pre-proline 0 C--O 1.213 -0.852 0 C-N-CA 120.563 -0.455 . . . . 0.0 112.185 -179.513 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . 0.519 ' HD2' ' N ' ' A' ' 124' ' ' LYS . 28.5 Cg_endo -59.8 -30.23 91.47 Favored 'Trans proline' 0 C--N 1.302 -1.893 0 C-N-CA 122.647 2.231 . . . . 0.0 112.532 -178.927 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -60.72 -35.35 76.1 Favored 'General case' 0 C--N 1.312 -1.045 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.783 -179.635 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 127' ' ' GLN . . . . . 0.404 ' CG ' ' N ' ' A' ' 128' ' ' LYS . 8.3 pt20 -51.5 -38.15 52.61 Favored 'General case' 0 C--N 1.311 -1.108 0 O-C-N 123.825 0.703 . . . . 0.0 110.504 -179.257 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . 0.404 ' N ' ' CG ' ' A' ' 127' ' ' GLN . 55.6 mtpt -63.53 -10.4 17.81 Favored 'General case' 0 CA--C 1.514 -0.412 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.922 -178.582 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 15.8 mt -117.61 21.86 12.72 Favored 'General case' 0 CA--C 1.509 -0.625 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.936 179.883 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . 0.517 ' O ' ' C ' ' A' ' 131' ' ' ILE . . . 101.15 -121.76 7.35 Favored Glycine 0 CA--C 1.506 -0.474 0 N-CA-C 110.735 -0.946 . . . . 0.0 110.735 179.589 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 131' ' ' ILE . . . . . 0.562 ' CD1' ' N ' ' A' ' 131' ' ' ILE . 2.0 mp 21.79 81.78 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 CA-C-N 116.591 0.195 . . . . 0.0 111.131 -179.439 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 69.5 tp60 -106.51 74.88 1.04 Allowed 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 -178.564 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 174.81 -6.81 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 O-C-N 123.452 0.47 . . . . 0.0 110.456 179.847 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 7.5 tpt -51.21 -40.33 58.5 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.493 -179.123 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 24.8 m -73.0 -59.76 2.56 Favored 'General case' 0 C--O 1.214 -0.777 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.048 179.444 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 136' ' ' LYS . . . . . 0.41 ' H ' ' HG2' ' A' ' 136' ' ' LYS . 44.9 mmtm -43.46 -50.8 6.9 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.982 -0.377 . . . . 0.0 109.982 -178.798 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 91.5 m -58.54 -52.11 67.06 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.629 -0.428 . . . . 0.0 110.925 179.621 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 48.7 t -64.03 -44.01 97.69 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.856 179.929 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 73.9 m -64.4 -42.19 96.24 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.495 -179.397 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 19.1 m-20 -67.07 -30.53 70.61 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.46 -179.58 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -71.43 -28.29 63.87 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.826 -179.433 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . 0.455 ' O ' ' O ' ' A' ' 143' ' ' GLU . . . -75.07 -29.97 60.84 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.695 -179.372 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . 0.533 ' O ' ' N ' ' A' ' 145' ' ' ASN . 69.3 tt0 -60.48 -119.47 0.0 OUTLIER 'General case' 0 C--O 1.211 -0.956 0 CA-C-O 119.082 -0.485 . . . . 0.0 109.811 -179.382 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 144' ' ' GLU . . . . . 0.501 ' C ' ' O ' ' A' ' 143' ' ' GLU . 84.0 tt0 18.54 -82.98 0.0 OUTLIER 'General case' 0 CA--C 1.518 -0.263 0 O-C-N 123.696 0.623 . . . . 0.0 111.678 -179.599 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 145' ' ' ASN . . . . . 0.533 ' N ' ' O ' ' A' ' 143' ' ' GLU . 57.7 t30 -127.19 95.58 36.07 Favored Pre-proline 0 CA--C 1.534 0.365 0 CA-C-N 115.467 -0.788 . . . . 0.0 111.24 178.332 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 146' ' ' PRO . . . . . . . . . . . . . 69.8 Cg_exo -50.07 125.16 14.15 Favored 'Trans proline' 0 C--N 1.321 -0.915 0 C-N-CA 122.653 2.235 . . . . 0.0 112.183 179.367 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 147' ' ' PRO . . . . . 0.469 ' C ' ' H ' ' A' ' 149' ' ' THR . 68.2 Cg_endo -75.37 70.52 5.52 Favored 'Trans proline' 0 C--N 1.312 -1.395 0 C-N-CA 122.527 2.151 . . . . 0.0 112.646 -179.402 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 40.2 p -77.88 22.05 0.29 Allowed 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.352 -179.914 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 149' ' ' THR . . . . . 0.469 ' H ' ' C ' ' A' ' 147' ' ' PRO . 16.6 m -137.6 163.36 31.41 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.539 179.55 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -62.99 -41.39 99.56 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.609 179.432 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 87.9 mt-30 -68.31 -33.68 74.76 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.139 179.804 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . -63.77 -51.42 53.88 Favored Glycine 0 CA--C 1.526 0.724 0 N-CA-C 110.834 -0.906 . . . . 0.0 110.834 -179.843 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 153' ' ' VAL . . . . . . . . . . . . . 69.1 t -60.77 -25.01 34.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 N-CA-C 110.157 -0.312 . . . . 0.0 110.157 -179.589 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -59.03 -39.74 82.9 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 121.133 0.492 . . . . 0.0 109.776 -179.011 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -59.84 -50.92 71.93 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 179.86 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 156' ' ' ILE . . . . . 0.423 HG21 HD13 ' A' ' 156' ' ' ILE . 20.1 mm -54.31 -56.06 11.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 C-N-CA 120.789 -0.364 . . . . 0.0 110.452 -179.417 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -50.32 -49.03 54.98 Favored 'General case' 0 C--N 1.33 -0.277 0 O-C-N 123.502 0.501 . . . . 0.0 110.339 179.9 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 158' ' ' LYS . . . . . 0.459 ' NZ ' ' OE2' ' A' ' 162' ' ' GLU . 63.6 tttm -64.91 -37.28 87.11 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.445 179.004 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 61.5 tttp -66.87 -31.96 72.91 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.308 -179.82 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 160' ' ' MET . . . . . 0.542 ' SD ' ' SD ' ' A' ' 119' ' ' MET . 3.8 mtm -67.3 -44.73 78.48 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.36 179.475 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 78.1 ttt180 -65.59 -33.23 75.43 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.411 -179.888 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . 0.459 ' OE2' ' NZ ' ' A' ' 158' ' ' LYS . 95.7 mt-10 -71.25 -29.68 65.4 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.152 -0.477 . . . . 0.0 111.0 -179.711 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 163' ' ' LYS . . . . . . . . . . . . . 2.0 tmtm? -83.11 -42.74 17.04 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-O 121.804 0.811 . . . . 0.0 110.94 -179.104 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 6.0 mt -67.82 -30.74 70.23 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.695 -0.684 . . . . 0.0 112.016 -178.607 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 4.5 pp0? -64.28 -31.82 73.17 Favored 'General case' 0 C--N 1.314 -0.963 0 O-C-N 123.776 0.673 . . . . 0.0 110.575 -179.08 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 58.4 ttt85 -65.88 -31.28 72.13 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.049 -179.346 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 167' ' ' VAL . . . . . . . . . . . . . 21.3 t -70.04 -45.22 77.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.066 -179.836 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 14.4 t60 -77.91 -30.03 50.43 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.627 -178.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 169' ' ' THR . . . . . . . . . . . . . 97.0 m -71.39 -46.54 60.03 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.952 -179.697 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 36.2 ttpt -60.76 -44.0 97.3 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.91 -179.286 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 171' ' ' ASN . . . . . . . . . . . . . 10.7 m120 -62.35 -30.88 71.49 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.608 179.725 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 172' ' ' TYR . . . . . . . . . . . . . 43.7 t80 -73.33 -35.29 66.01 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.09 0.472 . . . . 0.0 110.732 -179.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 1.9 t -76.61 -31.52 57.48 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.803 -179.375 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 9.2 p -60.82 -48.89 79.73 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.193 -179.1 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 11.0 mp -69.38 -32.19 71.07 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.338 179.23 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 33.9 ttmt -58.84 -28.52 66.14 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.091 -179.693 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 177' ' ' LYS . . . . . . . . . . . . . 58.9 tttm -55.48 -28.84 56.94 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.426 179.659 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 178' ' ' LYS . . . . . . . . . . . . . 25.2 mmtp -60.73 -44.28 96.85 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.441 -179.119 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 77.3 mt-10 -63.06 -32.66 74.08 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.157 -0.474 . . . . 0.0 109.85 179.376 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 180' ' ' ASN . . . . . . . . . . . . . 6.0 p30 -138.24 94.6 2.89 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-O 121.15 0.5 . . . . 0.0 109.962 179.661 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 11.1 t -52.68 -43.36 65.53 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.513 -179.35 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 182' ' ' THR . . . . . . . . . . . . . 64.3 p -60.44 96.12 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.476 179.379 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 183' ' ' PHE . . . . . 0.602 ' CD1' ' N ' ' A' ' 184' ' ' THR . 13.8 p90 -61.14 -44.84 96.71 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.076 0.465 . . . . 0.0 110.488 -179.971 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 184' ' ' THR . . . . . 0.602 ' N ' ' CD1' ' A' ' 183' ' ' PHE . 23.0 m -51.66 148.78 5.09 Favored 'General case' 0 CA--C 1.519 -0.231 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.526 -177.74 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 185' ' ' ASP . . . . . . . . . . . . . 36.4 t70 58.65 55.31 4.82 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.315 179.354 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 186' ' ' GLU . . . . . . . . . . . . . 80.6 mm-40 -136.63 -49.18 0.64 Allowed 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.185 179.548 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 34.3 tptt 54.84 105.24 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.925 179.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 188' ' ' CYS . . . . . . . . . . . . . 84.9 m -70.99 -53.81 13.49 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.591 179.764 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 189' ' ' LYS . . . . . 0.487 ' HZ2' ' ND2' ' A' ' 190' ' ' ASN . 62.9 tttm 46.63 -104.16 0.09 Allowed 'General case' 0 C--N 1.333 -0.121 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.232 -179.524 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 190' ' ' ASN . . . . . 0.491 ' CG ' ' H ' ' A' ' 191' ' ' ASN . 10.8 p-10 -125.23 -69.41 0.79 Allowed 'General case' 0 N--CA 1.455 -0.193 0 N-CA-C 109.955 -0.387 . . . . 0.0 109.955 179.709 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 191' ' ' ASN . . . . . 0.491 ' H ' ' CG ' ' A' ' 190' ' ' ASN . 53.0 p30 . . . . . 0 C--O 1.219 -0.525 0 CA-C-O 117.978 -1.011 . . . . 0.0 110.579 -179.379 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 70.6 m . . . . . 0 N--CA 1.49 1.556 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -166.29 -176.07 3.52 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.454 179.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . 0.492 ' O ' ' C ' ' A' ' 27' ' ' LEU . . . -174.86 -42.35 0.05 OUTLIER Glycine 0 CA--C 1.499 -0.906 0 CA-C-O 118.503 -1.165 . . . . 0.0 110.919 -179.94 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.492 ' C ' ' O ' ' A' ' 26' ' ' GLY . 50.7 mt -17.95 136.09 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.816 0 O-C-N 124.695 0.879 . . . . 0.0 111.239 179.532 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.7 t -152.03 45.33 0.75 Allowed 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.073 0.463 . . . . 0.0 109.997 -178.784 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . 0.471 ' C ' ' H ' ' A' ' 31' ' ' THR . . . 112.35 24.08 5.2 Favored Glycine 0 N--CA 1.472 1.099 0 N-CA-C 110.601 -1.0 . . . . 0.0 110.601 -179.781 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.409 ' CB ' ' O ' ' A' ' 29' ' ' GLY . . . 77.93 -20.77 0.36 Allowed 'General case' 0 C--O 1.221 -0.426 0 CA-C-O 121.531 0.681 . . . . 0.0 110.822 179.766 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.471 ' H ' ' C ' ' A' ' 29' ' ' GLY . 88.9 m -46.2 -34.31 4.26 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.369 -178.551 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 18.6 mmtp -64.25 -24.01 67.51 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.468 179.811 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 44.2 mm -62.0 -42.53 95.2 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.887 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 -179.073 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 45.0 ttm180 -63.32 -42.77 99.03 Favored 'General case' 0 C--N 1.321 -0.668 0 O-C-N 123.488 0.493 . . . . 0.0 110.141 -179.845 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 41.5 mt -66.66 -37.11 84.13 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.441 -179.765 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 80.4 tt0 -62.58 -45.51 92.6 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.6 -179.381 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -66.59 -40.82 89.09 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.329 179.937 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 83.5 p -73.49 -22.76 60.05 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.449 179.824 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -70.09 -49.54 49.9 Favored 'General case' 0 C--O 1.224 -0.27 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.768 -179.807 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 65.3 tttp -54.78 -42.68 72.05 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.567 -179.86 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . 0.413 ' OD1' ' N ' ' A' ' 41' ' ' ASP . 2.0 m-20 -50.44 -23.51 2.48 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.642 -179.336 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 72.2 mt -63.71 -50.89 75.96 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.094 -179.703 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 76.0 p -76.03 -38.51 57.15 Favored 'General case' 0 C--O 1.223 -0.3 0 CA-C-O 121.406 0.622 . . . . 0.0 110.797 -178.686 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 48.2 t0 -61.86 -35.99 79.93 Favored 'General case' 0 CA--C 1.519 -0.239 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.66 -177.472 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 66.1 mm-40 -71.26 -53.32 14.74 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.24 -179.76 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 9.3 pt -69.34 -31.84 51.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.706 -178.879 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 35.5 t0 -63.76 -29.45 70.66 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.181 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -67.31 -36.03 80.65 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.411 -0.358 . . . . 0.0 110.709 -179.763 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 70.4 mt -59.21 -48.42 86.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.137 -179.07 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 9.4 mtmp? -64.76 -36.4 84.19 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.469 179.707 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -62.74 -44.33 96.5 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.998 -0.547 . . . . 0.0 110.536 -179.688 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 60.1 m-20 -77.14 -35.34 56.23 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 116.511 -0.313 . . . . 0.0 110.896 -179.95 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -70.26 -38.81 75.2 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.799 -179.895 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . 0.528 ' O ' ' N ' ' A' ' 56' ' ' LYS . . . -50.79 -52.67 38.72 Favored 'General case' 0 CA--C 1.501 -0.936 0 CA-C-O 118.832 -0.604 . . . . 0.0 111.093 -178.929 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.554 ' O ' ' C ' ' A' ' 56' ' ' LYS . 4.5 mm? -12.98 80.96 0.0 OUTLIER 'General case' 0 CA--C 1.497 -1.095 0 O-C-N 124.423 1.077 . . . . 0.0 111.469 -179.744 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.554 ' C ' ' O ' ' A' ' 55' ' ' LEU . 1.1 ptmm? 8.77 67.5 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.63 0 O-C-N 124.793 1.308 . . . . 0.0 110.91 -178.256 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . 0.424 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . -156.56 -88.33 0.07 OUTLIER Glycine 0 CA--C 1.519 0.337 0 N-CA-C 110.661 -0.976 . . . . 0.0 110.661 -178.06 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 48.1 t -52.53 132.06 14.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-O 120.954 0.406 . . . . 0.0 110.599 -179.344 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . 0.404 ' O ' ' O ' ' A' ' 60' ' ' PHE . 8.1 m120 -64.65 -49.51 70.72 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.126 -179.188 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . 0.404 ' O ' ' O ' ' A' ' 59' ' ' ASN . 4.0 t80 50.96 176.54 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.768 -179.311 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 84.0 m-20 51.76 55.58 9.11 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.502 179.409 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -155.94 80.95 1.0 Allowed 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.45 -179.865 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 99.2 m-85 -116.23 7.95 14.19 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.345 179.672 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 65.2 mttp -53.7 -58.54 6.85 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.523 -179.785 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 90.9 m-20 -77.14 143.9 38.8 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.319 179.854 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 65.3 mttp -70.7 145.97 50.21 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.42 -179.851 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -75.9 149.94 37.66 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.29 179.914 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 3.5 t -149.23 156.8 42.7 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.496 -179.908 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 71.87 -108.6 2.54 Favored Glycine 0 CA--C 1.524 0.636 0 N-CA-C 110.981 -0.847 . . . . 0.0 110.981 179.924 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 24.2 t -169.51 -133.86 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.651 0.263 . . . . 0.0 110.683 -179.881 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -56.3 -52.8 47.39 Favored Glycine 0 C--N 1.333 0.361 0 N-CA-C 110.494 -1.042 . . . . 0.0 110.494 -179.69 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 27.5 m -39.03 157.77 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.209 0 CA-C-N 116.655 0.228 . . . . 0.0 110.598 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 40.3 t 56.01 -95.84 0.06 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.88 0.372 . . . . 0.0 110.272 -178.729 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . 0.493 ' O ' ' C ' ' A' ' 75' ' ' ASN . 43.8 tp10 -49.98 96.47 0.01 OUTLIER 'General case' 0 CA--C 1.51 -0.584 0 CA-C-O 119.299 -0.382 . . . . 0.0 110.491 -179.839 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . 0.623 ' N ' HD21 ' A' ' 75' ' ' ASN . 0.0 OUTLIER -22.32 111.03 0.15 Allowed Pre-proline 0 CA--C 1.544 0.717 0 O-C-N 124.556 1.16 . . . . 0.0 110.858 -179.969 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -51.14 -1.22 0.05 OUTLIER 'Trans proline' 0 C--N 1.31 -1.454 0 C-N-CA 122.564 2.176 . . . . 0.0 112.2 -179.038 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . 0.601 ' H ' ' C ' ' A' ' 75' ' ' ASN . 20.1 m-85 -66.79 -46.93 73.71 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-O 120.668 0.271 . . . . 0.0 110.662 -179.763 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 77.4 mt -72.17 -32.64 43.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-O 121.127 0.489 . . . . 0.0 110.358 -179.248 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.553 ' CD2' ' N ' ' A' ' 79' ' ' LEU . 3.2 mm? -66.88 -48.31 69.16 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.801 -178.723 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -69.31 -27.13 65.11 Favored 'General case' 0 C--N 1.317 -0.836 0 O-C-N 123.698 0.624 . . . . 0.0 109.969 179.664 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -79.24 -19.56 50.37 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.086 0.47 . . . . 0.0 110.837 179.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . 0.47 ' NZ ' ' CG2' ' A' ' 167' ' ' VAL . 53.1 tttm -70.5 -46.34 63.88 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.606 -179.499 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 16.4 m -71.59 -38.11 66.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.494 179.807 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -62.6 -38.64 90.95 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.662 -179.754 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -58.97 -42.26 89.5 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.698 -179.811 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 33.3 p -81.33 -20.0 41.65 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.706 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 85.9 m -62.09 -53.11 60.1 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 120.666 -0.413 . . . . 0.0 110.984 -178.471 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 48.9 t -69.37 -41.3 80.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 121.147 0.499 . . . . 0.0 110.639 -179.427 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -62.96 -36.81 84.71 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.769 -178.859 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 79.2 tt0 -54.94 -31.35 60.38 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.637 -179.906 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 63.8 mttp -66.51 -36.2 82.13 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.565 -179.969 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 87.6 t80 -62.35 -60.65 3.25 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.429 -178.624 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 16.5 m -51.65 -40.99 27.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-O 121.093 0.473 . . . . 0.0 110.602 -178.72 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 49.3 mt -57.04 -41.79 78.13 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 N-CA-C 109.783 -0.451 . . . . 0.0 109.783 -179.94 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.99 -36.56 79.76 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.081 -179.77 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . 0.411 HG22 HD12 ' A' ' 96' ' ' ILE . 30.5 mm -63.87 -43.94 97.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.535 -179.857 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 75.7 tt0 -58.34 -46.78 85.59 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.358 -179.404 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -70.74 -35.44 72.68 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.97 0.414 . . . . 0.0 110.793 -179.48 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 47.8 tp10 -62.75 -46.67 86.99 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.686 -179.27 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -56.12 -38.62 71.05 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.877 0.37 . . . . 0.0 110.478 -179.17 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 19.5 m -61.64 -41.86 98.09 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.653 -179.652 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -64.38 -40.76 96.45 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.912 -178.826 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . 0.534 ' O ' ' O ' ' A' ' 104' ' ' LYS . 33.9 mt -84.93 -10.3 57.22 Favored 'General case' 0 C--O 1.2 -1.542 0 CA-C-O 116.993 -1.479 . . . . 0.0 111.013 -178.702 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.549 ' HZ1' ' CG2' ' A' ' 106' ' ' THR . 0.0 OUTLIER 4.4 -124.71 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.062 0 O-C-N 125.243 1.59 . . . . 0.0 111.038 178.951 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . 0.55 ' O ' ' N ' ' A' ' 107' ' ' GLY . 69.7 mm-40 -56.98 -162.31 0.0 OUTLIER 'General case' 0 N--CA 1.437 -1.122 0 N-CA-C 109.986 -0.376 . . . . 0.0 109.986 178.653 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' THR . . . . . 0.549 ' CG2' ' HZ1' ' A' ' 104' ' ' LYS . 2.1 t 32.21 31.23 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 120.995 0.426 . . . . 0.0 110.87 -179.52 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . 0.55 ' N ' ' O ' ' A' ' 105' ' ' GLU . . . -89.28 158.66 27.97 Favored Glycine 0 C--N 1.335 0.506 0 N-CA-C 110.053 -1.219 . . . . 0.0 110.053 -179.103 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 55.9 m -114.75 124.43 51.76 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-O 120.919 0.39 . . . . 0.0 110.232 -179.744 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 77.9 p -59.99 -33.52 72.09 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.555 -179.985 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -63.61 -40.69 98.92 Favored Glycine 0 CA--C 1.524 0.62 0 N-CA-C 111.127 -0.789 . . . . 0.0 111.127 -179.548 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -67.58 -41.58 83.92 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.649 0.261 . . . . 0.0 110.586 -179.801 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 40.8 m-85 -63.06 -39.57 95.12 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.35 179.923 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 36.9 t -55.2 -38.21 68.09 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.144 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -69.88 -24.08 63.36 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.624 178.923 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 36.8 tpp -76.68 -45.79 28.29 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.063 -179.841 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 37.3 t80 -64.11 -36.24 83.37 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.877 0.37 . . . . 0.0 110.26 -179.374 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -65.6 -29.34 69.92 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.382 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 3.1 tt -64.18 -49.3 72.57 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 122.134 0.969 . . . . 0.0 110.723 -179.564 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 15.8 tpt -50.54 -41.64 54.25 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.146 -179.29 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 51.9 t80 -60.29 -41.97 94.48 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.059 0.457 . . . . 0.0 111.326 -179.83 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -58.98 -51.95 67.87 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.913 -178.991 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 29.1 m -72.94 -24.0 20.77 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-O 121.096 0.474 . . . . 0.0 110.856 -179.431 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 40.5 t -61.55 -27.18 68.44 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.454 -179.906 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . 0.45 ' CB ' ' CD ' ' A' ' 125' ' ' PRO . 16.2 mmtt -64.47 -59.19 11.29 Favored Pre-proline 0 C--O 1.222 -0.391 0 C-N-CA 120.575 -0.45 . . . . 0.0 111.775 -179.19 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . 0.45 ' CD ' ' CB ' ' A' ' 124' ' ' LYS . 61.1 Cg_exo -41.22 -36.89 2.69 Favored 'Trans proline' 0 C--N 1.306 -1.695 0 C-N-CA 122.537 2.158 . . . . 0.0 112.199 178.039 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 31.7 mt -67.52 -22.86 65.42 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.068 -179.438 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 127' ' ' GLN . . . . . 0.528 ' C ' ' H ' ' A' ' 129' ' ' LEU . 84.3 mt-30 -66.13 -50.93 62.3 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.995 0.426 . . . . 0.0 110.922 -179.621 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 73.8 mmtt -55.01 -6.11 0.12 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.609 179.713 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . 0.528 ' H ' ' C ' ' A' ' 127' ' ' GLN . 12.1 mt -118.08 19.25 13.66 Favored 'General case' 0 N--CA 1.465 0.299 0 O-C-N 123.451 0.47 . . . . 0.0 110.826 179.328 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . 0.506 ' O ' ' HB ' ' A' ' 131' ' ' ILE . . . 73.02 -177.13 42.73 Favored Glycine 0 CA--C 1.493 -1.333 0 N-CA-C 109.608 -1.397 . . . . 0.0 109.608 179.623 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 131' ' ' ILE . . . . . 0.919 ' O ' ' O ' ' A' ' 132' ' ' GLN . 60.9 mt 85.7 -20.91 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.476 -1.893 0 CA-C-O 116.996 -1.478 . . . . 0.0 110.78 178.576 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . 0.919 ' O ' ' O ' ' A' ' 131' ' ' ILE . 67.8 mt-30 -8.19 -145.58 0.0 OUTLIER 'General case' 0 N--CA 1.479 0.976 0 O-C-N 125.544 1.778 . . . . 0.0 112.097 -179.727 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 51.53 4.44 0.02 OUTLIER 'General case' 0 C--N 1.303 -1.417 0 O-C-N 120.032 -1.667 . . . . 0.0 111.409 179.385 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 134' ' ' MET . . . . . 0.611 ' H ' ' C ' ' A' ' 132' ' ' GLN . 0.0 OUTLIER -63.19 -43.35 98.44 Favored 'General case' 0 N--CA 1.444 -0.751 0 N-CA-C 109.926 -0.398 . . . . 0.0 109.926 -179.229 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 38.6 p -71.1 -22.4 62.09 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.737 -0.665 . . . . 0.0 109.97 179.655 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 16.3 ttmm -76.6 -57.05 4.08 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.323 -178.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 96.6 m -52.04 -53.17 45.21 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 120.686 -0.406 . . . . 0.0 110.628 -179.296 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 13.8 p -62.4 -39.64 85.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.787 -179.26 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 4.5 t -57.25 -33.29 67.44 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.382 -179.345 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -60.53 -39.85 89.34 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.47 -179.775 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -58.27 -51.28 70.42 Favored 'General case' 0 CA--C 1.515 -0.368 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.433 -179.752 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -41.29 -42.08 2.08 Favored 'General case' 0 CA--C 1.533 0.315 0 O-C-N 123.176 0.298 . . . . 0.0 110.482 -179.093 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 94.4 mt-10 -85.78 66.66 9.73 Favored 'General case' 0 C--N 1.322 -0.602 0 O-C-N 123.781 0.676 . . . . 0.0 109.727 177.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -179.45 -21.76 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 O-C-N 123.546 0.529 . . . . 0.0 110.606 179.813 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 145' ' ' ASN . . . . . 0.449 HD22 ' CD1' ' A' ' 156' ' ' ILE . 3.0 p-10 -173.04 68.31 0.37 Allowed Pre-proline 0 C--N 1.327 -0.41 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.247 -179.512 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 146' ' ' PRO . . . . . 0.493 ' C ' ' H ' ' A' ' 148' ' ' THR . 94.1 Cg_exo -37.39 118.27 0.24 Allowed 'Trans proline' 0 C--N 1.317 -1.131 0 C-N-CA 123.139 2.559 . . . . 0.0 111.69 -179.845 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 147' ' ' PRO . . . . . 0.475 ' C ' ' H ' ' A' ' 149' ' ' THR . 31.2 Cg_exo -59.98 39.86 0.05 OUTLIER 'Trans proline' 0 N--CA 1.498 1.794 0 C-N-CA 122.826 2.35 . . . . 0.0 112.408 178.931 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 148' ' ' THR . . . . . 0.493 ' H ' ' C ' ' A' ' 146' ' ' PRO . 20.6 p -65.61 0.39 1.65 Allowed 'General case' 0 N--CA 1.448 -0.573 0 N-CA-C 110.031 -0.359 . . . . 0.0 110.031 179.69 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 149' ' ' THR . . . . . 0.475 ' H ' ' C ' ' A' ' 147' ' ' PRO . 24.3 p -141.54 166.33 25.03 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.392 179.693 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -68.42 -41.31 80.59 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.626 179.778 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 99.1 mm-40 -66.76 -25.71 66.62 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.209 -179.63 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . -68.77 -33.71 76.23 Favored Glycine 0 CA--C 1.521 0.444 0 N-CA-C 111.237 -0.745 . . . . 0.0 111.237 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 153' ' ' VAL . . . . . . . . . . . . . 57.5 t -60.5 -26.48 37.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-O 120.921 0.391 . . . . 0.0 110.756 -178.786 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . 0.486 ' CD2' ' N ' ' A' ' 154' ' ' LEU . 4.0 mm? -62.97 -37.75 88.37 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.315 -179.073 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 42.3 tp10 -64.39 -32.93 74.74 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.064 -179.708 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 156' ' ' ILE . . . . . 0.459 ' CD1' ' N ' ' A' ' 156' ' ' ILE . 1.6 mp -77.06 -45.1 30.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.659 179.334 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -55.6 -43.2 75.83 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.541 -177.953 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -55.67 -47.28 76.99 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.022 -179.714 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 32.5 mmtp -65.66 -32.6 74.26 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.475 -0.33 . . . . 0.0 110.692 179.812 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 160' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -70.98 -53.23 15.62 Favored 'General case' 0 CA--C 1.515 -0.369 0 C-N-CA 120.505 -0.478 . . . . 0.0 111.309 -179.52 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 60.2 ttp180 -65.77 -42.58 90.65 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.736 -179.524 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 52.6 tp10 -57.8 -53.96 52.29 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.94 -179.061 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 163' ' ' LYS . . . . . . . . . . . . . 52.9 tptt -57.03 -35.26 69.08 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.708 -178.813 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 23.1 mt -69.57 -38.86 77.55 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.244 0.545 . . . . 0.0 111.709 -179.449 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 84.8 mt-30 -72.71 -32.11 65.5 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.648 -178.776 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 75.0 ttt180 -66.66 -40.96 88.84 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-O 121.951 0.882 . . . . 0.0 111.298 -178.622 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 167' ' ' VAL . . . . . 0.47 ' CG2' ' NZ ' ' A' ' 82' ' ' LYS . 7.7 p -75.17 -34.27 30.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 115.723 -0.672 . . . . 0.0 110.965 -179.958 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 168' ' ' HIS . . . . . 0.429 ' C ' ' ND1' ' A' ' 168' ' ' HIS . 14.6 t-80 -76.92 -41.66 42.61 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.935 -179.076 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 169' ' ' THR . . . . . . . . . . . . . 35.3 m -66.88 -43.8 82.52 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.235 -179.928 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 64.6 tttm -59.84 -48.19 82.69 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.842 -178.542 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 171' ' ' ASN . . . . . . . . . . . . . 20.0 t-20 -67.27 -40.72 86.21 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.009 0.433 . . . . 0.0 110.836 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 172' ' ' TYR . . . . . . . . . . . . . 64.1 t80 -68.76 -25.41 64.71 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.549 -179.293 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 17.0 t -78.47 -30.15 47.19 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.822 -179.209 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 22.7 p -73.06 -34.7 66.42 Favored 'General case' 0 C--O 1.222 -0.394 0 CA-C-O 121.333 0.587 . . . . 0.0 110.615 -178.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 99.0 mt -64.72 -43.54 93.11 Favored 'General case' 0 C--N 1.317 -0.828 0 C-N-CA 120.667 -0.413 . . . . 0.0 111.793 -178.617 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 17.7 ptpt -73.76 -14.25 61.09 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.009 -179.1 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 177' ' ' LYS . . . . . . . . . . . . . 14.9 pttp -46.93 -30.15 2.4 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.477 -0.329 . . . . 0.0 110.54 -178.98 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 178' ' ' LYS . . . . . . . . . . . . . 9.1 mtmp? -55.31 -34.62 64.32 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.858 -178.111 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 81.2 tt0 -50.64 -37.11 38.84 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.555 179.793 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 180' ' ' ASN . . . . . . . . . . . . . 83.1 m-20 -108.48 64.39 0.62 Allowed 'General case' 0 N--CA 1.47 0.551 0 CA-C-N 116.409 -0.359 . . . . 0.0 110.218 179.817 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 89.3 p -73.28 -10.81 60.15 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.471 179.783 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 182' ' ' THR . . . . . . . . . . . . . 20.8 m -60.14 -47.88 84.05 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.585 -179.638 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 183' ' ' PHE . . . . . . . . . . . . . 18.5 t80 -97.8 119.25 36.06 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.879 0.371 . . . . 0.0 110.211 179.933 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 31.1 m -64.46 119.63 10.77 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.664 -179.818 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 185' ' ' ASP . . . . . . . . . . . . . 55.1 t0 57.82 108.6 0.01 OUTLIER 'General case' 0 CA--C 1.519 -0.229 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.461 179.821 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 186' ' ' GLU . . . . . 0.473 ' N ' ' OE1' ' A' ' 186' ' ' GLU . 13.6 mp0 -114.69 135.47 54.12 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-O 120.995 0.426 . . . . 0.0 110.363 -179.745 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 34.6 ttmt -64.71 132.26 49.14 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.444 179.887 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 188' ' ' CYS . . . . . . . . . . . . . 4.5 m -81.13 -29.81 34.68 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.372 179.308 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 189' ' ' LYS . . . . . 0.499 ' HZ1' ' ND2' ' A' ' 191' ' ' ASN . 63.6 tttm 60.47 151.12 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 O-C-N 123.33 0.394 . . . . 0.0 110.637 -179.552 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 190' ' ' ASN . . . . . . . . . . . . . 58.6 t-20 -61.49 -40.17 93.58 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.5 -179.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 191' ' ' ASN . . . . . 0.499 ' ND2' ' HZ1' ' A' ' 189' ' ' LYS . 95.9 m-20 . . . . . 0 C--O 1.222 -0.349 0 CA-C-O 118.134 -0.936 . . . . 0.0 110.402 -179.835 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 33.9 t . . . . . 0 N--CA 1.491 1.58 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.501 ' O ' ' N ' ' A' ' 27' ' ' LEU . . . -66.02 151.24 47.27 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.464 179.904 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 56.76 -81.68 0.01 OUTLIER Glycine 0 C--N 1.333 0.399 0 N-CA-C 110.566 -1.014 . . . . 0.0 110.566 179.836 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.515 ' O ' ' OG1' ' A' ' 28' ' ' THR . 36.2 tp 55.71 106.79 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 110.017 -0.364 . . . . 0.0 110.017 -179.839 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' THR . . . . . 0.515 ' OG1' ' O ' ' A' ' 27' ' ' LEU . 6.8 m -171.84 -119.27 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.674 0 O-C-N 123.579 0.55 . . . . 0.0 109.707 179.163 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . 0.535 ' C ' ' H ' ' A' ' 31' ' ' THR . . . -134.51 93.84 0.25 Allowed Glycine 0 CA--C 1.526 0.744 0 N-CA-C 110.08 -1.208 . . . . 0.0 110.08 179.527 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . 73.16 -30.22 0.21 Allowed 'General case' 0 N--CA 1.466 0.371 0 CA-C-O 121.086 0.47 . . . . 0.0 111.062 -179.874 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.535 ' H ' ' C ' ' A' ' 29' ' ' GLY . 11.1 m -64.04 -32.74 74.39 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.351 -179.924 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 1.9 tmtp? -61.95 -50.36 72.43 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.785 179.678 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 64.8 mt -64.75 -28.94 45.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.455 -179.558 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 59.9 ttm-85 -69.27 -42.63 75.27 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.628 -179.421 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 79.4 mt -65.72 -35.0 79.49 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.637 -179.589 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 80.2 mm-40 -67.19 -50.24 61.68 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.761 179.879 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 23.3 mmm180 -63.42 -43.75 96.58 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.923 0.392 . . . . 0.0 110.832 -179.234 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 78.7 p -66.86 -38.59 86.63 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.319 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -70.62 -37.08 73.77 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.872 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 33.8 tptt -62.31 -31.92 72.6 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.846 -179.252 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 82.3 m-20 -67.02 -23.6 65.93 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.86 -179.384 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 73.3 mt -62.45 -53.39 47.89 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.365 0 C-N-CA 120.731 -0.388 . . . . 0.0 110.995 -179.391 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 52.6 p -74.1 -39.99 63.03 Favored 'General case' 0 C--O 1.226 -0.183 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.475 -178.583 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -60.26 -39.54 87.16 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.119 -0.491 . . . . 0.0 112.03 -178.435 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 43.2 tp10 -70.33 -53.5 16.47 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.092 0.473 . . . . 0.0 111.385 -178.612 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 6.5 pt -67.27 -27.05 37.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.588 -179.056 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 31.7 t0 -61.82 -40.92 96.95 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 120.576 -0.449 . . . . 0.0 110.388 179.9 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -52.96 -24.85 10.24 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.383 -178.875 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 62.3 mt -64.55 -46.56 92.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.298 179.65 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 49.0 mtmt -56.53 -41.29 76.54 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.28 -178.5 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 71.4 mmtt -65.98 -41.68 90.83 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.192 179.613 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -61.87 -41.48 97.91 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.471 -179.834 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . 0.482 ' O ' ' N ' ' A' ' 57' ' ' GLY . . . -61.34 -31.39 71.26 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.669 -179.953 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -61.89 -34.06 75.34 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.763 -179.759 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 52.3 mt -62.34 -41.97 99.01 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.948 -179.374 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -94.74 -56.26 2.84 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.599 -179.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . 0.482 ' N ' ' O ' ' A' ' 53' ' ' ALA . . . 98.07 47.9 1.98 Allowed Glycine 0 N--CA 1.467 0.732 0 N-CA-C 110.722 -0.951 . . . . 0.0 110.722 179.955 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.415 ' O ' ' O ' ' A' ' 59' ' ' ASN . 4.8 t -90.43 55.68 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.336 0 CA-C-O 120.822 0.344 . . . . 0.0 110.151 179.932 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . 0.415 ' O ' ' O ' ' A' ' 58' ' ' VAL . 72.7 m-80 47.38 -175.5 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.85 -179.927 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 28.2 t80 -172.2 -53.68 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.91 0.386 . . . . 0.0 110.64 179.686 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 85.4 m-20 -91.79 -10.79 38.64 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.532 -179.982 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -69.08 68.19 0.17 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.602 -179.855 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 65.6 m-85 -91.32 108.3 19.79 Favored 'General case' 0 N--CA 1.463 0.217 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 179.543 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.479 ' O ' ' N ' ' A' ' 66' ' ' LYS . 56.0 mtpt -96.03 18.25 13.82 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.432 -179.881 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 28.5 t70 61.98 -73.07 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.238 0 O-C-N 123.57 0.544 . . . . 0.0 110.717 179.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . 0.479 ' N ' ' O ' ' A' ' 64' ' ' LYS . 65.0 mttp -68.03 98.9 0.81 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.118 179.892 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -81.53 -8.77 59.76 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.485 -179.833 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 29.5 m 44.75 95.71 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.07 179.929 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 78.95 -116.8 4.41 Favored Glycine 0 CA--C 1.524 0.626 0 N-CA-C 110.661 -0.976 . . . . 0.0 110.661 -179.669 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 84.1 p -156.05 -136.3 0.05 Allowed 'General case' 0 N--CA 1.463 0.223 0 CA-C-O 120.697 0.284 . . . . 0.0 110.689 -179.772 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . 0.506 ' O ' ' N ' ' A' ' 73' ' ' SER . . . -52.0 -179.39 0.05 OUTLIER Glycine 0 CA--C 1.523 0.545 0 N-CA-C 110.41 -1.076 . . . . 0.0 110.41 179.529 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 14.8 t 61.56 -69.53 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-O 120.727 0.298 . . . . 0.0 110.827 -179.773 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' SER . . . . . 0.506 ' N ' ' O ' ' A' ' 71' ' ' GLY . 67.9 m -48.45 -63.86 0.96 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.704 179.922 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 41.8 tp10 -92.01 -65.86 0.97 Allowed 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 116.464 -0.335 . . . . 0.0 110.433 -179.817 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 6.2 m-20 -176.86 118.19 0.27 Allowed Pre-proline 0 CA--C 1.547 0.858 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.33 178.876 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -75.59 -14.14 20.0 Favored 'Trans proline' 0 N--CA 1.496 1.628 0 C-N-CA 121.709 1.606 . . . . 0.0 112.027 -179.932 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 59.3 t80 -74.31 -51.04 16.4 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-O 120.853 0.359 . . . . 0.0 111.555 -179.611 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 71.8 mt -67.47 -30.45 48.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.691 -179.482 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 8.5 mp -75.93 -48.85 19.61 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 121.097 0.475 . . . . 0.0 110.016 179.337 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -62.14 -28.06 69.38 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.937 -0.574 . . . . 0.0 109.963 179.742 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -66.37 -37.57 85.58 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.663 179.82 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 36.6 ttpt -62.82 -26.64 68.84 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.799 -179.794 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 54.0 t -70.43 -44.96 76.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.398 179.609 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 44.0 ttm180 -64.16 -35.69 81.62 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.089 -179.529 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -63.12 -41.74 99.4 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.949 0.404 . . . . 0.0 111.176 -179.333 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 41.3 p -72.76 -23.72 60.86 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.427 179.719 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 25.2 m -60.71 -51.18 70.47 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 120.787 -0.365 . . . . 0.0 111.0 -179.473 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 21.9 t -78.54 -48.24 22.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-O 121.209 0.528 . . . . 0.0 111.92 179.791 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -54.62 -45.59 73.73 Favored 'General case' 0 C--O 1.223 -0.331 0 CA-C-N 115.397 -0.819 . . . . 0.0 111.62 -177.387 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.423 ' CG ' ' N ' ' A' ' 91' ' ' LYS . 14.3 pt-20 -59.75 -42.57 93.52 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.989 0.424 . . . . 0.0 110.594 -179.569 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . 0.423 ' N ' ' CG ' ' A' ' 90' ' ' GLU . 67.6 mttm -59.09 -38.3 79.17 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.35 -179.221 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 88.2 t80 -60.81 -38.49 85.59 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.654 179.532 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 52.9 t -59.02 -44.65 91.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.247 -178.492 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 71.7 mt -54.69 -37.34 39.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.247 -179.787 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.33 -37.67 81.36 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.577 -179.867 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 38.4 mm -61.94 -43.95 98.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 120.91 0.386 . . . . 0.0 110.031 -179.751 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 81.6 tt0 -65.04 -41.83 94.87 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 120.683 -0.407 . . . . 0.0 110.707 179.489 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 40.9 tp10 -59.77 -46.46 89.11 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.924 0.392 . . . . 0.0 110.563 -178.908 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 80.2 mm-40 -60.96 -37.45 82.46 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.225 -179.743 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -64.82 -38.07 89.74 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.606 179.867 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 18.7 m -64.08 -47.7 79.05 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.062 -179.455 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -75.15 -18.94 60.11 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.3 -179.462 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 39.1 tp -90.48 -7.68 52.4 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-O 121.179 0.514 . . . . 0.0 110.218 -179.766 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 85.6 tttt -71.91 72.37 0.83 Allowed 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 120.527 -0.469 . . . . 0.0 110.825 179.762 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 79.2 tt0 -170.2 -61.02 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.581 179.652 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 59.5 p -69.76 -34.55 73.95 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.385 179.884 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 67.11 168.78 3.62 Favored Glycine 0 CA--C 1.523 0.579 0 N-CA-C 110.747 -0.941 . . . . 0.0 110.747 -179.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 24.4 t -172.16 -150.01 0.06 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.683 0.278 . . . . 0.0 110.436 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' SER . . . . . 0.565 ' HG ' ' H ' ' A' ' 110' ' ' GLY . 39.9 p -163.43 -77.34 0.04 OUTLIER 'General case' 0 C--N 1.333 -0.12 0 CA-C-O 120.857 0.361 . . . . 0.0 110.318 179.844 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . 0.565 ' H ' ' HG ' ' A' ' 109' ' ' SER . . . -65.59 -30.19 76.87 Favored Glycine 0 CA--C 1.524 0.617 0 N-CA-C 110.881 -0.888 . . . . 0.0 110.881 179.819 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 78.4 tt0 -60.31 -38.13 82.72 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.69 0.281 . . . . 0.0 110.498 -179.601 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 54.7 m-85 -60.6 -44.91 95.74 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.537 -0.301 . . . . 0.0 110.557 -179.829 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 70.0 m -50.78 -30.58 14.51 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.698 -179.52 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -62.13 -32.18 72.74 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.75 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 50.6 mmm -67.76 -40.64 84.06 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-O 121.058 0.456 . . . . 0.0 110.906 -179.744 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 55.8 m-85 -62.74 -30.85 71.74 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.183 -179.938 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -55.91 -37.99 69.65 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.994 0.426 . . . . 0.0 110.618 -179.612 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . 0.441 ' CD2' ' N ' ' A' ' 118' ' ' LEU . 4.1 mm? -61.42 -40.36 94.14 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.819 -0.628 . . . . 0.0 109.682 -179.178 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' MET . . . . . 0.408 ' C ' ' SD ' ' A' ' 119' ' ' MET . 0.0 OUTLIER -60.46 -53.21 60.28 Favored 'General case' 0 C--N 1.319 -0.727 0 C-N-CA 119.745 -0.782 . . . . 0.0 109.906 -179.632 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 20.1 m-85 -61.52 -46.36 90.3 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.667 -179.717 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 9.7 tm-20 -58.0 -44.87 87.48 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.185 -179.062 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 86.9 t -75.95 -21.47 15.67 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.33 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.078 179.804 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 32.2 t -71.43 -26.85 62.92 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 120.467 -0.493 . . . . 0.0 111.288 179.775 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . 0.412 ' N ' ' HD2' ' A' ' 125' ' ' PRO . 2.4 mptm? -58.8 -59.29 14.19 Favored Pre-proline 0 CA--C 1.542 0.64 0 C-N-CA 120.911 -0.316 . . . . 0.0 110.738 -179.827 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . 0.412 ' HD2' ' N ' ' A' ' 124' ' ' LYS . 37.3 Cg_endo -61.86 -50.04 5.85 Favored 'Trans proline' 0 N--CA 1.494 1.511 0 C-N-CA 122.039 1.826 . . . . 0.0 111.493 179.183 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 8.1 mp -56.71 -43.13 80.28 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.113 -179.16 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 11.9 tm0? -64.15 -49.98 70.01 Favored 'General case' 0 C--N 1.316 -0.849 0 C-N-CA 119.975 -0.69 . . . . 0.0 109.819 179.571 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -56.29 -19.38 14.02 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.188 -179.869 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 1.7 tt -93.72 -65.65 0.98 Allowed 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.742 179.886 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -151.8 -136.85 2.51 Favored Glycine 0 N--CA 1.462 0.374 0 N-CA-C 110.944 -0.862 . . . . 0.0 110.944 -178.955 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 131' ' ' ILE . . . . . 0.484 ' O ' ' CB ' ' A' ' 132' ' ' GLN . 81.2 mt 52.01 -114.58 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.333 -0.126 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 -178.977 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . 0.484 ' CB ' ' O ' ' A' ' 131' ' ' ILE . 57.6 tp60 97.15 55.4 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.803 0 O-C-N 124.138 0.899 . . . . 0.0 110.705 179.137 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 25.1 tt0 -170.42 -21.38 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 120.339 -0.544 . . . . 0.0 111.038 179.786 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -52.26 -53.21 46.75 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.191 0.52 . . . . 0.0 110.618 -178.766 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 24.5 m -61.47 -28.54 69.36 Favored 'General case' 0 C--N 1.314 -0.945 0 C-N-CA 120.655 -0.418 . . . . 0.0 110.526 -179.494 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 30.3 ttpt -79.76 -57.05 3.85 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 116.14 -0.482 . . . . 0.0 112.141 -178.505 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 137' ' ' THR . . . . . 0.433 ' CG2' ' N ' ' A' ' 138' ' ' VAL . 14.1 t -59.71 -43.35 94.15 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.291 -178.298 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 138' ' ' VAL . . . . . 0.433 ' N ' ' CG2' ' A' ' 137' ' ' THR . 70.3 t -63.78 -44.77 98.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.425 -179.753 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 77.9 p -62.53 -38.25 89.24 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.845 0.355 . . . . 0.0 110.69 -179.593 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 93.8 m-20 -70.78 -30.58 67.1 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.584 179.857 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -65.11 -26.3 68.15 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.991 -179.873 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . 0.473 ' O ' ' O ' ' A' ' 143' ' ' GLU . . . -65.64 -29.01 69.52 Favored 'General case' 0 CA--C 1.51 -0.592 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.646 -179.3 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . 0.577 ' O ' ' N ' ' A' ' 145' ' ' ASN . 14.2 mm-40 -59.39 -123.49 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 -179.878 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 144' ' ' GLU . . . . . 0.406 ' C ' ' O ' ' A' ' 143' ' ' GLU . 72.0 mm-40 26.05 -81.09 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 123.574 0.749 . . . . 0.0 111.844 -179.981 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 145' ' ' ASN . . . . . 0.577 ' N ' ' O ' ' A' ' 143' ' ' GLU . 24.7 t30 -129.67 91.66 39.94 Favored Pre-proline 0 CA--C 1.55 0.964 0 CA-C-N 115.584 -0.735 . . . . 0.0 110.38 178.27 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 146' ' ' PRO . . . . . 0.487 ' O ' ' N ' ' A' ' 148' ' ' THR . 96.1 Cg_exo -43.67 106.73 0.08 OUTLIER 'Trans proline' 0 N--CA 1.501 1.939 0 C-N-CA 122.738 2.292 . . . . 0.0 112.052 -179.796 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 147' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_exo -48.48 81.78 0.02 OUTLIER 'Trans proline' 0 N--CA 1.5 1.87 0 C-N-CA 122.299 1.999 . . . . 0.0 112.661 179.848 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 148' ' ' THR . . . . . 0.487 ' N ' ' O ' ' A' ' 146' ' ' PRO . 1.2 m -97.12 14.42 25.84 Favored 'General case' 0 N--CA 1.47 0.556 0 O-C-N 122.14 -0.35 . . . . 0.0 110.112 179.994 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 149' ' ' THR . . . . . . . . . . . . . 28.4 p -140.82 167.91 21.05 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.518 -179.811 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -62.26 -44.15 97.21 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.503 -179.851 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 151' ' ' GLN . . . . . 0.415 HE21 ' C ' ' A' ' 151' ' ' GLN . 0.0 OUTLIER -66.28 -37.0 84.4 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.756 -179.763 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . -55.53 -46.9 79.79 Favored Glycine 0 CA--C 1.523 0.59 0 N-CA-C 110.985 -0.846 . . . . 0.0 110.985 -179.26 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 153' ' ' VAL . . . . . . . . . . . . . 55.0 t -64.14 -24.69 36.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-O 120.828 0.347 . . . . 0.0 110.334 -179.62 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 1.1 tt -60.46 -40.44 91.21 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 109.558 -0.534 . . . . 0.0 109.558 -178.887 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -57.54 -46.07 84.31 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.062 179.535 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 16.0 mm -61.36 -43.63 97.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 -178.521 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -54.51 -50.02 68.83 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.38 179.202 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 158' ' ' LYS . . . . . 0.492 ' NZ ' ' OE2' ' A' ' 162' ' ' GLU . 65.1 tttm -62.72 -40.96 98.81 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.05 179.862 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 65.1 mmtt -65.92 -31.97 73.2 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.217 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 160' ' ' MET . . . . . . . . . . . . . 2.0 mtp -67.71 -47.89 68.1 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.228 0.537 . . . . 0.0 110.334 -179.5 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 62.4 ttp180 -66.44 -34.04 77.05 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.604 -179.716 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . 0.492 ' OE2' ' NZ ' ' A' ' 158' ' ' LYS . 48.5 mt-10 -69.95 -40.0 75.72 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.995 179.927 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 163' ' ' LYS . . . . . . . . . . . . . 17.0 tptp -67.35 -40.85 85.85 Favored 'General case' 0 C--N 1.325 -0.458 0 C-N-CA 120.553 -0.459 . . . . 0.0 111.135 -179.299 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 7.9 mt -69.15 -26.33 64.82 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.269 -179.628 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 165' ' ' GLN . . . . . 0.406 ' O ' ' OG1' ' A' ' 169' ' ' THR . 50.7 tt0 -59.98 -45.3 93.17 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.728 -179.146 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 84.8 mtp180 -61.8 -29.46 70.17 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.35 0.595 . . . . 0.0 110.889 -179.723 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 167' ' ' VAL . . . . . . . . . . . . . 22.3 t -67.93 -46.85 81.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.491 -179.827 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 168' ' ' HIS . . . . . 0.463 ' O ' ' ND1' ' A' ' 168' ' ' HIS . 29.4 t-80 -79.23 -28.99 42.53 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.28 179.943 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 169' ' ' THR . . . . . 0.406 ' OG1' ' O ' ' A' ' 165' ' ' GLN . 27.8 m -72.72 -48.52 38.04 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.781 0.324 . . . . 0.0 111.351 -179.562 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 170' ' ' LYS . . . . . 0.401 ' O ' ' OG1' ' A' ' 174' ' ' THR . 56.0 mtpt -64.08 -43.39 95.57 Favored 'General case' 0 C--N 1.326 -0.436 0 C-N-CA 120.756 -0.377 . . . . 0.0 110.692 -179.52 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 171' ' ' ASN . . . . . . . . . . . . . 42.8 t-20 -65.79 -35.04 79.59 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.597 -179.866 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 172' ' ' TYR . . . . . . . . . . . . . 89.4 t80 -74.65 -45.06 47.2 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.734 -0.667 . . . . 0.0 110.639 179.699 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 16.8 t -66.82 -44.04 82.19 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.177 -179.381 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 174' ' ' THR . . . . . 0.401 ' OG1' ' O ' ' A' ' 170' ' ' LYS . 12.6 p -60.92 -46.34 91.06 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.186 -179.648 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 175' ' ' LEU . . . . . 0.4 ' C ' ' H ' ' A' ' 177' ' ' LYS . 33.8 tp -63.85 -31.98 73.34 Favored 'General case' 0 C--N 1.319 -0.741 0 C-N-CA 120.581 -0.448 . . . . 0.0 110.719 -179.227 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 2.7 tptm -65.04 -2.85 3.0 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.648 -178.729 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 177' ' ' LYS . . . . . 0.4 ' H ' ' C ' ' A' ' 175' ' ' LEU . 20.7 ptmt -61.66 -16.04 45.2 Favored 'General case' 0 C--N 1.318 -0.769 0 C-N-CA 120.651 -0.419 . . . . 0.0 111.183 -178.962 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 178' ' ' LYS . . . . . . . . . . . . . 74.5 mmtt -68.98 -47.1 66.42 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.893 -179.324 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 179' ' ' GLU . . . . . 0.442 ' OE1' ' N ' ' A' ' 179' ' ' GLU . 56.0 mp0 -72.79 -42.64 63.71 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.048 0.451 . . . . 0.0 110.197 179.965 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 180' ' ' ASN . . . . . . . . . . . . . 91.7 m-20 -65.67 -31.31 72.26 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.26 179.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 2.7 p 74.55 -49.07 0.66 Allowed 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.209 -179.682 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 182' ' ' THR . . . . . . . . . . . . . 81.9 p -75.49 176.19 7.79 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.018 179.496 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 183' ' ' PHE . . . . . 0.503 ' CD2' ' N ' ' A' ' 184' ' ' THR . 32.9 p90 -135.72 -50.99 0.73 Allowed 'General case' 0 N--CA 1.469 0.511 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.57 -179.843 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 184' ' ' THR . . . . . 0.503 ' N ' ' CD2' ' A' ' 183' ' ' PHE . 7.4 t -88.12 160.34 17.82 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-N 116.387 -0.369 . . . . 0.0 110.23 179.68 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 185' ' ' ASP . . . . . . . . . . . . . 11.6 t70 64.22 33.78 11.42 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.844 179.929 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 186' ' ' GLU . . . . . . . . . . . . . 2.2 pp20? -168.48 141.6 3.02 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.402 -179.91 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 22.3 pttp -171.69 149.52 2.58 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.261 179.699 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 188' ' ' CYS . . . . . 0.401 ' O ' ' C ' ' A' ' 189' ' ' LYS . 23.8 m -75.94 -138.66 0.02 OUTLIER 'General case' 0 C--O 1.233 0.203 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 179.43 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 189' ' ' LYS . . . . . 0.401 ' C ' ' O ' ' A' ' 188' ' ' CYS . 20.7 pttm 30.39 55.63 0.18 Allowed 'General case' 0 N--CA 1.475 0.81 0 O-C-N 123.566 0.541 . . . . 0.0 111.224 179.323 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 190' ' ' ASN . . . . . . . . . . . . . 59.1 t30 -153.88 81.59 1.15 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.405 -178.723 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 191' ' ' ASN . . . . . . . . . . . . . 23.6 p30 . . . . . 0 C--O 1.219 -0.503 0 CA-C-O 117.978 -1.01 . . . . 0.0 111.552 179.769 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 16.6 m . . . . . 0 N--CA 1.49 1.526 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -170.91 -28.13 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.636 -179.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 43.09 74.05 0.21 Allowed Glycine 0 CA--C 1.524 0.642 0 N-CA-C 111.063 -0.815 . . . . 0.0 111.063 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 5.7 tp -78.34 -50.85 11.03 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.952 0.406 . . . . 0.0 110.829 -179.791 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' THR . . . . . 0.515 ' O ' ' C ' ' A' ' 29' ' ' GLY . 72.2 p 44.15 70.97 0.28 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.709 -179.698 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . 0.515 ' C ' ' O ' ' A' ' 28' ' ' THR . . . -29.36 146.21 0.01 OUTLIER Glycine 0 CA--C 1.525 0.677 0 N-CA-C 110.988 -0.845 . . . . 0.0 110.988 179.827 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.43 ' CB ' ' O ' ' A' ' 29' ' ' GLY . . . 76.42 -69.36 0.16 Allowed 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.953 0.406 . . . . 0.0 110.554 -179.526 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 86.0 m -50.47 -39.73 48.95 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.473 -179.953 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 6.2 tmtt? -49.77 -29.35 7.61 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.673 -179.766 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 96.4 mt -52.86 -52.96 23.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.697 -179.19 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 87.9 mtm180 -62.19 -41.31 98.23 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.458 -179.472 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.492 ' N ' ' CD2' ' A' ' 35' ' ' LEU . 4.2 mm? -64.17 -52.01 61.04 Favored 'General case' 0 N--CA 1.455 -0.22 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.037 -179.705 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 83.7 tt0 -65.27 -46.17 81.55 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.598 -179.401 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 44.7 ttm180 -64.59 -45.43 87.03 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.794 -179.148 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 30.2 t -72.14 -37.11 69.51 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.916 -178.725 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -71.51 -49.69 38.6 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.231 -178.383 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 64.3 mmtt -57.77 -30.64 65.79 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.683 -178.667 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 86.1 m-20 -68.36 -24.43 64.79 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.87 -178.268 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 63.0 mt -63.03 -56.74 15.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.281 -178.278 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' THR . . . . . 0.458 ' HG1' ' N ' ' A' ' 44' ' ' ASP . 55.8 p -75.78 -38.36 58.34 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.143 -178.455 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . 0.458 ' N ' ' HG1' ' A' ' 43' ' ' THR . 96.3 m-20 -61.5 -38.53 87.69 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.978 -176.99 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 14.3 tm-20 -72.22 -58.5 3.36 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.114 -0.493 . . . . 0.0 111.248 -178.057 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 7.4 pt -61.22 -28.53 44.0 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.188 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.782 -178.539 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -66.51 -38.58 87.52 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.814 179.288 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . 0.414 ' O ' ' OD2' ' A' ' 52' ' ' ASP . . . -55.92 -25.1 41.55 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.485 -179.904 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 66.9 mt -58.39 -43.02 85.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.678 -179.631 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -60.6 -34.21 73.89 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.57 -179.8 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -61.72 -51.75 67.11 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.964 -179.036 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . 0.414 ' OD2' ' O ' ' A' ' 48' ' ' ALA . 0.4 OUTLIER -70.21 -19.8 63.14 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.753 -179.189 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -72.92 -32.92 65.65 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.734 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -58.06 -25.79 61.7 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.63 -179.786 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 79.3 mt -55.67 -43.76 76.63 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.366 -179.346 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 72.7 mmtt -107.11 144.09 34.32 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.935 0.398 . . . . 0.0 110.346 178.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -73.86 73.17 1.26 Allowed Glycine 0 CA--C 1.521 0.447 0 N-CA-C 110.946 -0.862 . . . . 0.0 110.946 -179.573 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 39.1 t -116.16 126.84 73.82 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-O 120.852 0.358 . . . . 0.0 110.498 -179.889 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 23.6 m120 -65.16 103.16 0.73 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.482 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 40.3 t80 -59.92 -49.32 78.15 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.618 -179.362 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . 0.462 ' C ' ' H ' ' A' ' 63' ' ' PHE . 46.1 p-10 -57.74 -161.0 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.353 179.705 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . 70.93 -45.85 0.62 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.36 -179.588 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . 0.462 ' H ' ' C ' ' A' ' 61' ' ' ASP . 68.7 t80 -73.18 134.8 44.5 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.434 179.819 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 61.3 tttp -151.46 -70.71 0.17 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.648 -179.554 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 48.4 t0 -161.69 -67.72 0.06 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.62 -179.809 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -60.1 90.4 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.353 179.574 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 1.2 ttmp? -148.51 158.89 44.42 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.622 -179.495 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 22.4 m -57.3 -36.9 71.66 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.571 -179.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 74.64 -142.15 29.56 Favored Glycine 0 CA--C 1.525 0.682 0 N-CA-C 110.925 -0.87 . . . . 0.0 110.925 -179.971 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' SER . . . . . 0.781 ' HG ' ' HZ1' ' A' ' 177' ' ' LYS . 50.6 m 55.35 165.3 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.826 0.346 . . . . 0.0 110.561 179.796 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -65.38 -30.45 77.65 Favored Glycine 0 CA--C 1.524 0.599 0 N-CA-C 110.954 -0.858 . . . . 0.0 110.954 179.969 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.421 ' O ' ' O ' ' A' ' 73' ' ' SER . 7.6 p -73.08 157.96 6.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-O 120.729 0.3 . . . . 0.0 110.558 -179.968 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' SER . . . . . 0.61 ' O ' ' O ' ' A' ' 74' ' ' GLU . 10.4 p 58.96 148.85 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.364 -179.349 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . 0.61 ' O ' ' O ' ' A' ' 73' ' ' SER . 22.1 mp0 39.81 105.41 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.342 -179.118 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . 0.496 ' C ' ' O ' ' A' ' 74' ' ' GLU . 33.6 m120 -31.01 140.5 0.15 Allowed Pre-proline 0 C--N 1.328 -0.341 0 CA-C-N 116.506 -0.315 . . . . 0.0 110.91 -179.68 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -71.08 4.4 2.79 Favored 'Trans proline' 0 C--N 1.301 -1.925 0 C-N-CA 122.794 2.329 . . . . 0.0 112.353 -178.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 52.5 t80 -63.74 -51.63 64.06 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.774 -179.261 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 76.6 mt -70.08 -48.08 64.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.9 -179.158 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.452 ' CD1' ' N ' ' A' ' 79' ' ' LEU . 10.0 mp -52.23 -51.42 58.4 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.499 -179.073 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.416 ' O ' ' NH1' ' A' ' 84' ' ' ARG . 96.1 mt-10 -65.52 -31.83 73.11 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.438 -179.982 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -65.25 -38.14 89.4 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.634 -179.684 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -54.58 -24.93 23.23 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.425 -179.618 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 44.2 t -72.5 -43.85 62.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.978 -179.446 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . 0.416 ' NH1' ' O ' ' A' ' 80' ' ' GLU . 12.0 mpt_? -61.8 -29.21 70.0 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.6 -179.101 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -64.08 -44.93 90.86 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.917 -178.725 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 54.9 p -71.18 -20.18 62.31 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.769 -179.216 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 26.0 m -64.33 -53.89 41.6 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.218 -178.642 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 41.3 t -69.27 -46.5 77.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.094 -178.311 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -57.35 -37.44 72.59 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.744 -178.094 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 17.3 mm-40 -55.22 -42.24 73.1 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.701 -179.391 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 14.6 mptt -64.75 -23.37 67.23 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.639 -178.406 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 53.8 t80 -74.1 -59.57 2.66 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.316 -177.924 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 4.5 m -49.92 -38.3 13.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.674 -177.64 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.405 HD11 HG22 ' A' ' 94' ' ' ILE . 81.1 mt -58.91 -39.42 77.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.136 179.475 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -51.55 -40.77 60.33 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.569 -179.521 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . 0.472 ' CD1' ' N ' ' A' ' 96' ' ' ILE . 1.7 mp -61.99 -41.64 91.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.597 -179.809 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 75.6 mt-10 -60.54 -49.43 77.59 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.962 -178.718 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 39.7 tp10 -68.3 -42.51 79.35 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.852 -178.878 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 91.1 mt-10 -69.48 -32.27 71.05 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.762 -178.911 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -57.38 -30.95 65.31 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.566 -179.588 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 21.1 m -63.65 -52.84 59.01 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.738 -179.253 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -66.76 -28.75 68.65 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.351 179.754 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . 1.195 ' O ' ' O ' ' A' ' 104' ' ' LYS . 0.1 OUTLIER -71.69 -30.8 66.07 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.836 179.994 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 1.195 ' O ' ' O ' ' A' ' 103' ' ' LEU . 22.2 pttp -5.58 -148.85 0.0 OUTLIER 'General case' 0 C--O 1.235 0.296 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.854 -179.258 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 70.2 mm-40 -71.77 82.35 0.88 Allowed 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 120.904 0.383 . . . . 0.0 110.682 -179.614 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 1.4 t -164.27 8.97 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.407 178.239 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . 0.597 ' O ' ' OG ' ' A' ' 108' ' ' SER . . . -120.62 -56.02 0.24 Allowed Glycine 0 CA--C 1.522 0.511 0 N-CA-C 110.853 -0.899 . . . . 0.0 110.853 179.754 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' SER . . . . . 0.597 ' OG ' ' O ' ' A' ' 107' ' ' GLY . 3.4 m 156.32 -103.9 0.0 OUTLIER 'General case' 0 N--CA 1.454 -0.263 0 CA-C-O 120.875 0.369 . . . . 0.0 110.442 -179.959 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' SER . . . . . 0.599 ' HG ' ' H ' ' A' ' 110' ' ' GLY . 18.9 p -172.19 -56.4 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.386 -179.339 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . 0.599 ' H ' ' HG ' ' A' ' 109' ' ' SER . . . -75.52 -28.67 61.05 Favored Glycine 0 CA--C 1.525 0.682 0 N-CA-C 111.008 -0.837 . . . . 0.0 111.008 178.896 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . 0.459 ' N ' ' OE1' ' A' ' 111' ' ' GLU . 13.1 mp0 -56.78 -27.53 59.84 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.76 0.314 . . . . 0.0 110.536 -179.354 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 30.6 m-85 -53.28 -26.03 16.9 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.456 179.618 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 66.5 m -50.9 -34.48 28.54 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.538 179.934 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -57.41 -31.52 65.93 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.394 179.175 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 45.7 ttm -77.99 -40.45 39.1 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.936 179.448 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 30.4 t80 -64.06 -31.69 72.97 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.431 179.606 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 94.2 m-20 -59.92 -35.75 75.56 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.606 -179.409 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 81.5 mt -56.62 -38.61 72.33 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.326 179.743 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' MET . . . . . 0.478 ' C ' ' SD ' ' A' ' 119' ' ' MET . 0.0 OUTLIER -56.4 -50.13 72.48 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.476 179.612 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 68.6 t80 -63.84 -44.3 93.58 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.959 0.409 . . . . 0.0 110.693 -179.735 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . 0.405 ' O ' ' CD ' ' A' ' 125' ' ' PRO . 78.0 tt0 -53.98 -40.11 66.63 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.566 -179.706 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 95.1 t -83.42 -18.97 10.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.746 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 51.4 p -71.31 -30.29 66.06 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.809 -178.874 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . 0.499 ' CB ' ' HD3' ' A' ' 125' ' ' PRO . 5.6 mmtp -69.58 -55.2 9.63 Favored Pre-proline 0 C--N 1.33 -0.241 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.279 -177.509 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . 0.499 ' HD3' ' CB ' ' A' ' 124' ' ' LYS . 68.3 Cg_exo -50.66 -44.45 40.44 Favored 'Trans proline' 0 C--N 1.306 -1.707 0 C-N-CA 122.61 2.207 . . . . 0.0 111.887 179.06 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 75.4 mt -64.01 -21.2 66.4 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.575 -179.479 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 6.4 tm0? -62.91 -49.47 74.67 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.863 -179.627 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 70.7 mmtt -62.11 -6.75 3.23 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.443 -179.718 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 1.1 tt -108.2 -50.71 3.0 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.562 179.792 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . 0.593 ' O ' ' C ' ' A' ' 131' ' ' ILE . . . 170.83 -120.97 0.88 Allowed Glycine 0 CA--C 1.52 0.36 0 N-CA-C 110.935 -0.866 . . . . 0.0 110.935 -179.688 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 131' ' ' ILE . . . . . 0.593 ' C ' ' O ' ' A' ' 130' ' ' GLY . 81.1 mt 21.83 94.23 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 120.65 0.262 . . . . 0.0 110.712 179.976 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . 0.485 ' O ' ' HG2' ' A' ' 133' ' ' GLU . 47.0 tt0 -117.59 158.66 24.23 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.542 -179.642 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 133' ' ' GLU . . . . . 0.485 ' HG2' ' O ' ' A' ' 132' ' ' GLN . 0.6 OUTLIER 79.57 -12.17 1.1 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.539 179.173 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 26.4 ttm -58.5 -22.41 55.05 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.508 -179.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 34.9 m -67.79 -65.85 0.64 Allowed 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.689 179.559 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 136' ' ' LYS . . . . . 0.477 ' O ' ' N ' ' A' ' 140' ' ' ASP . 19.4 ttmm -51.4 -33.57 30.79 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.676 -0.491 . . . . 0.0 109.676 179.135 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 99.8 m -54.19 -66.05 0.46 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.654 -179.448 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 7.2 p -62.39 -33.38 58.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.624 -179.127 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 1.2 p -71.31 -31.93 68.02 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.613 -179.881 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 140' ' ' ASP . . . . . 0.477 ' N ' ' O ' ' A' ' 136' ' ' LYS . 49.9 t0 -68.89 -27.6 65.93 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.497 -179.816 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -69.36 -25.97 64.44 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.953 -178.84 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -64.6 -29.12 70.13 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.815 -178.513 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 80.9 mm-40 -67.19 -37.62 83.97 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.678 -179.455 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -65.56 -33.24 75.46 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.599 -179.728 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 145' ' ' ASN . . . . . . . . . . . . . 48.4 t30 -159.75 83.92 2.24 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.529 -179.358 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 146' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_exo -47.13 106.36 0.1 Allowed 'Trans proline' 0 C--N 1.305 -1.739 0 C-N-CA 122.875 2.384 . . . . 0.0 112.098 179.898 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 147' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_exo -48.72 110.57 0.36 Allowed 'Trans proline' 0 C--N 1.304 -1.815 0 C-N-CA 122.774 2.316 . . . . 0.0 112.252 -179.534 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 10.0 t -124.17 1.51 8.51 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.377 179.314 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 149' ' ' THR . . . . . 0.475 ' HG1' ' H ' ' A' ' 150' ' ' ALA . 5.1 t -162.12 -178.99 6.74 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.636 -179.843 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 150' ' ' ALA . . . . . 0.475 ' H ' ' HG1' ' A' ' 149' ' ' THR . . . -62.79 -34.27 76.93 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.583 -179.59 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 12.6 tt0 -66.21 -45.14 81.79 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.741 -179.707 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . -61.43 -44.75 97.63 Favored Glycine 0 CA--C 1.524 0.655 0 N-CA-C 110.869 -0.892 . . . . 0.0 110.869 -179.884 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 153' ' ' VAL . . . . . . . . . . . . . 99.4 t -65.77 -42.78 93.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-O 120.836 0.35 . . . . 0.0 110.468 -179.86 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 7.8 mt -51.46 -31.96 25.19 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.36 179.68 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 34.4 tp10 -64.68 -47.3 78.9 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.327 179.056 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 156' ' ' ILE . . . . . 0.433 ' CD1' ' N ' ' A' ' 156' ' ' ILE . 1.7 mp -64.12 -43.53 97.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.479 179.472 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -49.46 -46.89 48.51 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.358 -179.407 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 63.9 tttp -61.91 -41.91 98.46 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.092 178.89 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -65.42 -31.1 72.02 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.394 179.713 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 160' ' ' MET . . . . . . . . . . . . . 1.6 mtm -67.89 -51.49 47.39 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.869 179.689 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 76.1 ttt180 -67.77 -35.36 78.55 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.455 -179.939 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 81.1 tt0 -62.61 -48.7 78.24 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.89 -178.853 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 163' ' ' LYS . . . . . . . . . . . . . 41.1 tptt -65.42 -33.91 77.06 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.548 -179.43 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 14.2 mt -67.17 -30.45 70.42 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.915 -178.884 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 165' ' ' GLN . . . . . 0.421 ' O ' ' OG1' ' A' ' 169' ' ' THR . 90.1 mt-30 -66.11 -35.17 79.8 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.741 -179.146 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 92.3 mtt-85 -64.73 -34.08 77.49 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.451 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 167' ' ' VAL . . . . . . . . . . . . . 11.1 t -68.39 -43.31 84.25 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.426 0 CA-C-O 120.893 0.378 . . . . 0.0 110.762 179.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 168' ' ' HIS . . . . . 0.402 ' ND1' ' O ' ' A' ' 168' ' ' HIS . 24.9 t-80 -80.01 -33.48 39.21 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.767 -179.546 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 169' ' ' THR . . . . . 0.421 ' OG1' ' O ' ' A' ' 165' ' ' GLN . 91.5 m -70.15 -45.29 67.08 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.991 -178.542 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 58.9 mmtt -60.13 -44.27 95.03 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.612 -179.278 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 171' ' ' ASN . . . . . . . . . . . . . 48.6 t-20 -68.76 -33.05 73.25 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.992 0.425 . . . . 0.0 110.597 -179.703 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 172' ' ' TYR . . . . . 0.569 ' HH ' ' HZ1' ' A' ' 176' ' ' LYS . 53.7 t80 -62.93 -47.39 83.45 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.639 -179.442 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 68.7 m -73.75 -37.63 64.98 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.708 -179.332 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 89.5 m -62.03 -48.37 80.56 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.588 -179.315 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 12.3 tp -66.42 -34.32 77.67 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.548 -179.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 176' ' ' LYS . . . . . 0.569 ' HZ1' ' HH ' ' A' ' 172' ' ' TYR . 23.5 mmtp -78.01 -8.0 57.61 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.972 -179.266 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 177' ' ' LYS . . . . . 0.781 ' HZ1' ' HG ' ' A' ' 70' ' ' SER . 13.7 ptmt -62.5 -22.8 66.55 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.411 -179.696 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 178' ' ' LYS . . . . . . . . . . . . . 31.7 ttmt -70.85 -51.61 25.49 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.836 -179.328 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 94.8 mt-10 -70.71 -41.66 71.63 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.364 179.768 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 180' ' ' ASN . . . . . . . . . . . . . 97.9 m-20 -71.22 -42.18 69.24 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.748 179.554 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 181' ' ' SER . . . . . 0.468 ' O ' ' OG1' ' A' ' 182' ' ' THR . 67.2 p 44.91 -152.19 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.578 -179.9 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 182' ' ' THR . . . . . 0.468 ' OG1' ' O ' ' A' ' 181' ' ' SER . 73.2 p 52.11 176.52 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.664 179.425 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 183' ' ' PHE . . . . . 0.448 ' C ' ' HG1' ' A' ' 184' ' ' THR . 32.2 p90 -120.51 153.99 35.91 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.577 -179.712 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 184' ' ' THR . . . . . 0.448 ' HG1' ' C ' ' A' ' 183' ' ' PHE . 43.9 p 43.31 34.04 0.67 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.739 -179.998 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 185' ' ' ASP . . . . . . . . . . . . . 74.5 m-20 -142.8 21.4 1.97 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.623 -179.779 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 186' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -57.92 139.46 54.24 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.409 179.879 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 187' ' ' LYS . . . . . 0.439 ' C ' ' H ' ' A' ' 189' ' ' LYS . 88.0 tttt -64.93 -47.1 78.92 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.618 -179.755 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 188' ' ' CYS . . . . . . . . . . . . . 20.6 p -77.48 39.94 0.28 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.53 -179.7 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 189' ' ' LYS . . . . . 0.439 ' H ' ' C ' ' A' ' 187' ' ' LYS . 37.3 ttmt -60.39 -41.09 93.1 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.369 179.951 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 190' ' ' ASN . . . . . . . . . . . . . 15.0 m120 -69.97 140.06 52.93 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.423 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 191' ' ' ASN . . . . . 0.449 ' N ' ' OD1' ' A' ' 191' ' ' ASN . 13.3 p-10 . . . . . 0 C--O 1.22 -0.491 0 CA-C-O 118.0 -1.0 . . . . 0.0 110.624 -179.859 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 51.2 p . . . . . 0 N--CA 1.491 1.59 0 N-CA-C 109.349 -0.611 . . . . 0.0 109.349 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -161.12 67.89 0.31 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.531 179.941 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . 0.468 ' O ' ' N ' ' A' ' 28' ' ' THR . . . -168.79 -99.5 0.13 Allowed Glycine 0 CA--C 1.517 0.168 0 N-CA-C 110.862 -0.895 . . . . 0.0 110.862 179.983 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.631 ' O ' ' O ' ' A' ' 28' ' ' THR . 9.3 mt 35.41 31.77 0.01 OUTLIER 'General case' 0 C--O 1.22 -0.493 0 CA-C-N 116.358 0.079 . . . . 0.0 111.175 -179.526 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' THR . . . . . 0.631 ' O ' ' O ' ' A' ' 27' ' ' LEU . 21.7 p -45.95 -119.93 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.415 0 O-C-N 123.995 0.809 . . . . 0.0 110.781 -179.094 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . 0.511 ' C ' ' H ' ' A' ' 31' ' ' THR . . . -65.85 166.73 35.53 Favored Glycine 0 CA--C 1.523 0.56 0 N-CA-C 111.046 -0.822 . . . . 0.0 111.046 179.774 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -57.49 -4.69 0.27 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.802 0.334 . . . . 0.0 110.492 179.626 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.511 ' H ' ' C ' ' A' ' 29' ' ' GLY . 98.0 m -61.53 -23.53 66.0 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.465 179.725 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 17.2 tptp -68.45 -47.21 67.75 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.245 0.545 . . . . 0.0 110.817 179.606 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . 0.453 ' CD1' ' N ' ' A' ' 33' ' ' ILE . 1.7 mp -57.17 -45.49 84.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 N-CA-C 109.152 -0.684 . . . . 0.0 109.152 -179.33 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 44.8 ttm180 -69.79 -27.79 65.2 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.047 0.451 . . . . 0.0 109.968 -179.703 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 44.5 tp -68.44 -47.9 65.97 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.066 -179.605 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 22.1 pt-20 -76.83 -39.8 50.04 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.612 -179.731 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 79.5 ttt180 -62.94 -42.71 99.89 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.028 -0.533 . . . . 0.0 109.997 -179.15 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 78.0 p -63.84 -26.45 68.62 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.097 0.475 . . . . 0.0 110.256 -179.755 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -83.16 -32.22 26.73 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.067 0.461 . . . . 0.0 111.105 179.366 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -63.81 -35.18 79.77 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.015 -0.538 . . . . 0.0 111.0 -179.003 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . 0.496 ' OD1' ' N ' ' A' ' 42' ' ' ILE . 15.2 p30 -61.92 -23.62 66.46 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.669 -179.261 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.496 ' N ' ' OD1' ' A' ' 41' ' ' ASP . 75.3 mt -59.84 -49.74 82.73 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.633 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.676 -179.097 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 40.3 p -72.6 -36.73 68.17 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.047 0.451 . . . . 0.0 111.305 -178.76 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 66.4 t0 -63.0 -39.94 96.26 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.96 -178.232 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 68.2 mm-40 -71.16 -55.92 7.16 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 112.233 0.456 . . . . 0.0 112.233 -179.285 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 7.0 pt -62.0 -26.33 39.73 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.107 -178.788 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -65.47 -39.09 91.57 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.91 -0.587 . . . . 0.0 110.687 -179.836 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.16 -24.33 67.12 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-O 121.059 0.457 . . . . 0.0 110.687 -178.89 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 65.2 mt -65.94 -52.82 44.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.007 -0.542 . . . . 0.0 112.365 -178.249 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 38.5 pttt -59.33 -30.19 68.18 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.857 -178.554 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 49.6 mtpt -63.89 -43.98 94.38 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.33 -179.678 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -65.42 -43.47 90.44 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.559 -179.895 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -58.34 -30.45 66.74 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.754 -179.578 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -66.47 -35.61 80.69 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.006 -179.858 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 53.7 mt -61.99 -46.66 88.26 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.31 -178.945 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.503 ' O ' ' N ' ' A' ' 58' ' ' VAL . 55.4 pttt -177.13 -17.93 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.377 0 O-C-N 123.483 0.489 . . . . 0.0 110.811 179.999 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . 0.407 ' O ' ' O ' ' A' ' 58' ' ' VAL . . . -64.26 65.31 0.06 OUTLIER Glycine 0 CA--C 1.526 0.724 0 N-CA-C 110.921 -0.872 . . . . 0.0 110.921 -179.378 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.503 ' N ' ' O ' ' A' ' 56' ' ' LYS . 15.0 t 57.4 155.72 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 120.925 0.393 . . . . 0.0 110.844 179.812 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 83.5 m-20 -71.17 143.89 50.37 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.042 0.448 . . . . 0.0 110.316 179.565 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . 0.408 ' CD2' ' N ' ' A' ' 61' ' ' ASP . 20.5 t80 -85.35 -179.45 6.96 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.419 -179.425 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . 0.408 ' N ' ' CD2' ' A' ' 60' ' ' PHE . 66.4 t0 61.36 -118.0 0.7 Allowed 'General case' 0 C--N 1.33 -0.254 0 O-C-N 123.708 0.63 . . . . 0.0 110.246 179.805 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . 61.2 -121.51 0.82 Allowed 'General case' 0 N--CA 1.452 -0.355 0 CA-C-O 120.77 0.319 . . . . 0.0 110.922 179.866 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 1.7 m-85 58.15 91.18 0.04 OUTLIER 'General case' 0 CA--C 1.516 -0.358 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.159 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.469 ' CG ' ' H ' ' A' ' 65' ' ' ASP . 10.8 tptm -113.03 -149.01 0.44 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.933 0.397 . . . . 0.0 110.787 179.365 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.469 ' H ' ' CG ' ' A' ' 64' ' ' LYS . 75.3 m-20 -74.55 -39.36 62.34 Favored 'General case' 0 N--CA 1.456 -0.142 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.454 179.977 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 6.3 mptt -62.87 -45.65 91.55 Favored 'General case' 0 CA--C 1.514 -0.437 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.928 -179.432 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -77.0 116.68 17.88 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.401 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 1.5 t -174.61 2.35 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.547 179.859 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -69.45 -20.12 75.12 Favored Glycine 0 CA--C 1.524 0.646 0 N-CA-C 110.919 -0.873 . . . . 0.0 110.919 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 5.6 t 62.23 141.0 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.656 0.265 . . . . 0.0 110.534 -179.759 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . 0.564 ' H ' ' ND2' ' A' ' 171' ' ' ASN . . . 73.2 -77.23 0.86 Allowed Glycine 0 N--CA 1.46 0.245 0 N-CA-C 110.351 -1.1 . . . . 0.0 110.351 179.809 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 1.9 m -122.62 105.02 15.42 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.473 0 CA-C-O 121.278 0.561 . . . . 0.0 110.144 179.723 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 2.5 t -155.06 95.78 1.77 Allowed 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.465 178.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 69.96 -67.78 0.22 Allowed 'General case' 0 CA--C 1.513 -0.47 0 O-C-N 123.426 0.454 . . . . 0.0 110.896 179.085 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 17.1 m120 -115.58 94.01 38.78 Favored Pre-proline 0 CA--C 1.532 0.284 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.265 -179.57 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -73.52 -8.23 21.38 Favored 'Trans proline' 0 N--CA 1.489 1.236 0 C-N-CA 122.79 2.327 . . . . 0.0 112.003 -179.343 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 53.4 t80 -76.96 -50.94 12.06 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.04 0.448 . . . . 0.0 110.275 -179.92 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 16.8 tt -75.48 -27.58 19.26 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.144 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.307 -179.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 3.1 mp -74.0 -37.96 64.25 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.6 179.776 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 10.5 mm-40 -63.14 -25.19 68.24 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.377 -179.858 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -65.98 -45.21 82.47 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.747 -179.35 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 6.5 ttpm? -55.97 -25.75 45.22 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.627 -179.735 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 26.9 t -74.49 -46.17 43.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.724 179.685 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 91.2 mtm180 -67.25 -28.03 67.71 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.167 0.508 . . . . 0.0 110.377 -179.705 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -58.41 -41.37 84.78 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.012 -179.204 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 68.7 p -76.86 -24.1 52.65 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.716 -179.906 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 86.2 m -60.23 -51.92 67.51 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.805 -178.947 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 56.1 t -67.92 -43.34 85.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.693 -179.396 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -64.13 -31.8 73.13 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.854 -179.065 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -55.43 -41.81 73.31 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.004 -179.579 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -58.09 -34.04 69.75 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.595 -179.325 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 46.0 t80 -71.29 -45.48 63.0 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.902 -179.91 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 57.3 t -53.18 -56.87 6.14 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.793 -177.627 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 23.3 pt -54.14 -30.71 20.68 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.661 -179.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -52.56 -41.89 63.97 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.351 -179.641 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . 0.469 ' CD1' ' N ' ' A' ' 96' ' ' ILE . 1.6 mp -63.87 -41.81 93.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 116.073 -0.512 . . . . 0.0 109.945 179.255 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 79.4 tt0 -61.18 -49.89 75.38 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.073 -178.452 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 80.9 mm-40 -68.04 -41.41 82.13 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.42 -179.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 48.5 tp10 -62.1 -43.07 99.64 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.284 -179.88 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -62.36 -35.66 79.84 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.877 0.37 . . . . 0.0 110.572 -179.545 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 99.3 m -59.3 -43.4 92.62 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.164 -179.698 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 60.1 mttp -55.69 -36.43 67.13 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.237 -0.438 . . . . 0.0 109.849 -179.459 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . 0.483 ' CD2' ' N ' ' A' ' 103' ' ' LEU . 4.2 mm? -81.29 -92.39 0.06 Allowed 'General case' 0 CA--C 1.511 -0.556 0 N-CA-C 109.916 -0.402 . . . . 0.0 109.916 179.112 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.419 ' CB ' ' O ' ' A' ' 103' ' ' LEU . 26.6 ttmt 78.92 -38.58 0.21 Allowed 'General case' 0 C--N 1.334 -0.075 0 O-C-N 123.759 0.662 . . . . 0.0 110.784 179.906 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . 0.434 ' O ' ' C ' ' A' ' 106' ' ' THR . 97.5 mt-10 -64.0 150.96 44.12 Favored 'General case' 0 CA--C 1.514 -0.415 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 -179.982 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' THR . . . . . 0.434 ' C ' ' O ' ' A' ' 105' ' ' GLU . 26.1 p -32.81 -42.26 0.08 Allowed 'General case' 0 N--CA 1.471 0.605 0 O-C-N 123.346 0.404 . . . . 0.0 110.763 -179.789 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 70.06 -179.28 28.23 Favored Glycine 0 CA--C 1.521 0.421 0 N-CA-C 110.733 -0.947 . . . . 0.0 110.733 179.101 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 52.3 m -80.32 -1.82 42.66 Favored 'General case' 0 C--N 1.331 -0.229 0 O-C-N 122.832 -0.217 . . . . 0.0 110.479 179.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER 70.88 -49.5 0.67 Allowed 'General case' 0 N--CA 1.462 0.166 0 CA-C-O 120.924 0.392 . . . . 0.0 110.449 -179.714 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . 0.401 ' O ' ' OG ' ' A' ' 113' ' ' SER . . . -66.97 -28.03 73.64 Favored Glycine 0 CA--C 1.523 0.559 0 N-CA-C 110.686 -0.966 . . . . 0.0 110.686 -179.9 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 82.0 tt0 -61.23 -43.29 99.12 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.794 0.33 . . . . 0.0 110.544 -179.312 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 70.2 m-85 -65.43 -40.15 92.98 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.608 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.401 ' OG ' ' O ' ' A' ' 110' ' ' GLY . 59.8 p -57.12 -31.91 65.8 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.33 -179.509 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -63.9 -29.58 70.75 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.445 179.592 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 37.3 mtp -74.95 -51.93 12.48 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.485 -179.221 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 41.6 t80 -50.15 -35.88 27.85 Favored 'General case' 0 N--CA 1.463 0.194 0 N-CA-C 110.042 -0.355 . . . . 0.0 110.042 -179.427 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 97.2 m-20 -61.8 -41.89 98.32 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.184 -0.462 . . . . 0.0 109.841 179.352 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 1.4 tt -59.66 -40.56 88.16 Favored 'General case' 0 C--O 1.222 -0.343 0 CA-C-O 121.369 0.604 . . . . 0.0 109.685 -179.761 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' MET . . . . . 0.444 ' C ' ' SD ' ' A' ' 119' ' ' MET . 0.1 OUTLIER -53.15 -45.96 68.63 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.187 0.518 . . . . 0.0 109.858 -179.456 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 50.5 t80 -63.43 -41.21 98.69 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.176 0.512 . . . . 0.0 110.652 -179.013 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 14.5 mm-40 -55.48 -48.48 74.48 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.289 -178.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 31.1 m -71.27 -16.93 19.58 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.524 0 O-C-N 123.429 0.456 . . . . 0.0 110.819 -179.491 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 9.4 m -72.34 -24.98 61.37 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-O 121.191 0.519 . . . . 0.0 110.748 179.593 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . 0.521 ' N ' ' HD2' ' A' ' 125' ' ' PRO . 2.5 mptp? -65.05 -57.8 14.56 Favored Pre-proline 0 C--N 1.323 -0.578 0 CA-C-N 116.194 -0.457 . . . . 0.0 112.113 -179.376 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . 0.521 ' HD2' ' N ' ' A' ' 124' ' ' LYS . 30.2 Cg_endo -60.32 -30.63 91.48 Favored 'Trans proline' 0 C--N 1.307 -1.644 0 C-N-CA 122.441 2.094 . . . . 0.0 112.453 -179.01 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 92.6 mt -70.69 -24.82 62.74 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.71 179.854 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 55.2 tt0 -65.21 -39.43 92.77 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.148 -179.99 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 17.0 tptm -50.27 -44.37 53.7 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 120.576 -0.449 . . . . 0.0 110.546 -178.249 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 18.5 mt -57.52 -110.37 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.824 178.727 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . 0.42 ' C ' ' NE2' ' A' ' 132' ' ' GLN . . . -147.85 17.25 1.41 Allowed Glycine 0 C--N 1.332 0.356 0 N-CA-C 110.876 -0.889 . . . . 0.0 110.876 -179.489 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 76.3 mt -111.71 115.22 49.26 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.393 0 CA-C-O 120.904 0.383 . . . . 0.0 110.247 179.816 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . 0.497 ' C ' ' H ' ' A' ' 134' ' ' MET . 8.1 mp0 -139.93 -178.71 5.56 Favored 'General case' 0 CA--C 1.508 -0.645 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.077 -179.701 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 133' ' ' GLU . . . . . 0.47 ' HB2' ' O ' ' A' ' 132' ' ' GLN . 75.0 mt-10 75.48 -21.91 0.29 Allowed 'General case' 0 CA--C 1.52 -0.195 0 O-C-N 123.895 0.747 . . . . 0.0 110.622 179.497 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 134' ' ' MET . . . . . 0.497 ' H ' ' C ' ' A' ' 132' ' ' GLN . 48.5 mtp -51.27 -23.25 3.34 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.165 179.662 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 34.7 p -63.0 -63.82 1.09 Allowed 'General case' 0 C--O 1.221 -0.411 0 CA-C-O 121.486 0.66 . . . . 0.0 109.251 179.625 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 136' ' ' LYS . . . . . 0.483 ' O ' ' N ' ' A' ' 140' ' ' ASP . 59.0 mmtt -51.38 -38.3 52.63 Favored 'General case' 0 C--N 1.318 -0.791 0 O-C-N 121.661 -0.649 . . . . 0.0 109.827 179.549 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 46.1 m -54.84 -66.01 0.48 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.548 -179.547 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 14.8 p -63.33 -34.65 68.4 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.146 -178.902 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 5.8 p -73.22 -33.55 65.41 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.758 -178.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 140' ' ' ASP . . . . . 0.483 ' N ' ' O ' ' A' ' 136' ' ' LYS . 8.9 t70 -65.1 -30.73 71.7 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.427 -179.614 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -62.91 -27.22 69.22 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.778 -179.176 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -59.85 -28.91 67.91 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.67 -179.169 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 70.0 mm-40 -81.53 66.16 6.97 Favored 'General case' 0 CA--C 1.517 -0.291 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.543 -179.777 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER 175.78 -37.93 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.783 -179.981 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 145' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -143.62 73.83 17.04 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.138 -179.318 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 146' ' ' PRO . . . . . 0.656 ' C ' ' H ' ' A' ' 148' ' ' THR . 86.8 Cg_exo -38.7 106.47 0.05 OUTLIER 'Trans proline' 0 C--N 1.32 -0.956 0 C-N-CA 122.945 2.43 . . . . 0.0 111.8 179.89 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 147' ' ' PRO . . . . . 0.583 ' C ' ' H ' ' A' ' 149' ' ' THR . 49.6 Cg_exo -55.17 10.27 0.03 OUTLIER 'Trans proline' 0 C--N 1.309 -1.551 0 C-N-CA 122.665 2.243 . . . . 0.0 112.4 179.224 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 148' ' ' THR . . . . . 0.656 ' H ' ' C ' ' A' ' 146' ' ' PRO . 61.8 m -55.38 -2.65 0.05 OUTLIER 'General case' 0 N--CA 1.445 -0.713 0 CA-C-O 120.744 0.307 . . . . 0.0 110.714 179.303 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 149' ' ' THR . . . . . 0.583 ' H ' ' C ' ' A' ' 147' ' ' PRO . 62.5 p -124.28 162.55 23.51 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-O 121.012 0.434 . . . . 0.0 110.223 179.458 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -68.05 -47.53 68.11 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.716 -179.814 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 87.1 mt-30 -66.14 -30.27 70.73 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.621 -179.812 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . -59.98 -34.29 82.67 Favored Glycine 0 CA--C 1.523 0.553 0 N-CA-C 111.085 -0.806 . . . . 0.0 111.085 -179.287 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 153' ' ' VAL . . . . . . . . . . . . . 62.4 t -65.61 -41.68 91.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 120.783 0.325 . . . . 0.0 110.688 -179.798 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 78.9 mt -45.31 -37.58 4.94 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.598 -179.108 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -62.3 -58.82 6.31 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.136 178.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 156' ' ' ILE . . . . . 0.438 HG22 HD11 ' A' ' 156' ' ' ILE . 24.0 mm -53.68 -42.63 51.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.735 -179.439 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -56.71 -47.58 79.63 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 123.562 0.539 . . . . 0.0 110.548 178.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 34.8 tptt -61.66 -36.61 81.32 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.376 -179.797 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -72.32 -30.19 64.53 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.476 -179.658 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 160' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -66.11 -50.95 62.25 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.266 179.742 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 61.6 ttp180 -65.0 -31.24 72.38 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.099 179.522 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 40.9 tp10 -64.34 -61.31 2.31 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.124 -178.77 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 163' ' ' LYS . . . . . . . . . . . . . 23.9 tptp -60.36 -34.36 73.75 Favored 'General case' 0 N--CA 1.447 -0.605 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.533 -179.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 38.3 tp -66.21 -37.84 86.52 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.249 -179.881 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 65.9 mm-40 -70.14 -28.37 65.31 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.909 -179.64 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 166' ' ' ARG . . . . . 0.629 ' HE ' ' HZ2' ' A' ' 170' ' ' LYS . 76.0 ttt180 -63.76 -34.13 77.21 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.399 -179.91 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 167' ' ' VAL . . . . . . . . . . . . . 70.1 t -67.04 -43.69 88.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.321 -179.667 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 12.6 t60 -78.59 -31.57 47.24 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.816 -179.277 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 169' ' ' THR . . . . . . . . . . . . . 92.6 m -68.5 -47.03 68.07 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.849 -179.49 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 170' ' ' LYS . . . . . 0.629 ' HZ2' ' HE ' ' A' ' 166' ' ' ARG . 28.1 mmtp -60.74 -45.39 94.48 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.694 -179.539 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 171' ' ' ASN . . . . . 0.564 ' ND2' ' H ' ' A' ' 71' ' ' GLY . 6.8 m120 -66.61 -36.82 83.53 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.51 179.58 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 172' ' ' TYR . . . . . . . . . . . . . 84.4 t80 -66.53 -41.6 88.51 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.67 -179.434 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 41.0 t -67.75 -39.64 84.2 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.685 -179.444 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 31.4 p -66.01 -34.94 79.23 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.794 -179.62 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 175' ' ' LEU . . . . . 0.422 ' C ' ' H ' ' A' ' 177' ' ' LYS . 6.3 mt -64.17 -38.45 91.11 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.032 179.497 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 66.3 mmtt -62.4 -5.76 2.74 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.527 179.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 177' ' ' LYS . . . . . 0.422 ' H ' ' C ' ' A' ' 175' ' ' LEU . 62.9 tttp -63.76 -42.16 97.86 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.823 179.548 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 178' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -66.2 -42.36 88.91 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.649 -179.827 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 67.9 mm-40 -56.83 -47.85 79.35 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.0 -178.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 180' ' ' ASN . . . . . 0.552 ' O ' ' N ' ' A' ' 182' ' ' THR . 14.8 m120 -47.64 -62.85 1.25 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.175 179.367 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 44.8 t 49.99 -82.74 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.105 179.037 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 182' ' ' THR . . . . . 0.552 ' N ' ' O ' ' A' ' 180' ' ' ASN . 80.5 p -48.01 -58.76 4.02 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.151 -179.817 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 183' ' ' PHE . . . . . . . . . . . . . 87.9 t80 -174.2 -81.62 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.967 0.413 . . . . 0.0 110.491 179.794 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 184' ' ' THR . . . . . 0.415 HG21 ' H ' ' A' ' 185' ' ' ASP . 0.2 OUTLIER 53.16 -173.69 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.767 -179.595 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 185' ' ' ASP . . . . . 0.415 ' H ' HG21 ' A' ' 184' ' ' THR . 67.5 t0 -84.73 111.92 20.02 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.645 179.659 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 186' ' ' GLU . . . . . . . . . . . . . 94.2 mt-10 -65.69 -45.59 82.24 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.533 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -70.42 132.09 45.08 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.373 -179.8 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 188' ' ' CYS . . . . . . . . . . . . . 5.0 m -79.58 -25.08 41.64 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.351 -179.939 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 189' ' ' LYS . . . . . 0.467 ' O ' ' N ' ' A' ' 191' ' ' ASN . 99.0 mttt 55.92 65.52 1.43 Allowed 'General case' 0 C--N 1.327 -0.38 0 O-C-N 123.457 0.473 . . . . 0.0 110.494 -179.719 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 190' ' ' ASN . . . . . . . . . . . . . 24.2 t-20 -44.77 92.54 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.749 -179.956 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 191' ' ' ASN . . . . . 0.467 ' N ' ' O ' ' A' ' 189' ' ' LYS . 89.3 m-20 . . . . . 0 C--O 1.219 -0.54 0 CA-C-O 118.053 -0.975 . . . . 0.0 110.695 -179.471 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 33.1 t . . . . . 0 N--CA 1.49 1.531 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -171.32 -58.38 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.446 -179.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -48.12 -79.63 0.07 OUTLIER Glycine 0 CA--C 1.527 0.812 0 N-CA-C 111.241 -0.744 . . . . 0.0 111.241 -179.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.471 ' CD1' ' N ' ' A' ' 27' ' ' LEU . 8.2 mp 47.86 -162.25 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.272 0 CA-C-O 120.72 0.295 . . . . 0.0 110.259 179.444 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' THR . . . . . 0.486 ' CG2' ' H ' ' A' ' 32' ' ' LYS . 6.8 t -169.53 -129.47 0.01 OUTLIER 'General case' 0 N--CA 1.445 -0.679 0 CA-C-N 116.287 -0.415 . . . . 0.0 109.976 -179.775 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . 0.437 ' N ' ' OG1' ' A' ' 28' ' ' THR . . . -108.92 -39.5 1.7 Allowed Glycine 0 N--CA 1.467 0.715 0 N-CA-C 111.08 -0.808 . . . . 0.0 111.08 179.71 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -169.23 -13.24 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.892 0.377 . . . . 0.0 110.648 -179.732 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 24.8 m -64.14 -31.18 72.27 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.1 179.568 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.486 ' H ' ' CG2' ' A' ' 28' ' ' THR . 55.7 tptt -63.36 -50.19 70.91 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 120.315 -0.554 . . . . 0.0 110.646 -179.478 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 71.4 mt -63.16 -27.95 44.12 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.003 -178.921 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 41.4 ttm180 -71.41 -39.46 71.11 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.889 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 64.9 mt -68.93 -37.71 79.07 Favored 'General case' 0 CA--C 1.514 -0.415 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.73 -179.583 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 47.0 tp10 -73.21 -43.37 61.41 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.496 -179.741 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 43.7 ttm180 -63.4 -43.75 96.64 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.588 -179.324 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 37.9 m -69.0 -29.68 67.92 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.273 -179.961 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -75.05 -36.27 61.84 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.902 179.855 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -65.42 -31.42 72.51 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.832 -179.556 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 10.9 m-20 -66.93 -24.67 66.11 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.967 -179.635 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 98.3 mt -64.37 -48.42 85.37 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.311 0 C-N-CA 120.678 -0.409 . . . . 0.0 111.088 -179.19 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 77.2 p -73.23 -38.66 65.97 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.102 -178.712 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 65.6 t0 -64.0 -37.89 89.09 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.663 -179.364 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 9.9 tm-20 -67.36 -49.53 63.59 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.922 0.391 . . . . 0.0 111.434 -179.352 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 8.4 pt -72.18 -26.71 25.3 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.732 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.46 -179.614 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -62.33 -42.31 99.28 Favored 'General case' 0 C--N 1.322 -0.609 0 C-N-CA 120.729 -0.389 . . . . 0.0 110.525 179.337 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -53.22 -27.68 23.15 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.215 -178.918 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 66.2 mt -63.11 -45.76 97.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.077 179.62 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 23.3 mmtp -54.57 -41.31 69.7 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.153 -179.17 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 28.3 mmtp -65.51 -43.73 89.18 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.588 179.624 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 47.3 t0 -62.06 -43.86 97.92 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.386 -179.731 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . 0.424 ' O ' ' O ' ' A' ' 56' ' ' LYS . . . -58.99 -30.73 68.19 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.909 -179.809 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -56.09 -37.45 69.38 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.054 -179.392 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.417 ' N ' ' CD1' ' A' ' 55' ' ' LEU . 10.0 mp -58.75 -42.93 90.01 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.131 -178.487 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.424 ' O ' ' O ' ' A' ' 53' ' ' ALA . 51.5 mtpt -99.84 139.91 34.81 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.906 0.384 . . . . 0.0 110.42 -179.902 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -77.98 68.93 2.76 Favored Glycine 0 CA--C 1.52 0.378 0 N-CA-C 110.695 -0.962 . . . . 0.0 110.695 -179.857 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 40.7 t -104.3 132.77 50.1 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.476 0 CA-C-O 120.805 0.336 . . . . 0.0 110.192 -179.935 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 91.5 m-20 -69.29 78.19 0.37 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.293 -179.645 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . 0.421 ' C ' ' H ' ' A' ' 62' ' ' ALA . 36.9 t80 -63.18 -41.99 99.29 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.026 -0.533 . . . . 0.0 110.589 -179.666 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 40.0 p-10 -60.11 -6.43 1.4 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.295 -179.364 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.495 ' O ' ' CG ' ' A' ' 63' ' ' PHE . . . -64.23 128.4 35.64 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.233 179.882 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . 0.495 ' CG ' ' O ' ' A' ' 62' ' ' ALA . 44.8 m-85 -163.91 102.8 0.89 Allowed 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.515 -179.956 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.413 ' O ' ' N ' ' A' ' 66' ' ' LYS . 68.9 mttm -84.06 138.63 32.97 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 109.727 -0.471 . . . . 0.0 109.727 179.14 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 55.8 t0 -45.67 -19.54 0.06 Allowed 'General case' 0 N--CA 1.465 0.316 0 CA-C-O 121.086 0.47 . . . . 0.0 110.867 -179.859 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . 0.413 ' N ' ' O ' ' A' ' 64' ' ' LYS . 58.7 pttt -140.61 140.7 35.13 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.196 -179.921 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 70.7 mmtt -114.91 105.96 13.6 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.372 -179.773 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 27.4 p -140.54 147.13 39.02 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.09 179.545 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 148.38 -109.38 0.45 Allowed Glycine 0 N--CA 1.464 0.52 0 N-CA-C 110.666 -0.974 . . . . 0.0 110.666 179.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 40.0 p -164.82 -149.67 0.13 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.674 0.273 . . . . 0.0 110.608 -179.877 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -56.7 -42.77 91.45 Favored Glycine 0 C--N 1.332 0.33 0 N-CA-C 110.494 -1.042 . . . . 0.0 110.494 -179.819 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.684 ' CG1' ' H ' ' A' ' 73' ' ' SER . 2.7 p -79.03 -101.18 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.223 -0.33 0 N-CA-C 110.093 -0.336 . . . . 0.0 110.093 179.627 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' SER . . . . . 0.684 ' H ' ' CG1' ' A' ' 72' ' ' VAL . 9.7 p 63.48 -65.97 0.11 Allowed 'General case' 0 N--CA 1.448 -0.556 0 O-C-N 123.893 0.745 . . . . 0.0 109.717 -179.172 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . 0.583 ' N ' ' HG ' ' A' ' 73' ' ' SER . 80.9 mm-40 -126.84 15.36 7.46 Favored 'General case' 0 CA--C 1.499 -1.013 0 CA-C-N 116.053 -0.522 . . . . 0.0 111.004 179.863 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . 0.452 ' OD1' ' N ' ' A' ' 75' ' ' ASN . 1.4 m-20 89.52 137.54 0.04 OUTLIER Pre-proline 0 CA--C 1.535 0.388 0 O-C-N 124.39 1.056 . . . . 0.0 110.664 179.583 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -70.19 6.07 1.6 Allowed 'Trans proline' 0 N--CA 1.494 1.53 0 C-N-CA 122.156 1.904 . . . . 0.0 112.156 -179.26 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 68.0 t80 -77.52 -58.99 2.97 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.948 0.404 . . . . 0.0 111.515 -179.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 19.6 tt -75.64 -27.98 19.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.768 -179.643 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 82.9 mt -73.54 -49.95 23.84 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.463 -178.855 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 99.2 mt-10 -64.45 -22.79 67.07 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.298 179.859 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -59.69 -28.44 67.3 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.867 0.365 . . . . 0.0 110.912 -179.862 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -69.44 -20.48 63.77 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.536 -179.921 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 50.3 t -73.66 -45.08 51.75 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-O 120.998 0.428 . . . . 0.0 110.805 179.621 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 84.3 mtp180 -66.95 -35.39 79.87 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.553 -179.799 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -66.15 -39.36 89.77 Favored 'General case' 0 CA--C 1.517 -0.324 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.58 -179.701 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 34.0 p -78.91 -14.5 59.19 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.716 -179.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 33.4 m -62.07 -54.5 40.46 Favored 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 120.417 -0.513 . . . . 0.0 111.456 -179.224 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 13.2 p -79.76 -44.55 23.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-O 121.35 0.595 . . . . 0.0 111.491 179.008 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -53.58 -49.36 67.9 Favored 'General case' 0 CA--C 1.52 -0.208 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.324 -176.672 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.451 ' CG ' ' N ' ' A' ' 91' ' ' LYS . 16.0 pt-20 -58.74 -45.67 89.14 Favored 'General case' 0 C--N 1.315 -0.911 0 C-N-CA 120.793 -0.363 . . . . 0.0 110.807 -179.91 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . 0.451 ' N ' ' CG ' ' A' ' 90' ' ' GLU . 98.3 mttt -58.23 -36.51 73.28 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.064 -0.517 . . . . 0.0 109.856 -179.194 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 56.4 t80 -62.43 -41.6 98.84 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.834 179.612 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 81.0 t -58.27 -45.08 89.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.203 -179.142 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 65.4 mt -53.93 -42.12 52.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-O 120.802 0.334 . . . . 0.0 110.331 -179.818 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -52.47 -36.99 56.06 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.22 -179.679 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 34.9 mm -65.45 -43.54 94.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.301 -179.773 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -64.87 -49.24 71.3 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.752 -179.674 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 80.8 tt0 -63.54 -38.98 93.19 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.011 0.434 . . . . 0.0 110.413 -179.364 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -71.19 -28.98 64.62 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.296 -179.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -65.84 -52.38 50.93 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.657 -179.181 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 1.7 t -58.27 -35.41 71.74 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.812 -179.535 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 47.3 mttp -63.77 -29.06 70.31 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.666 179.806 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 67.1 mt -92.37 2.04 56.88 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.732 0.301 . . . . 0.0 110.691 -179.476 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 86.6 tttt -68.15 73.83 0.21 Allowed 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.045 179.713 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 67.5 tt0 -172.31 48.16 0.02 OUTLIER 'General case' 0 CA--C 1.532 0.253 0 CA-C-O 121.29 0.567 . . . . 0.0 109.697 179.526 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 16.6 p 50.54 20.6 0.73 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.927 0.394 . . . . 0.0 110.973 -179.445 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -49.81 -36.74 26.81 Favored Glycine 0 CA--C 1.525 0.69 0 N-CA-C 110.973 -0.851 . . . . 0.0 110.973 -179.64 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 30.9 p -172.51 -166.82 0.41 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.799 0.333 . . . . 0.0 110.208 179.819 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 69.0 p -147.07 -57.88 0.27 Allowed 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.432 179.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -72.25 -28.31 68.35 Favored Glycine 0 CA--C 1.525 0.657 0 N-CA-C 111.341 -0.704 . . . . 0.0 111.341 179.666 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 79.9 tt0 -54.38 -34.29 60.92 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.71 0.291 . . . . 0.0 110.753 -179.129 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 61.4 m-85 -61.25 -39.04 88.84 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.607 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 40.0 t -58.84 -39.9 82.63 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.34 -179.793 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -63.7 -35.71 81.47 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.79 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 96.1 mtp -68.1 -40.35 82.62 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.131 -179.901 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 29.7 t80 -58.67 -28.13 65.45 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.313 179.87 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 66.3 t0 -57.54 -35.26 70.08 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.91 0.386 . . . . 0.0 110.48 -179.112 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 21.3 mt -58.5 -40.48 82.92 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.052 0.453 . . . . 0.0 110.034 -179.62 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.26 -53.6 52.75 Favored 'General case' 0 C--N 1.313 -0.996 0 C-N-CA 120.083 -0.647 . . . . 0.0 110.058 -179.335 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 52.8 t80 -59.36 -47.05 86.91 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.112 -179.316 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 51.3 tp10 -60.16 -35.38 75.19 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.089 -179.496 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 42.8 t -83.45 -19.85 9.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 N-CA-C 110.001 -0.37 . . . . 0.0 110.001 179.841 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 60.0 p -74.88 -27.2 60.15 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.931 0.396 . . . . 0.0 111.213 -179.612 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . 0.48 ' N ' ' HD2' ' A' ' 125' ' ' PRO . 8.0 mmtp -66.29 -57.25 13.28 Favored Pre-proline 0 C--N 1.323 -0.585 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.53 -179.541 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . 0.48 ' HD2' ' N ' ' A' ' 124' ' ' LYS . 23.8 Cg_endo -58.44 -31.66 94.63 Favored 'Trans proline' 0 C--N 1.314 -1.242 0 C-N-CA 122.24 1.96 . . . . 0.0 111.837 -179.358 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 81.2 mt -68.34 -32.53 72.71 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.676 -179.942 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -59.24 -47.05 86.78 Favored 'General case' 0 C--N 1.317 -0.82 0 C-N-CA 120.406 -0.517 . . . . 0.0 110.421 -179.29 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -69.67 -11.74 61.08 Favored 'General case' 0 CA--C 1.509 -0.619 0 CA-C-N 116.041 -0.527 . . . . 0.0 109.799 -179.614 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -87.45 -55.93 3.58 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.168 0.509 . . . . 0.0 110.5 -179.741 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -175.67 -137.68 2.62 Favored Glycine 0 N--CA 1.451 -0.353 0 N-CA-C 110.675 -0.97 . . . . 0.0 110.675 -179.084 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 131' ' ' ILE . . . . . 0.492 ' CG2' ' H ' ' A' ' 132' ' ' GLN . 1.7 mt 54.26 -150.38 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 N-CA-C 109.944 -0.391 . . . . 0.0 109.944 179.309 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . 0.492 ' H ' ' CG2' ' A' ' 131' ' ' ILE . 4.6 tt0 179.99 138.15 0.12 Allowed 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.424 179.785 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 51.06 24.74 2.0 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.882 0.372 . . . . 0.0 110.848 178.479 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 10.4 tpt -58.95 -40.19 83.94 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.895 -0.593 . . . . 0.0 109.985 -179.605 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 21.7 m -74.19 -61.34 1.89 Allowed 'General case' 0 N--CA 1.467 0.413 0 CA-C-O 121.606 0.717 . . . . 0.0 110.284 -179.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 2.2 tppp? -49.31 -42.17 40.58 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-O 121.518 0.675 . . . . 0.0 110.451 -178.354 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 137' ' ' THR . . . . . 0.717 ' HG1' ' HZ2' ' A' ' 163' ' ' LYS . 23.0 m -56.11 -68.49 0.2 Allowed 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.298 -0.864 . . . . 0.0 111.194 -179.241 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 14.6 p -55.92 -34.74 38.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 C-N-CA 120.723 -0.391 . . . . 0.0 110.681 -178.629 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 139' ' ' SER . . . . . 0.632 ' HG ' ' N ' ' A' ' 140' ' ' ASP . 25.0 p -63.91 -36.89 85.44 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.622 -179.863 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 140' ' ' ASP . . . . . 0.632 ' N ' ' HG ' ' A' ' 139' ' ' SER . 57.0 t0 -66.19 -28.06 68.48 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.594 179.811 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -67.23 -42.34 84.18 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-O 120.837 0.351 . . . . 0.0 111.1 -179.655 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -62.94 -30.13 71.33 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.396 -179.513 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 77.5 tt0 -68.31 -39.98 81.85 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.768 0.318 . . . . 0.0 110.71 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 78.7 tt0 -70.27 -41.32 73.58 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.904 -179.591 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 145' ' ' ASN . . . . . . . . . . . . . 30.0 m120 -135.27 76.57 56.54 Favored Pre-proline 0 N--CA 1.468 0.45 0 CA-C-N 116.607 -0.269 . . . . 0.0 110.556 -179.459 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 146' ' ' PRO . . . . . . . . . . . . . 78.5 Cg_exo -48.72 109.59 0.27 Allowed 'Trans proline' 0 N--CA 1.492 1.4 0 C-N-CA 122.601 2.201 . . . . 0.0 111.45 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 147' ' ' PRO . . . . . . . . . . . . . 85.1 Cg_exo -46.86 116.93 1.87 Allowed 'Trans proline' 0 N--CA 1.494 1.505 0 C-N-CA 121.813 1.675 . . . . 0.0 112.472 -179.759 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 9.1 m -130.7 -7.64 4.06 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.637 179.247 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 149' ' ' THR . . . . . 0.44 ' CG2' ' N ' ' A' ' 150' ' ' ALA . 85.3 m -159.51 167.34 28.84 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.849 0.357 . . . . 0.0 110.266 179.506 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 150' ' ' ALA . . . . . 0.44 ' N ' ' CG2' ' A' ' 149' ' ' THR . . . -51.91 -28.91 17.92 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.131 179.769 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 84.7 mt-30 -73.07 -40.48 65.0 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.476 179.501 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . -59.53 -46.09 94.53 Favored Glycine 0 C--O 1.223 -0.555 0 N-CA-C 111.015 -0.834 . . . . 0.0 111.015 -179.593 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 153' ' ' VAL . . . . . . . . . . . . . 58.3 t -63.4 -42.25 95.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-O 120.831 0.348 . . . . 0.0 110.459 -179.807 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -51.28 -36.17 40.92 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.254 -178.881 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 97.3 mt-10 -67.51 -33.79 75.8 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.082 -179.952 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 11.6 mm -77.82 -39.08 25.81 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.275 0 CA-C-O 121.028 0.442 . . . . 0.0 111.024 179.496 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -62.4 -40.69 97.31 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.641 -179.127 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -60.11 -45.87 91.51 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.045 0.45 . . . . 0.0 110.041 -179.802 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 61.8 tttm -66.65 -27.56 67.77 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.92 -179.716 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 160' ' ' MET . . . . . . . . . . . . . 22.6 mtp -74.17 -51.63 14.95 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.883 0.373 . . . . 0.0 110.451 -179.492 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 28.7 ttm180 -64.56 -37.47 87.67 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.671 -179.196 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 51.4 mm-40 -62.21 -42.73 99.56 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.854 -179.214 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 163' ' ' LYS . . . . . 0.717 ' HZ2' ' HG1' ' A' ' 137' ' ' THR . 86.5 tttt -65.44 -55.22 19.17 Favored 'General case' 0 C--N 1.323 -0.547 0 C-N-CA 120.316 -0.553 . . . . 0.0 110.653 -179.191 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 9.1 mp -53.34 -32.45 49.17 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.948 0.404 . . . . 0.0 110.152 -179.333 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 61.2 tp60 -62.09 -45.92 91.39 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.439 -179.412 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 69.2 ttp85 -64.3 -30.76 71.79 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.24 0.543 . . . . 0.0 111.041 -179.845 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 167' ' ' VAL . . . . . . . . . . . . . 56.0 t -69.56 -44.84 79.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 115.41 -0.814 . . . . 0.0 110.511 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 168' ' ' HIS . . . . . 0.423 ' O ' ' ND1' ' A' ' 168' ' ' HIS . 31.0 t-80 -77.7 -30.3 51.76 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.081 179.995 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 169' ' ' THR . . . . . 0.442 ' O ' ' SG ' ' A' ' 173' ' ' CYS . 91.3 m -69.26 -49.84 52.5 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.841 -179.913 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 28.5 mmtp -63.73 -45.05 91.65 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.828 0.346 . . . . 0.0 111.068 -179.263 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 171' ' ' ASN . . . . . . . . . . . . . 97.9 m-20 -65.21 -39.71 93.14 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.121 -179.753 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 172' ' ' TYR . . . . . . . . . . . . . 66.2 t80 -75.04 -34.42 61.86 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.799 179.83 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 173' ' ' CYS . . . . . 0.442 ' SG ' ' O ' ' A' ' 169' ' ' THR . 66.9 m -71.62 -23.05 61.64 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.482 179.95 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 19.3 m -62.25 -42.77 99.62 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.689 -179.815 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 175' ' ' LEU . . . . . 0.402 ' N ' ' CD1' ' A' ' 175' ' ' LEU . 10.1 mp -65.83 -34.61 78.55 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.575 -179.238 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -55.49 -30.79 61.27 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.322 -179.553 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 177' ' ' LYS . . . . . . . . . . . . . 85.8 tttt -61.08 -33.75 73.83 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.57 179.543 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 178' ' ' LYS . . . . . . . . . . . . . 55.7 mtpt -74.19 -47.96 32.17 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.085 -179.912 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 81.0 mm-40 -66.2 -45.11 81.91 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.301 -179.399 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 180' ' ' ASN . . . . . . . . . . . . . 88.2 m-20 -90.47 51.28 1.98 Allowed 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.345 -0.389 . . . . 0.0 109.998 179.634 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 90.9 p -61.09 -18.54 58.51 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.308 -179.613 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 182' ' ' THR . . . . . . . . . . . . . 36.2 m -61.6 -47.42 85.52 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.684 -179.829 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 183' ' ' PHE . . . . . . . . . . . . . 9.8 m-85 -98.66 123.7 43.02 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-O 121.049 0.452 . . . . 0.0 110.401 179.734 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 15.6 m -62.75 -42.01 99.47 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.461 -0.79 . . . . 0.0 109.966 179.578 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 185' ' ' ASP . . . . . . . . . . . . . 65.8 m-20 -96.62 -123.05 0.12 Allowed 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.477 -179.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 186' ' ' GLU . . . . . . . . . . . . . 81.1 mm-40 46.86 64.36 1.57 Allowed 'General case' 0 N--CA 1.456 -0.159 0 CA-C-O 120.891 0.377 . . . . 0.0 110.814 179.823 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 64.9 mttp -66.27 -76.15 0.08 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.271 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 188' ' ' CYS . . . . . . . . . . . . . 2.9 p -177.1 -62.24 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.209 179.881 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 189' ' ' LYS . . . . . . . . . . . . . 64.0 tttm -164.57 116.39 1.26 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.488 -179.732 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 190' ' ' ASN . . . . . . . . . . . . . 30.0 m120 -82.31 103.31 11.79 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.41 179.749 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 191' ' ' ASN . . . . . . . . . . . . . 98.2 m-20 . . . . . 0 C--O 1.22 -0.488 0 CA-C-O 118.026 -0.988 . . . . 0.0 110.312 -179.991 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 59.8 p . . . . . 0 N--CA 1.49 1.542 0 N-CA-C 109.315 -0.624 . . . . 0.0 109.315 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . 51.64 -177.4 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.523 -179.894 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 87.05 -10.05 70.02 Favored Glycine 0 CA--C 1.525 0.665 0 N-CA-C 110.921 -0.872 . . . . 0.0 110.921 -179.916 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 9.9 mp -92.76 178.62 5.73 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 120.967 0.413 . . . . 0.0 110.135 179.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -176.26 -31.6 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.533 -179.77 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 142.19 -135.14 6.48 Favored Glycine 0 N--CA 1.466 0.673 0 N-CA-C 110.463 -1.055 . . . . 0.0 110.463 -179.284 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.06 -13.03 62.21 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.957 0.408 . . . . 0.0 110.315 -179.828 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 19.6 m -65.4 -35.38 80.76 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.585 179.653 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 64.0 tttp -62.72 -53.14 58.95 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.046 0.45 . . . . 0.0 110.685 -179.57 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 71.1 mt -63.1 -30.23 49.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.093 -179.842 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 40.5 ttm180 -67.23 -41.97 84.82 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.754 -179.85 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 46.8 mt -73.47 -36.37 65.82 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.504 -0.316 . . . . 0.0 111.132 -179.61 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 78.6 tt0 -63.18 -50.77 69.03 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.537 -179.112 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -69.93 -44.61 69.23 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.841 0.353 . . . . 0.0 110.628 -179.671 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 70.3 m -62.68 -35.81 80.87 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.614 -179.974 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -73.69 -39.65 64.23 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.351 -179.913 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 37.4 ttmt -61.44 -31.94 71.9 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.66 -179.051 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -68.18 -23.52 64.86 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.73 -179.437 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 63.5 mt -64.91 -50.38 75.36 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 C-N-CA 120.627 -0.429 . . . . 0.0 111.333 -179.143 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 71.9 p -75.24 -42.28 55.64 Favored 'General case' 0 C--O 1.223 -0.321 0 CA-C-O 121.043 0.449 . . . . 0.0 111.762 -178.662 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 82.2 m-20 -62.11 -34.34 76.15 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.773 -178.322 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 55.5 mm-40 -72.76 -56.1 5.76 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.874 0.369 . . . . 0.0 111.571 -179.529 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 9.7 pt -63.81 -27.75 43.52 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.069 -178.838 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 88.4 m-20 -70.72 -35.08 72.54 Favored 'General case' 0 N--CA 1.465 0.275 0 O-C-N 123.342 0.401 . . . . 0.0 110.907 179.841 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -52.66 -21.18 3.69 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.45 -179.501 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . 0.418 ' CG2' ' N ' ' A' ' 50' ' ' LYS . 16.9 tt -60.61 -40.55 84.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.837 -179.501 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.418 ' N ' ' CG2' ' A' ' 49' ' ' ILE . 56.0 mtpt -51.6 -34.92 39.43 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.505 -178.744 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 34.4 mmtp -66.87 -39.5 87.55 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.61 179.865 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 50.5 t0 -70.35 -51.82 27.15 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.776 0.322 . . . . 0.0 110.844 -179.756 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . 0.467 ' O ' ' O ' ' A' ' 56' ' ' LYS . . . -55.07 -34.34 63.51 Favored 'General case' 0 C--O 1.222 -0.351 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.445 -179.5 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -58.66 -31.69 68.41 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.887 0.375 . . . . 0.0 110.819 179.956 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 61.0 mt -60.94 -43.91 98.0 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.937 -179.268 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.467 ' O ' ' O ' ' A' ' 53' ' ' ALA . 52.2 mtpt -110.7 141.7 43.63 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-O 121.141 0.496 . . . . 0.0 110.638 -179.852 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -76.8 90.68 0.97 Allowed Glycine 0 CA--C 1.522 0.519 0 N-CA-C 110.674 -0.97 . . . . 0.0 110.674 -179.926 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 27.7 m -136.77 161.15 36.67 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.508 0 CA-C-O 120.914 0.388 . . . . 0.0 110.525 -179.79 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 71.5 m-80 -70.67 165.31 23.2 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.944 -0.571 . . . . 0.0 109.943 -179.915 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 67.7 t80 -142.44 -59.11 0.45 Allowed 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.785 -179.877 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 54.1 t0 -112.1 100.89 9.21 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.595 179.805 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -132.77 -95.14 0.33 Allowed 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.295 179.954 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 93.4 m-85 52.35 99.09 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.773 0.321 . . . . 0.0 110.653 -179.721 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 25.2 pttm -153.3 145.78 24.09 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.359 -179.896 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 84.9 m-20 53.4 36.1 22.15 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.668 179.668 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 66.0 tttm 57.27 114.28 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.119 0.485 . . . . 0.0 110.502 -179.872 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 6.7 tppt? -57.02 123.77 16.36 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.48 -179.655 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 44.6 m -90.39 126.08 35.76 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-O 120.991 0.424 . . . . 0.0 110.56 179.619 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 68.1 178.63 15.01 Favored Glycine 0 CA--C 1.522 0.476 0 N-CA-C 110.637 -0.985 . . . . 0.0 110.637 179.769 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 95.9 p -160.05 156.24 26.62 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-O 120.82 0.343 . . . . 0.0 110.414 179.75 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . 0.576 ' H ' ' CD1' ' A' ' 79' ' ' LEU . . . 64.09 -92.65 0.12 Allowed Glycine 0 CA--C 1.528 0.899 0 N-CA-C 110.985 -0.846 . . . . 0.0 110.985 179.895 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.441 ' O ' ' O ' ' A' ' 73' ' ' SER . 27.9 m -56.08 130.0 18.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 C-N-CA 121.129 -0.229 . . . . 0.0 110.854 -179.867 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' SER . . . . . 0.463 ' O ' ' CB ' ' A' ' 74' ' ' GLU . 65.1 m 50.9 101.9 0.01 OUTLIER 'General case' 0 CA--C 1.507 -0.695 0 CA-C-O 118.7 -0.667 . . . . 0.0 109.782 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . 0.463 ' CB ' ' O ' ' A' ' 73' ' ' SER . 59.5 tt0 152.34 -22.28 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.714 0 O-C-N 124.696 1.247 . . . . 0.0 110.761 179.553 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . 0.605 ' C ' ' H ' ' A' ' 77' ' ' PHE . 8.0 m120 88.03 85.39 0.04 OUTLIER Pre-proline 0 N--CA 1.472 0.653 0 O-C-N 124.112 0.882 . . . . 0.0 109.465 -177.96 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_exo -59.3 18.62 0.03 OUTLIER 'Trans proline' 0 N--CA 1.498 1.789 0 C-N-CA 122.642 2.228 . . . . 0.0 112.401 179.656 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . 0.605 ' H ' ' C ' ' A' ' 75' ' ' ASN . 75.3 t80 -75.06 -52.75 10.28 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.017 0.437 . . . . 0.0 110.925 179.803 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 15.1 tt -76.33 -27.57 17.66 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.244 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.319 -179.879 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.576 ' CD1' ' H ' ' A' ' 71' ' ' GLY . 56.6 mt -72.99 -43.69 61.92 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.032 0.444 . . . . 0.0 111.377 -179.684 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 92.0 mt-10 -67.6 -24.17 65.45 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.54 179.477 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -64.92 -34.33 78.16 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.878 0.37 . . . . 0.0 111.004 -179.9 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 48.7 mtmt -72.89 -20.64 61.05 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.698 -179.663 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 48.3 t -72.81 -44.89 57.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 121.016 0.436 . . . . 0.0 110.61 179.865 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 91.4 mtt-85 -71.14 -30.03 65.98 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.361 -179.874 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -65.07 -46.4 81.31 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.047 0.451 . . . . 0.0 111.568 -179.146 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 5.7 t -75.43 -20.87 58.6 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.288 179.966 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 96.3 m -62.05 -53.54 54.13 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.528 -0.469 . . . . 0.0 111.244 -179.218 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 35.4 t -70.41 -44.32 77.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-O 121.092 0.473 . . . . 0.0 110.829 -179.591 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -59.17 -36.7 75.78 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.971 -0.558 . . . . 0.0 110.601 -179.052 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 84.3 tt0 -56.68 -44.93 81.93 Favored 'General case' 0 C--N 1.323 -0.577 0 C-N-CA 120.565 -0.454 . . . . 0.0 110.515 -179.933 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 9.7 mtpm? -56.66 -39.18 73.29 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.371 -179.3 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 76.9 t80 -59.3 -45.97 89.84 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.806 -179.855 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 65.2 t -56.03 -44.86 79.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-O 120.83 0.348 . . . . 0.0 110.401 -178.817 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 96.7 mt -58.94 -41.17 82.26 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 -179.335 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -56.1 -44.7 79.32 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.464 -0.334 . . . . 0.0 110.751 -179.452 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 44.4 mm -61.42 -41.78 91.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.177 -179.682 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 83.7 tt0 -60.61 -48.57 81.2 Favored 'General case' 0 C--N 1.323 -0.58 0 C-N-CA 120.651 -0.42 . . . . 0.0 110.586 -179.825 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 14.8 mm-40 -66.22 -32.22 73.52 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.561 -179.55 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -59.7 -39.65 85.32 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.417 -179.152 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -59.28 -27.59 65.96 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.037 -0.528 . . . . 0.0 110.302 -179.416 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 8.5 m -60.65 -43.33 97.71 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.504 -179.48 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -71.22 -16.57 62.51 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.472 -179.603 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . 0.491 ' O ' ' N ' ' A' ' 105' ' ' GLU . 77.8 mt -101.77 -6.63 23.41 Favored 'General case' 0 CA--C 1.5 -0.966 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.406 -179.341 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.485 ' O ' ' O ' ' A' ' 105' ' ' GLU . 0.1 OUTLIER -24.33 -44.13 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.772 0 O-C-N 124.528 1.142 . . . . 0.0 110.798 -179.169 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . 0.491 ' N ' ' O ' ' A' ' 103' ' ' LEU . 77.5 mm-40 -56.75 -148.11 0.0 OUTLIER 'General case' 0 N--CA 1.448 -0.575 0 CA-C-N 115.187 -0.915 . . . . 0.0 109.343 178.514 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' THR . . . . . 0.53 ' CG2' ' H ' ' A' ' 107' ' ' GLY . 4.7 t -48.57 -59.17 3.73 Favored 'General case' 0 C--N 1.318 -0.772 0 O-C-N 121.992 -0.443 . . . . 0.0 111.114 178.997 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . 0.53 ' H ' ' CG2' ' A' ' 106' ' ' THR . . . 70.94 -43.84 0.64 Allowed Glycine 0 CA--C 1.526 0.762 0 N-CA-C 111.044 -0.822 . . . . 0.0 111.044 -179.445 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' SER . . . . . 0.444 ' H ' ' C ' ' A' ' 106' ' ' THR . 1.4 t 72.89 129.83 0.04 OUTLIER 'General case' 0 CA--C 1.53 0.184 0 CA-C-O 120.767 0.317 . . . . 0.0 110.482 -179.792 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 15.0 m -64.01 -36.73 84.94 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.449 179.912 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -59.04 -33.36 73.99 Favored Glycine 0 CA--C 1.522 0.487 0 N-CA-C 110.792 -0.923 . . . . 0.0 110.792 -179.658 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 42.7 tp10 -66.73 -43.34 84.5 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 120.77 -0.372 . . . . 0.0 110.3 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' PHE . . . . . 0.436 ' O ' ' N ' ' A' ' 115' ' ' MET . 48.3 m-85 -67.62 -37.57 82.68 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.625 -179.956 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 59.9 p -47.31 -34.71 7.08 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.967 0.413 . . . . 0.0 110.67 -179.039 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -76.44 -28.85 56.74 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.778 178.854 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' MET . . . . . 0.436 ' N ' ' O ' ' A' ' 112' ' ' PHE . 60.9 mmm -73.38 -44.71 58.0 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.234 -179.844 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 7.4 m-85 -60.24 -49.43 77.64 Favored 'General case' 0 CA--C 1.513 -0.445 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 -179.388 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 66.8 t0 -47.75 -32.15 5.58 Favored 'General case' 0 N--CA 1.453 -0.28 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 -179.084 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.23 -44.81 95.72 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.73 -179.992 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' MET . . . . . 0.415 ' C ' ' SD ' ' A' ' 119' ' ' MET . 0.0 OUTLIER -52.16 -42.91 63.79 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.238 -0.892 . . . . 0.0 109.724 -178.988 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 85.4 m-85 -68.06 -39.61 82.97 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.06 -179.828 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 87.7 mt-10 -59.61 -45.76 90.96 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.779 -179.344 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 7.7 p -75.08 -24.66 17.88 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.822 0 O-C-N 123.314 0.384 . . . . 0.0 110.042 179.344 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 23.0 t -75.5 -25.75 57.55 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.832 0.348 . . . . 0.0 111.037 179.862 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . 0.463 ' N ' ' HD2' ' A' ' 125' ' ' PRO . 43.6 tptt -59.55 -57.25 28.32 Favored Pre-proline 0 CA--C 1.549 0.92 0 C-N-CA 120.557 -0.457 . . . . 0.0 110.777 179.797 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . 0.463 ' HD2' ' N ' ' A' ' 124' ' ' LYS . 31.8 Cg_endo -60.28 -25.78 81.02 Favored 'Trans proline' 0 N--CA 1.489 1.208 0 C-N-CA 122.597 2.198 . . . . 0.0 111.783 -178.387 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -64.65 -32.77 74.57 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.69 -179.211 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 78.6 mt-30 -57.28 -38.22 73.58 Favored 'General case' 0 C--N 1.31 -1.129 0 C-N-CA 120.403 -0.519 . . . . 0.0 110.306 -179.859 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 32.4 mmtp -61.61 -10.98 9.45 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.752 -179.614 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 15.4 mt -114.47 -2.52 13.18 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.973 179.743 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . 0.525 ' O ' ' C ' ' A' ' 131' ' ' ILE . . . 114.43 -94.78 0.7 Allowed Glycine 0 CA--C 1.503 -0.687 0 N-CA-C 109.82 -1.312 . . . . 0.0 109.82 179.942 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 131' ' ' ILE . . . . . 0.525 ' C ' ' O ' ' A' ' 130' ' ' GLY . 4.8 mp -3.46 88.46 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.084 0 O-C-N 124.902 1.001 . . . . 0.0 110.703 179.837 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . 0.463 ' O ' ' HB2' ' A' ' 133' ' ' GLU . 19.4 tt0 -123.51 162.62 22.54 Favored 'General case' 0 CA--C 1.486 -1.514 0 N-CA-C 107.294 -1.372 . . . . 0.0 107.294 -178.583 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 133' ' ' GLU . . . . . 0.463 ' HB2' ' O ' ' A' ' 132' ' ' GLN . 92.4 mt-10 106.22 -19.4 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.972 0 O-C-N 125.785 1.928 . . . . 0.0 109.757 179.536 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 5.0 mtp -52.85 -48.2 67.22 Favored 'General case' 0 C--N 1.319 -0.735 0 C-N-CA 120.36 -0.536 . . . . 0.0 110.899 -179.277 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 65.7 p -52.58 -21.62 4.07 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.57 178.796 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 70.3 mmtt -83.31 -48.09 10.8 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 115.626 -0.715 . . . . 0.0 111.304 -179.651 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 46.5 p -54.05 -50.22 67.2 Favored 'General case' 0 C--N 1.324 -0.505 0 C-N-CA 120.827 -0.349 . . . . 0.0 110.745 -178.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 58.3 t -68.72 -44.35 82.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.088 -179.881 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 47.6 t -65.34 -41.29 94.07 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.954 0.407 . . . . 0.0 111.14 -179.846 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -64.21 -42.1 96.76 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.665 -179.539 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -63.54 -47.59 80.96 Favored 'General case' 0 CA--C 1.519 -0.248 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.998 -179.626 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -46.54 -35.46 5.8 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.944 -179.292 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -90.61 77.15 6.43 Favored 'General case' 0 CA--C 1.517 -0.301 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 179.509 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 79.2 tt0 -177.64 -61.23 0.01 OUTLIER 'General case' 0 C--N 1.334 -0.077 0 O-C-N 123.593 0.558 . . . . 0.0 110.434 179.644 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 145' ' ' ASN . . . . . . . . . . . . . 7.2 p-10 -143.01 64.63 14.71 Favored Pre-proline 0 N--CA 1.467 0.402 0 CA-C-N 116.196 -0.457 . . . . 0.0 109.897 -179.575 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 146' ' ' PRO . . . . . 0.547 ' O ' ' N ' ' A' ' 148' ' ' THR . 80.7 Cg_exo -34.24 98.78 0.02 OUTLIER 'Trans proline' 0 N--CA 1.491 1.329 0 C-N-CA 123.304 2.669 . . . . 0.0 111.722 -179.503 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 147' ' ' PRO . . . . . 0.546 ' C ' ' H ' ' A' ' 149' ' ' THR . 59.6 Cg_exo -51.48 74.2 0.02 OUTLIER 'Trans proline' 0 N--CA 1.496 1.671 0 C-N-CA 122.354 2.036 . . . . 0.0 113.14 -179.294 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 148' ' ' THR . . . . . 0.547 ' N ' ' O ' ' A' ' 146' ' ' PRO . 8.1 p -73.17 21.43 0.08 Allowed 'General case' 0 C--N 1.329 -0.309 0 O-C-N 121.997 -0.439 . . . . 0.0 109.981 179.883 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 149' ' ' THR . . . . . 0.546 ' H ' ' C ' ' A' ' 147' ' ' PRO . 1.2 t -148.52 156.36 42.34 Favored 'General case' 0 CA--C 1.52 -0.176 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.161 -179.881 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -64.75 -33.78 76.78 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.958 -179.784 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 7.2 tt0 -68.74 -44.41 73.85 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.881 0.372 . . . . 0.0 110.753 -179.784 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . -56.53 -38.3 79.97 Favored Glycine 0 CA--C 1.52 0.366 0 N-CA-C 110.871 -0.892 . . . . 0.0 110.871 -179.198 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 153' ' ' VAL . . . . . . . . . . . . . 75.9 t -53.51 -32.53 20.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 C-N-CA 120.923 -0.311 . . . . 0.0 110.503 -179.392 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 72.5 mt -56.85 -27.47 60.37 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.94 0.4 . . . . 0.0 110.112 -179.505 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 67.3 mm-40 -66.92 -32.82 74.33 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.258 179.583 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 156' ' ' ILE . . . . . 0.407 HD13 HG21 ' A' ' 156' ' ' ILE . 14.7 mm -75.23 -41.53 44.07 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.182 0 CA-C-O 120.931 0.396 . . . . 0.0 110.88 179.605 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -50.8 -39.22 52.3 Favored 'General case' 0 CA--C 1.516 -0.341 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.379 -179.646 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 158' ' ' LYS . . . . . 0.436 ' O ' ' CB ' ' A' ' 162' ' ' GLU . 99.6 mttt -56.38 -56.63 18.76 Favored 'General case' 0 C--O 1.216 -0.664 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.447 179.787 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 42.7 mmtm -57.96 -36.49 72.66 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.757 0.313 . . . . 0.0 111.007 -179.375 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 160' ' ' MET . . . . . . . . . . . . . 6.2 mtp -67.44 -57.4 6.61 Favored 'General case' 0 C--N 1.322 -0.588 0 C-N-CA 120.398 -0.521 . . . . 0.0 110.826 -179.526 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 61.4 ttp180 -68.71 -35.86 77.71 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.881 -179.483 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . 0.436 ' CB ' ' O ' ' A' ' 158' ' ' LYS . 81.2 tt0 -65.14 -35.54 81.42 Favored 'General case' 0 CA--C 1.512 -0.495 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.536 -179.275 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 163' ' ' LYS . . . . . . . . . . . . . 23.3 tptm -70.58 -56.5 6.37 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 119.992 -0.683 . . . . 0.0 110.845 -179.131 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 4.8 mt -55.17 -28.96 56.67 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.187 0.518 . . . . 0.0 110.081 -178.519 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 54.3 tt0 -61.71 -47.82 83.56 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.718 -0.673 . . . . 0.0 110.388 -179.71 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -62.09 -30.52 71.06 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.4 0.619 . . . . 0.0 110.731 -179.595 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 167' ' ' VAL . . . . . . . . . . . . . 51.8 t -67.2 -46.57 83.89 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-N 115.038 -0.983 . . . . 0.0 110.693 -179.694 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 168' ' ' HIS . . . . . 0.469 ' O ' ' ND1' ' A' ' 168' ' ' HIS . 23.6 t-80 -79.68 -30.52 41.15 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.193 -179.791 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 169' ' ' THR . . . . . . . . . . . . . 27.5 m -72.99 -45.35 58.41 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.409 -179.904 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 64.7 tttm -61.9 -42.26 98.87 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.663 -179.047 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 171' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -69.84 -31.47 69.35 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.609 179.829 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 172' ' ' TYR . . . . . . . . . . . . . 74.2 t80 -70.05 -32.26 70.29 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.887 -179.833 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 86.5 m -76.24 -32.93 59.15 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.734 -179.822 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 21.4 p -63.62 -37.17 86.33 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.842 0.353 . . . . 0.0 110.477 -179.856 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 94.9 mt -65.49 -34.78 79.07 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.39 -179.928 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 72.6 mmtt -63.44 -8.63 9.64 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.477 -179.818 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 177' ' ' LYS . . . . . . . . . . . . . 62.7 tttm -63.42 -35.86 81.84 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.658 179.124 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 178' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -67.75 -38.87 84.06 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.863 179.897 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 52.3 tp10 -51.04 -46.12 61.53 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.301 -178.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 180' ' ' ASN . . . . . 0.404 ' O ' ' CB ' ' A' ' 181' ' ' SER . 16.8 m120 -96.09 -90.1 0.25 Allowed 'General case' 0 N--CA 1.464 0.244 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 179.481 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 181' ' ' SER . . . . . 0.404 ' CB ' ' O ' ' A' ' 180' ' ' ASN . 1.0 OUTLIER 166.16 -67.05 0.0 OUTLIER 'General case' 0 N--CA 1.462 0.169 0 CA-C-O 120.874 0.369 . . . . 0.0 110.167 179.727 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 182' ' ' THR . . . . . . . . . . . . . 28.8 m -159.15 111.72 2.21 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.521 -179.655 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 183' ' ' PHE . . . . . . . . . . . . . 30.5 m-85 -141.54 153.4 44.84 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.356 179.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 2.9 m -145.4 45.49 1.31 Allowed 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.418 179.758 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 185' ' ' ASP . . . . . . . . . . . . . 49.6 p-10 -163.46 42.05 0.1 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.704 179.876 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 186' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -155.13 152.3 29.3 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.151 0.5 . . . . 0.0 109.957 -179.081 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 58.4 mtpt -88.73 148.17 24.11 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.309 179.598 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 188' ' ' CYS . . . . . . . . . . . . . 45.1 t -54.11 -34.25 59.8 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.523 179.713 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 189' ' ' LYS . . . . . . . . . . . . . 34.9 mmtp -69.47 -59.62 2.86 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.528 -179.849 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 190' ' ' ASN . . . . . . . . . . . . . 20.6 t-20 -71.88 102.55 2.92 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.01 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 191' ' ' ASN . . . . . . . . . . . . . 86.9 m-20 . . . . . 0 C--O 1.219 -0.538 0 CA-C-O 118.137 -0.935 . . . . 0.0 110.544 -179.82 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 35.3 m . . . . . 0 N--CA 1.491 1.596 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . 52.27 -104.31 0.18 Allowed 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.489 -179.944 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -157.52 -36.5 0.02 OUTLIER Glycine 0 CA--C 1.523 0.577 0 N-CA-C 110.824 -0.91 . . . . 0.0 110.824 -179.882 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 52.1 mt -78.16 149.14 33.82 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.028 0.442 . . . . 0.0 110.082 -179.895 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' THR . . . . . 0.498 ' O ' ' N ' ' A' ' 30' ' ' ALA . 7.1 t -59.88 98.64 0.06 Allowed 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.786 -0.643 . . . . 0.0 109.852 179.719 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . 0.461 ' C ' ' O ' ' A' ' 28' ' ' THR . . . -20.89 84.72 0.0 OUTLIER Glycine 0 N--CA 1.48 1.619 0 O-C-N 123.7 0.625 . . . . 0.0 112.322 -179.347 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.498 ' N ' ' O ' ' A' ' 28' ' ' THR . . . 164.5 -69.65 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 120.988 0.423 . . . . 0.0 109.963 -178.363 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 25.4 m -49.18 -29.32 5.36 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.55 -178.86 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 21.0 pttp -61.94 -26.3 68.11 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.5 179.596 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 96.6 mt -59.07 -45.12 92.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 -178.549 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 10.1 tpt180 -65.61 -53.07 46.73 Favored 'General case' 0 C--N 1.324 -0.506 0 C-N-CA 120.158 -0.617 . . . . 0.0 110.365 -179.69 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 11.0 mp -59.87 -44.9 93.92 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.054 -0.521 . . . . 0.0 109.696 -178.635 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 80.9 tt0 -58.94 -51.01 71.89 Favored 'General case' 0 C--N 1.32 -0.717 0 C-N-CA 120.479 -0.488 . . . . 0.0 110.234 -179.505 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 16.5 mmm180 -68.69 -42.43 77.8 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.962 0.411 . . . . 0.0 110.968 -179.766 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 52.0 m -67.52 -40.08 85.08 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.609 -179.89 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -61.01 -49.49 77.23 Favored 'General case' 0 C--O 1.219 -0.51 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.491 -179.536 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -54.4 -42.75 70.79 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 120.683 -0.407 . . . . 0.0 110.25 -179.09 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 23.9 m-20 -52.93 -22.87 6.11 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.713 179.594 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 81.1 mt -65.81 -59.01 4.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 C-N-CA 120.184 -0.606 . . . . 0.0 110.98 -179.819 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 82.8 p -76.71 -37.22 56.47 Favored 'General case' 0 C--O 1.225 -0.188 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.657 -179.009 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 52.6 t0 -61.94 -41.04 97.5 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.836 -0.62 . . . . 0.0 112.427 -178.088 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 64.8 mm-40 -69.1 -51.76 35.28 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.873 0.368 . . . . 0.0 111.419 -179.194 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 10.2 pt -66.91 -28.59 43.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.531 -179.333 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -61.43 -40.47 94.56 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 110.036 -0.357 . . . . 0.0 110.036 -179.785 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -53.41 -30.07 38.29 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.331 -179.15 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 62.8 mt -67.6 -43.42 86.96 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.333 179.454 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 69.0 mttm -58.21 -46.28 86.12 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.159 -179.087 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 52.1 mtmt -65.62 -41.07 93.11 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.662 179.401 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 96.6 m-20 -61.59 -39.37 90.93 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.029 -179.377 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . 0.441 ' O ' ' O ' ' A' ' 56' ' ' LYS . . . -60.86 -31.97 71.4 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.596 -179.992 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -59.35 -30.82 68.67 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.892 0.377 . . . . 0.0 110.921 -179.701 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 57.3 mt -59.1 -34.3 71.84 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.609 -179.349 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.441 ' O ' ' O ' ' A' ' 53' ' ' ALA . 68.9 mttm -119.19 147.45 44.21 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-O 121.249 0.547 . . . . 0.0 110.551 -179.851 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -77.27 95.51 1.19 Allowed Glycine 0 CA--C 1.521 0.441 0 N-CA-C 110.496 -1.041 . . . . 0.0 110.496 -179.895 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 27.4 m -133.55 152.21 34.71 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.512 0 CA-C-O 120.853 0.358 . . . . 0.0 110.098 179.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . 0.557 ' N ' HD21 ' A' ' 59' ' ' ASN . 0.0 OUTLIER -84.33 63.58 7.85 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.277 -179.948 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 81.3 t80 -62.08 -53.57 53.67 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.687 -179.744 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 36.1 p-10 -91.41 78.15 5.72 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.573 -179.746 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -143.42 -82.19 0.18 Allowed 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.269 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . 0.521 ' C ' ' H ' ' A' ' 65' ' ' ASP . 64.4 m-85 56.58 39.43 29.84 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.451 -179.596 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 72.7 tttt -72.02 19.9 0.07 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.48 -179.838 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.521 ' H ' ' C ' ' A' ' 63' ' ' PHE . 37.4 t70 -167.06 160.3 13.9 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.81 0.338 . . . . 0.0 110.166 -179.998 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 22.5 pttp -65.29 140.43 58.7 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.251 179.84 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.577 ' C ' ' H ' ' A' ' 69' ' ' GLY . 46.9 mmtm -119.85 -84.44 0.66 Allowed 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.338 -179.952 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 3.5 m 66.39 -15.42 0.13 Allowed 'General case' 0 C--N 1.326 -0.452 0 O-C-N 123.24 0.338 . . . . 0.0 110.633 -179.499 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . 0.577 ' H ' ' C ' ' A' ' 67' ' ' LYS . . . 160.19 -136.09 4.38 Favored Glycine 0 C--N 1.333 0.416 0 N-CA-C 110.397 -1.081 . . . . 0.0 110.397 -179.665 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' SER . . . . . 0.418 ' C ' ' H ' ' A' ' 72' ' ' VAL . 5.2 t 64.25 88.06 0.11 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.757 0.313 . . . . 0.0 110.16 -179.742 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -79.1 23.35 3.24 Favored Glycine 0 CA--C 1.524 0.596 0 N-CA-C 111.055 -0.818 . . . . 0.0 111.055 -179.792 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.418 ' H ' ' C ' ' A' ' 70' ' ' SER . 10.9 p -130.82 -31.94 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.708 0 CA-C-O 120.791 0.329 . . . . 0.0 110.765 -179.908 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 67.5 m -58.33 -40.91 83.37 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.389 -179.447 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 11.4 tp10 -135.29 -145.05 0.22 Allowed 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.468 -179.708 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 69.8 m-20 -90.19 140.24 27.24 Favored Pre-proline 0 CA--C 1.534 0.347 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.321 -179.5 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -74.53 -5.67 17.21 Favored 'Trans proline' 0 N--CA 1.495 1.58 0 C-N-CA 122.443 2.095 . . . . 0.0 111.971 179.903 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 53.5 t80 -72.36 -50.95 22.92 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.907 0.384 . . . . 0.0 111.513 -179.413 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 64.7 mt -69.74 -29.0 39.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.935 -179.296 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.42 ' N ' ' CD1' ' A' ' 79' ' ' LEU . 8.1 mp -77.01 -48.71 17.18 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 120.862 0.363 . . . . 0.0 110.174 179.778 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -65.44 -29.33 69.99 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.095 -0.502 . . . . 0.0 109.922 179.937 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -66.78 -37.28 84.27 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.706 179.662 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 37.0 ttpt -63.78 -24.2 67.67 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.744 -179.596 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 32.3 t -70.69 -46.6 68.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.668 179.859 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 57.8 ttt85 -62.28 -33.18 74.14 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.32 -179.642 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -59.28 -37.6 78.08 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.121 0.486 . . . . 0.0 110.895 -179.427 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 61.3 p -72.11 -27.7 62.8 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.36 179.638 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 25.0 m -57.61 -53.77 54.4 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 120.443 -0.503 . . . . 0.0 111.252 -178.778 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 26.8 m -72.46 -50.8 32.57 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-O 120.92 0.39 . . . . 0.0 111.338 179.668 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -55.57 -44.25 76.71 Favored 'General case' 0 C--O 1.222 -0.376 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.341 -178.323 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 77.8 tt0 -58.2 -45.45 87.57 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.193 0.52 . . . . 0.0 110.584 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 57.3 mtpt -60.87 -29.65 69.67 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.63 -179.206 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 82.7 t80 -71.05 -59.38 2.81 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.987 -178.859 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 8.4 m -49.4 -40.29 14.23 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.448 0 N-CA-C 109.921 -0.4 . . . . 0.0 109.921 -178.801 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 88.9 mt -61.94 -43.06 96.97 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 N-CA-C 109.888 -0.412 . . . . 0.0 109.888 179.52 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -57.52 -30.98 65.6 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 120.876 -0.33 . . . . 0.0 110.801 -179.112 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 40.7 mm -59.87 -36.51 67.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.44 -179.512 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -65.78 -34.41 78.12 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.938 179.907 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -65.05 -39.53 93.43 Favored 'General case' 0 C--N 1.326 -0.45 0 C-N-CA 120.851 -0.34 . . . . 0.0 110.358 -179.469 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 80.7 mm-40 -67.38 -39.0 85.59 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.908 0.385 . . . . 0.0 110.744 -179.832 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -53.27 -48.34 68.39 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.956 0.408 . . . . 0.0 110.81 -179.634 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 11.9 m -60.1 -48.24 82.57 Favored 'General case' 0 C--N 1.321 -0.652 0 C-N-CA 120.472 -0.491 . . . . 0.0 110.847 -179.392 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 5.8 mptp? -67.21 -31.57 72.03 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.802 0.334 . . . . 0.0 111.009 179.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 27.1 mt -67.11 -7.1 20.62 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 120.869 0.366 . . . . 0.0 110.679 -178.803 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 22.4 pttp -57.83 142.51 45.53 Favored 'General case' 0 C--N 1.316 -0.863 0 C-N-CA 120.508 -0.477 . . . . 0.0 109.788 179.547 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 70.3 mm-40 66.96 20.87 10.44 Favored 'General case' 0 C--N 1.33 -0.253 0 O-C-N 123.609 0.568 . . . . 0.0 111.133 178.753 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' THR . . . . . 0.425 ' O ' ' OG1' ' A' ' 106' ' ' THR . 0.9 OUTLIER 178.0 31.32 0.0 OUTLIER 'General case' 0 CA--C 1.53 0.188 0 CA-C-O 121.126 0.488 . . . . 0.0 110.081 179.694 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -82.83 -63.79 1.72 Allowed Glycine 0 N--CA 1.464 0.508 0 N-CA-C 110.871 -0.892 . . . . 0.0 110.871 -179.719 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' SER . . . . . 0.464 ' O ' ' CE1' ' A' ' 112' ' ' PHE . 1.0 OUTLIER 70.5 -171.48 0.17 Allowed 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 109.735 -0.468 . . . . 0.0 109.735 -179.74 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 91.4 p -113.99 -10.79 12.85 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.366 179.638 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -71.76 -52.79 10.97 Favored Glycine 0 CA--C 1.526 0.754 0 N-CA-C 111.355 -0.698 . . . . 0.0 111.355 179.89 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . 0.452 ' CD ' ' H ' ' A' ' 111' ' ' GLU . 2.5 mp0 -68.31 -22.62 64.7 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.916 0.389 . . . . 0.0 110.876 -179.491 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' PHE . . . . . 0.464 ' CE1' ' O ' ' A' ' 108' ' ' SER . 3.3 m-85 -59.42 -43.79 92.98 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.24 -178.987 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 43.8 t -60.1 -43.44 95.56 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.212 -179.891 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -65.11 -28.89 69.75 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.733 179.642 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 50.1 tpp -76.11 -52.54 9.92 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.245 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 36.9 t80 -62.08 -50.18 72.97 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 109.777 -0.453 . . . . 0.0 109.777 -179.685 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 52.2 t0 -48.58 -27.73 2.97 Favored 'General case' 0 CA--C 1.517 -0.29 0 N-CA-C 109.652 -0.499 . . . . 0.0 109.652 -179.073 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.68 -46.14 83.7 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.498 0.666 . . . . 0.0 109.893 -179.926 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 14.4 tpt -57.96 -34.26 69.74 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 114.987 -1.006 . . . . 0.0 109.638 -179.305 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 68.1 t80 -71.0 -41.1 71.38 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.317 -0.401 . . . . 0.0 112.046 -179.41 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 65.5 mm-40 -63.45 -44.87 93.24 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.87 -178.937 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 28.9 m -75.22 -23.97 17.37 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.405 0 O-C-N 123.326 0.391 . . . . 0.0 110.749 -179.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 21.2 t -68.0 -33.16 74.08 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.631 179.69 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 17.1 mttp -60.24 -56.68 33.06 Favored Pre-proline 0 CA--C 1.541 0.626 0 C-N-CA 121.05 -0.26 . . . . 0.0 110.833 -179.421 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 75.8 Cg_exo -43.58 -36.5 7.18 Favored 'Trans proline' 0 C--N 1.317 -1.113 0 C-N-CA 122.14 1.893 . . . . 0.0 112.442 178.402 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 10.1 mp -70.29 -35.13 73.51 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.981 -179.862 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 40.9 mm-40 -61.51 -52.41 64.6 Favored 'General case' 0 C--N 1.32 -0.683 0 C-N-CA 120.248 -0.581 . . . . 0.0 110.728 -179.427 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 50.1 mtmt -63.78 -10.98 22.82 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.18 -179.57 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 2.5 tt -97.86 -67.62 0.84 Allowed 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.278 -179.778 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -155.51 -138.51 2.58 Favored Glycine 0 CA--C 1.518 0.259 0 N-CA-C 110.688 -0.965 . . . . 0.0 110.688 -179.231 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 131' ' ' ILE . . . . . 0.754 ' CG2' ' H ' ' A' ' 132' ' ' GLN . 3.3 mp 53.28 -158.41 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.517 -0.298 0 N-CA-C 109.654 -0.499 . . . . 0.0 109.654 -179.771 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . 0.754 ' H ' ' CG2' ' A' ' 131' ' ' ILE . 6.0 tp60 177.43 139.52 0.08 Allowed 'General case' 0 N--CA 1.446 -0.654 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 179.866 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 94.1 mt-10 59.28 26.12 14.88 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-O 120.966 0.412 . . . . 0.0 111.455 178.135 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 9.3 tpt -57.79 -39.93 78.69 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.087 -179.798 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 135' ' ' THR . . . . . 0.465 ' HG1' ' H ' ' A' ' 136' ' ' LYS . 56.8 p -75.22 -61.72 1.8 Allowed 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 121.363 0.602 . . . . 0.0 110.696 -179.699 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 136' ' ' LYS . . . . . 0.465 ' H ' ' HG1' ' A' ' 135' ' ' THR . 17.7 ttmm -49.24 -44.27 43.41 Favored 'General case' 0 C--N 1.32 -0.679 0 C-N-CA 120.455 -0.498 . . . . 0.0 110.524 -178.327 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 76.8 m -55.52 -68.44 0.2 Allowed 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.323 -179.299 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 11.7 p -59.86 -38.89 78.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.993 0.425 . . . . 0.0 110.469 -178.891 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 139' ' ' SER . . . . . 0.44 ' OG ' ' O ' ' A' ' 135' ' ' THR . 15.9 m -63.23 -38.5 91.4 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.753 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -63.09 -31.42 72.56 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.009 -0.542 . . . . 0.0 110.522 -179.859 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -64.43 -46.03 84.93 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.86 0.362 . . . . 0.0 111.119 -179.598 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -57.75 -31.18 66.24 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.713 -179.207 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 14.3 mm-40 -75.13 -44.59 46.18 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.861 0.362 . . . . 0.0 111.117 -179.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 46.3 tp10 -72.12 -45.79 59.17 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.022 -179.106 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 145' ' ' ASN . . . . . 0.514 HD22 ' CD1' ' A' ' 156' ' ' ILE . 3.5 p-10 -128.54 68.98 78.81 Favored Pre-proline 0 N--CA 1.469 0.513 0 CA-C-N 116.376 -0.374 . . . . 0.0 110.09 -179.045 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 146' ' ' PRO . . . . . . . . . . . . . 23.2 Cg_endo -60.28 112.69 1.39 Allowed 'Trans proline' 0 N--CA 1.492 1.418 0 C-N-CA 122.38 2.053 . . . . 0.0 111.303 -179.7 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 147' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -79.3 136.36 12.62 Favored 'Trans proline' 0 N--CA 1.491 1.378 0 C-N-CA 122.115 1.876 . . . . 0.0 111.768 -179.902 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 36.5 p -129.53 18.96 5.76 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.236 179.327 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 149' ' ' THR . . . . . . . . . . . . . 8.5 m -151.96 152.46 32.52 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 120.661 0.267 . . . . 0.0 110.354 179.578 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -49.47 -36.11 21.71 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.795 0.331 . . . . 0.0 110.559 -179.077 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 14.9 pt20 -77.74 -40.64 40.41 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.649 179.216 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . -56.4 -36.97 71.92 Favored Glycine 0 CA--C 1.519 0.302 0 N-CA-C 110.887 -0.885 . . . . 0.0 110.887 -178.839 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 153' ' ' VAL . . . . . 0.44 ' O ' ' N ' ' A' ' 156' ' ' ILE . 86.1 t -60.88 -42.07 91.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 C-N-CA 121.21 -0.196 . . . . 0.0 110.508 -179.839 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 79.3 mt -43.56 -23.42 0.07 Allowed 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 120.912 0.387 . . . . 0.0 110.86 -179.295 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 155' ' ' GLU . . . . . 0.411 ' N ' ' C ' ' A' ' 153' ' ' VAL . 95.2 mt-10 -64.86 -40.4 95.08 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.004 179.268 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 156' ' ' ILE . . . . . 0.514 ' CD1' HD22 ' A' ' 145' ' ' ASN . 10.2 mm -71.48 -35.74 57.94 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.154 -179.709 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -60.13 -41.75 93.34 Favored 'General case' 0 N--CA 1.453 -0.278 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.864 -179.686 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 17.3 ttmm -60.74 -44.68 96.37 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.496 -179.405 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 53.6 tttm -73.77 -30.09 62.57 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.83 -179.371 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 160' ' ' MET . . . . . . . . . . . . . 12.0 mtp -67.49 -54.05 23.48 Favored 'General case' 0 C--O 1.221 -0.436 0 C-N-CA 120.508 -0.477 . . . . 0.0 110.174 -178.976 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 80.8 mtp180 -61.99 -31.75 72.15 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.394 179.922 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -58.4 -46.34 86.59 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.222 -179.269 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 163' ' ' LYS . . . . . . . . . . . . . 54.0 tttp -65.08 -52.28 56.52 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 120.357 -0.537 . . . . 0.0 110.78 -179.064 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -51.98 -36.08 48.54 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.998 0.427 . . . . 0.0 110.285 -179.071 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 165' ' ' GLN . . . . . 0.412 ' O ' ' OG1' ' A' ' 169' ' ' THR . 57.6 tt0 -62.09 -40.04 94.48 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.325 179.896 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 20.3 mmt85 -65.89 -34.66 78.65 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.453 0.644 . . . . 0.0 111.434 -179.585 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 167' ' ' VAL . . . . . . . . . . . . . 38.6 t -66.76 -47.44 82.93 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.769 0 CA-C-N 115.139 -0.937 . . . . 0.0 110.284 -179.53 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 42.8 t-80 -79.44 -31.11 42.5 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.519 -179.471 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 169' ' ' THR . . . . . 0.412 ' OG1' ' O ' ' A' ' 165' ' ' GLN . 90.2 m -71.64 -44.43 64.35 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.126 -179.828 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 59.8 mmtt -62.01 -41.76 98.43 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.99 0.424 . . . . 0.0 110.733 -179.021 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 171' ' ' ASN . . . . . . . . . . . . . 10.3 m120 -68.63 -34.92 76.57 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.628 179.473 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 172' ' ' TYR . . . . . 0.466 ' CZ ' ' NZ ' ' A' ' 176' ' ' LYS . 86.8 t80 -63.85 -40.46 96.64 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.115 -179.524 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 7.2 t -76.11 -46.85 26.83 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.783 -178.679 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 24.5 p -58.2 -47.83 82.23 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.078 -178.808 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -64.1 -35.14 79.78 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-O 120.808 0.337 . . . . 0.0 110.721 -179.911 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 176' ' ' LYS . . . . . 0.466 ' NZ ' ' CZ ' ' A' ' 172' ' ' TYR . 14.2 tptt -54.71 -19.3 5.93 Favored 'General case' 0 C--N 1.313 -1.003 0 C-N-CA 120.274 -0.57 . . . . 0.0 110.461 -179.158 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 177' ' ' LYS . . . . . . . . . . . . . 61.0 tttm -68.98 -39.77 79.21 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 121.712 0.768 . . . . 0.0 111.368 179.846 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 178' ' ' LYS . . . . . . . . . . . . . 20.0 mtpp -80.7 -23.34 39.61 Favored 'General case' 0 C--N 1.31 -1.138 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.024 -178.721 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 80.7 mm-40 -59.7 -50.97 71.77 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 120.181 -0.608 . . . . 0.0 110.502 -178.753 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 180' ' ' ASN . . . . . 0.536 ' C ' ' H ' ' A' ' 182' ' ' THR . 54.1 p30 -147.16 -13.13 0.41 Allowed 'General case' 0 CA--C 1.516 -0.362 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.281 -179.872 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 3.6 p 70.35 -16.39 0.31 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.839 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 182' ' ' THR . . . . . 0.536 ' H ' ' C ' ' A' ' 180' ' ' ASN . 71.5 p -83.01 86.46 6.99 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-O 120.877 0.37 . . . . 0.0 110.27 -179.856 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 183' ' ' PHE . . . . . 0.411 ' CZ ' ' OE1' ' A' ' 186' ' ' GLU . 72.0 t80 -167.41 -16.57 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.52 -179.874 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 1.5 t -49.91 -16.63 0.29 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.989 0.423 . . . . 0.0 110.686 -179.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 185' ' ' ASP . . . . . . . . . . . . . 89.5 m-20 -60.8 -43.74 97.75 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.314 -179.915 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 186' ' ' GLU . . . . . 0.411 ' OE1' ' CZ ' ' A' ' 183' ' ' PHE . 70.7 mt-10 -79.08 147.8 32.65 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.32 -179.739 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 16.9 mmmt -66.68 116.91 8.12 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.575 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 188' ' ' CYS . . . . . . . . . . . . . 12.9 t -171.13 -5.34 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.573 179.868 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 189' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -66.96 -34.41 77.7 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.627 -179.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 190' ' ' ASN . . . . . . . . . . . . . 36.1 m120 53.86 -108.31 0.42 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.495 -179.471 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 191' ' ' ASN . . . . . . . . . . . . . 21.2 m120 . . . . . 0 C--O 1.221 -0.43 0 CA-C-O 117.932 -1.032 . . . . 0.0 110.772 179.971 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 33.5 t . . . . . 0 N--CA 1.49 1.531 0 N-CA-C 109.368 -0.604 . . . . 0.0 109.368 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -65.98 -36.15 82.52 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.689 179.872 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -65.16 174.69 15.76 Favored Glycine 0 CA--C 1.525 0.661 0 N-CA-C 110.906 -0.878 . . . . 0.0 110.906 -179.767 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.2 mp -70.71 165.21 23.48 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.82 0.343 . . . . 0.0 110.855 -179.711 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' THR . . . . . 0.523 ' OG1' ' N ' ' A' ' 29' ' ' GLY . 1.4 t -174.34 -173.33 0.76 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.432 -179.589 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . 0.601 ' C ' ' H ' ' A' ' 31' ' ' THR . . . 74.22 40.69 40.92 Favored Glycine 0 CA--C 1.519 0.319 0 N-CA-C 110.833 -0.907 . . . . 0.0 110.833 179.715 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . 68.48 -20.3 0.15 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.796 0.331 . . . . 0.0 110.583 -179.495 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.601 ' H ' ' C ' ' A' ' 29' ' ' GLY . 24.7 m -64.63 -30.29 71.3 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.351 -179.969 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 63.9 tttp -68.48 -50.7 50.44 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.807 179.973 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 65.0 mt -60.38 -42.48 91.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.361 -179.196 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 -56.35 -42.64 78.08 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.75 -179.517 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 26.8 mt -68.97 -34.18 74.9 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.55 0.214 . . . . 0.0 111.319 -179.147 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -64.93 -52.76 54.61 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.868 -179.43 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 50.3 ptt85 -71.81 -39.71 69.65 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.882 0.372 . . . . 0.0 110.799 -179.625 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 39.4 t -64.85 -39.25 93.27 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.965 -179.595 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -76.53 -34.0 58.56 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.1 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 64.8 tttm -66.36 -33.01 74.77 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.905 -179.623 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 39.7 m-20 -67.35 -27.04 66.8 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.821 -179.307 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 52.8 mt -61.47 -50.19 81.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 C-N-CA 120.885 -0.326 . . . . 0.0 110.846 -179.08 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 68.4 p -73.73 -36.5 65.2 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.801 0.334 . . . . 0.0 111.46 -178.294 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 85.7 m-20 -66.2 -35.09 79.54 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.561 -178.306 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 68.8 mm-40 -74.4 -57.77 3.73 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.933 0.397 . . . . 0.0 111.513 -178.935 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 6.7 pt -58.56 -23.14 22.12 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.637 -178.92 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -62.94 -39.24 94.01 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.072 0.463 . . . . 0.0 110.502 179.459 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -55.24 -22.5 18.33 Favored 'General case' 0 C--N 1.319 -0.728 0 C-N-CA 120.669 -0.412 . . . . 0.0 110.676 -179.924 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 81.4 mt -60.25 -52.72 58.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.462 -178.549 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 5.1 ptmm? -65.85 -30.92 71.61 Favored 'General case' 0 C--N 1.324 -0.542 0 C-N-CA 120.693 -0.403 . . . . 0.0 110.366 -179.167 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 37.7 ttmt -63.83 -47.72 79.69 Favored 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 120.756 -0.378 . . . . 0.0 110.227 179.859 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 95.1 m-20 -65.47 -33.3 75.6 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.17 179.816 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . 0.427 ' O ' ' O ' ' A' ' 56' ' ' LYS . . . -64.01 -28.39 69.77 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.835 179.957 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -60.05 -32.51 70.99 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.891 -179.673 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 55.0 mt -56.84 -44.5 82.18 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.438 -179.216 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.427 ' O ' ' O ' ' A' ' 53' ' ' ALA . 74.2 mmtt -109.42 143.16 39.38 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-O 121.041 0.448 . . . . 0.0 110.501 -179.83 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -74.91 90.73 0.78 Allowed Glycine 0 CA--C 1.519 0.338 0 N-CA-C 110.447 -1.061 . . . . 0.0 110.447 -179.637 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 51.1 t -133.58 135.68 55.43 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.448 0 CA-C-O 120.823 0.344 . . . . 0.0 110.551 -179.861 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 19.9 p-10 -71.2 84.36 0.75 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.134 179.741 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 76.8 t80 -60.88 -47.92 84.17 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.741 -179.561 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 66.5 t0 -100.48 99.21 9.79 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.625 -179.839 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.5 ' O ' ' C ' ' A' ' 63' ' ' PHE . . . -150.37 -15.07 0.24 Allowed 'General case' 0 CA--C 1.512 -0.515 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.665 179.986 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . 0.5 ' C ' ' O ' ' A' ' 62' ' ' ALA . 89.3 m-85 -18.99 95.05 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.827 0 O-C-N 124.169 0.918 . . . . 0.0 111.158 -179.792 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 53.2 tptt -65.55 -81.84 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.739 -178.161 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 65.0 m-20 -156.05 -99.38 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.465 -179.583 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 13.9 mptt -68.36 135.95 52.61 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.899 0.381 . . . . 0.0 110.07 -179.447 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.452 ' O ' ' C ' ' A' ' 68' ' ' THR . 19.2 mmtp -91.79 -18.05 24.43 Favored 'General case' 0 CA--C 1.507 -0.695 0 CA-C-N 115.833 -0.622 . . . . 0.0 110.836 -179.85 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' THR . . . . . 0.452 ' C ' ' O ' ' A' ' 67' ' ' LYS . 0.8 OUTLIER 28.11 58.86 0.11 Allowed 'General case' 0 N--CA 1.469 0.488 0 O-C-N 123.943 0.777 . . . . 0.0 110.91 179.819 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 108.71 176.65 21.73 Favored Glycine 0 N--CA 1.467 0.728 0 N-CA-C 110.342 -1.103 . . . . 0.0 110.342 -178.557 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' SER . . . . . 0.417 ' O ' ' OG1' ' A' ' 174' ' ' THR . 91.9 p -160.05 90.01 0.89 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.726 0.298 . . . . 0.0 110.509 -179.941 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -172.34 -55.51 0.04 OUTLIER Glycine 0 CA--C 1.522 0.496 0 N-CA-C 110.655 -0.978 . . . . 0.0 110.655 179.466 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.429 ' O ' ' OG ' ' A' ' 73' ' ' SER . 6.4 m -145.6 109.74 0.96 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.44 0 CA-C-O 121.029 0.442 . . . . 0.0 110.625 -179.533 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' SER . . . . . 0.429 ' OG ' ' O ' ' A' ' 72' ' ' VAL . 1.9 m 172.88 -57.32 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.151 0.5 . . . . 0.0 110.085 179.553 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 99.6 mt-10 -88.37 -51.18 5.88 Favored 'General case' 0 CA--C 1.508 -0.651 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.244 -179.197 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . 0.428 ' O ' ' N ' ' A' ' 77' ' ' PHE . 2.0 p30 163.54 98.38 0.01 OUTLIER Pre-proline 0 CA--C 1.541 0.623 0 N-CA-C 109.41 -0.589 . . . . 0.0 109.41 -179.506 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 77.0 Cg_exo -43.79 -19.94 0.23 Allowed 'Trans proline' 0 N--CA 1.496 1.659 0 C-N-CA 122.505 2.137 . . . . 0.0 112.226 -179.46 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . 0.428 ' N ' ' O ' ' A' ' 75' ' ' ASN . 58.0 t80 -62.26 -52.78 62.36 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.632 -0.427 . . . . 0.0 110.711 -179.872 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 94.4 mt -69.35 -46.16 77.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.427 179.819 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.479 ' O ' ' ND2' ' A' ' 171' ' ' ASN . 39.9 mt -55.57 -51.63 66.45 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.095 -178.442 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 95.6 mt-10 -63.49 -36.0 82.32 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.191 179.475 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -64.46 -40.43 95.7 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.499 179.967 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 33.9 ttmt -54.88 -19.37 6.45 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.088 0.471 . . . . 0.0 110.528 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 5.6 t -79.43 -44.65 23.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.818 179.943 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 84.7 mtp180 -62.96 -31.4 72.49 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.413 -179.672 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -67.32 -42.77 83.07 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.91 0.386 . . . . 0.0 111.274 -179.341 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 38.3 p -67.77 -21.51 65.25 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.245 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 24.5 m -59.0 -54.03 51.75 Favored 'General case' 0 C--N 1.323 -0.571 0 C-N-CA 120.506 -0.478 . . . . 0.0 111.027 -179.051 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 45.2 t -73.13 -49.18 40.12 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-O 121.057 0.456 . . . . 0.0 111.3 -179.445 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -57.18 -43.15 82.37 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.672 -178.896 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 7.1 tm-20 -56.28 -47.83 77.83 Favored 'General case' 0 C--N 1.317 -0.84 0 C-N-CA 120.404 -0.518 . . . . 0.0 110.718 -179.613 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 70.0 mmtt -59.0 -36.75 75.43 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.895 -178.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 87.7 t80 -56.99 -38.88 73.67 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.506 -179.926 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 49.0 t -58.03 -41.93 81.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-O 120.926 0.393 . . . . 0.0 110.173 -179.02 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 64.3 mt -54.51 -39.91 47.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.327 179.944 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -53.3 -45.32 68.93 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.631 -179.762 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . 0.445 ' CD1' ' N ' ' A' ' 96' ' ' ILE . 1.6 mp -60.63 -44.37 96.76 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 116.311 -0.404 . . . . 0.0 109.986 -179.586 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 14.1 tm-20 -64.43 -49.36 71.81 Favored 'General case' 0 C--N 1.32 -0.71 0 C-N-CA 120.576 -0.45 . . . . 0.0 110.649 -178.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 83.0 tt0 -63.15 -46.48 86.99 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.58 -179.166 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 79.3 mm-40 -65.86 -35.13 79.81 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.743 -179.794 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -60.68 -41.63 95.49 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.57 -179.853 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 33.0 m -63.32 -49.07 75.43 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.643 -179.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 35.3 ttmt -69.32 -19.67 63.88 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.508 -179.924 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . 0.481 ' O ' ' N ' ' A' ' 105' ' ' GLU . 41.1 tp -81.91 -16.72 49.62 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.433 -179.402 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 15.3 ttmm -66.25 62.7 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.815 0.34 . . . . 0.0 110.912 -179.088 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . 0.481 ' N ' ' O ' ' A' ' 103' ' ' LEU . 80.0 tt0 -113.12 -70.12 0.82 Allowed 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.676 -0.49 . . . . 0.0 109.676 179.926 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -89.88 -33.84 16.3 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.126 179.594 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 59.66 50.2 70.31 Favored Glycine 0 CA--C 1.526 0.764 0 N-CA-C 111.12 -0.792 . . . . 0.0 111.12 179.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' SER . . . . . 0.432 ' OG ' ' N ' ' A' ' 109' ' ' SER . 95.5 p -56.63 -109.07 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.818 0.342 . . . . 0.0 110.516 -179.912 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' SER . . . . . 0.432 ' N ' ' OG ' ' A' ' 108' ' ' SER . 54.4 p -171.39 -60.06 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.816 0.341 . . . . 0.0 110.507 179.839 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -62.55 -31.38 79.58 Favored Glycine 0 CA--C 1.521 0.425 0 N-CA-C 110.876 -0.89 . . . . 0.0 110.876 -179.961 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 44.9 tp10 -53.72 -45.61 70.52 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.864 0.364 . . . . 0.0 110.368 -179.544 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 65.1 m-85 -65.23 -41.17 94.65 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.575 -179.869 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 6.1 t -57.17 -33.28 67.27 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.499 -179.725 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -61.9 -35.89 79.69 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.452 -179.92 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 28.9 tpp -66.4 -47.65 72.61 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.958 0.409 . . . . 0.0 110.91 -179.871 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 37.1 t80 -51.12 -32.17 21.82 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.548 -179.542 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 63.6 t0 -60.05 -44.71 94.5 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.756 -179.889 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 10.8 mp -58.33 -39.21 78.84 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.289 -0.414 . . . . 0.0 109.922 -179.222 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 13.4 tpt -61.84 -32.29 72.61 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.365 179.941 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . 0.582 ' CZ ' ' NZ ' ' A' ' 124' ' ' LYS . 14.6 t80 -77.42 -46.01 24.01 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.353 0.597 . . . . 0.0 111.035 -179.851 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -59.91 -42.46 93.92 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.699 -178.424 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 11.1 p -74.53 -25.86 19.62 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.385 0 CA-C-O 120.942 0.401 . . . . 0.0 110.687 -179.785 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 11.5 t -65.47 -21.08 66.6 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 116.611 -0.268 . . . . 0.0 111.193 179.912 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . 0.582 ' NZ ' ' CZ ' ' A' ' 120' ' ' PHE . 5.1 mptt -71.3 -59.31 3.33 Favored Pre-proline 0 C--N 1.324 -0.511 0 N-CA-C 112.139 0.422 . . . . 0.0 112.139 -178.906 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . 0.467 ' HD2' ' N ' ' A' ' 124' ' ' LYS . 18.6 Cg_endo -56.6 -32.01 88.84 Favored 'Trans proline' 0 C--N 1.309 -1.506 0 C-N-CA 122.204 1.936 . . . . 0.0 112.106 -178.036 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 7.4 mp -60.98 -39.61 90.28 Favored 'General case' 0 CA--C 1.51 -0.57 0 CA-C-N 116.431 -0.349 . . . . 0.0 110.552 -179.839 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -44.69 -28.71 0.65 Allowed 'General case' 0 C--N 1.318 -0.791 0 CA-C-O 120.922 0.391 . . . . 0.0 110.923 179.858 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -64.99 -8.55 16.35 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.83 -179.399 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . 0.422 ' N ' ' CD2' ' A' ' 129' ' ' LEU . 4.2 mm? -102.75 -10.35 19.24 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.604 -179.663 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . 0.411 ' C ' ' H ' ' A' ' 132' ' ' GLN . . . 83.65 17.61 65.64 Favored Glycine 0 CA--C 1.52 0.381 0 N-CA-C 110.438 -1.065 . . . . 0.0 110.438 179.684 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 131' ' ' ILE . . . . . 0.531 ' O ' ' C ' ' A' ' 132' ' ' GLN . 81.4 mt -77.82 15.36 0.25 Allowed 'Isoleucine or valine' 0 CA--C 1.518 -0.27 0 N-CA-C 110.038 -0.356 . . . . 0.0 110.038 -179.835 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . 0.547 HE21 ' HZ1' ' A' ' 136' ' ' LYS . 59.1 tt0 -25.84 122.9 0.07 Allowed 'General case' 0 CA--C 1.507 -0.694 0 CA-C-O 118.941 -0.552 . . . . 0.0 109.666 179.968 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 133' ' ' GLU . . . . . 0.503 ' CB ' ' O ' ' A' ' 132' ' ' GLN . 8.6 mm-40 148.22 -21.95 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.201 0 O-C-N 124.677 1.236 . . . . 0.0 110.343 -178.858 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 24.6 mmt -62.01 -61.92 2.15 Favored 'General case' 0 C--N 1.319 -0.724 0 C-N-CA 120.849 -0.341 . . . . 0.0 111.138 -178.378 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 71.4 p -56.96 -30.38 64.02 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.834 -178.799 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 136' ' ' LYS . . . . . 0.547 ' HZ1' HE21 ' A' ' 132' ' ' GLN . 50.8 mtmt -82.69 -52.81 6.44 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.347 -179.745 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 137' ' ' THR . . . . . 0.42 ' CG2' ' NZ ' ' A' ' 159' ' ' LYS . 30.2 m -60.57 -46.12 91.41 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.857 -179.023 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 138' ' ' VAL . . . . . 0.424 ' CG1' ' N ' ' A' ' 139' ' ' SER . 9.0 p -61.4 -40.61 86.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-O 121.051 0.453 . . . . 0.0 110.68 -178.92 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 139' ' ' SER . . . . . 0.424 ' N ' ' CG1' ' A' ' 138' ' ' VAL . 23.7 t -72.5 -36.37 68.36 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.648 -179.841 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 84.7 m-20 -64.74 -30.18 71.18 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.64 -179.589 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -74.97 -28.23 60.49 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.81 -179.924 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -64.57 -34.09 77.44 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.114 -179.283 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 94.9 mt-10 -70.8 -36.91 73.22 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.743 0.306 . . . . 0.0 110.834 -179.422 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 47.6 tp10 -74.05 -43.49 57.64 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.012 -179.475 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 145' ' ' ASN . . . . . . . . . . . . . 70.3 m-80 -144.28 82.68 10.53 Favored Pre-proline 0 N--CA 1.466 0.349 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.197 -179.53 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 146' ' ' PRO . . . . . 0.456 ' O ' ' N ' ' A' ' 148' ' ' THR . 24.4 Cg_endo -61.02 113.05 1.56 Allowed 'Trans proline' 0 N--CA 1.493 1.446 0 C-N-CA 122.394 2.063 . . . . 0.0 111.694 -178.846 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 147' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_exo -45.79 87.61 0.02 OUTLIER 'Trans proline' 0 N--CA 1.493 1.489 0 C-N-CA 122.397 2.065 . . . . 0.0 112.786 -179.364 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 148' ' ' THR . . . . . 0.456 ' N ' ' O ' ' A' ' 146' ' ' PRO . 31.2 m -111.56 -15.43 13.5 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.335 179.284 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 149' ' ' THR . . . . . 0.478 ' CG2' ' H ' ' A' ' 150' ' ' ALA . 30.8 m -138.8 172.27 13.11 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.639 179.845 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 150' ' ' ALA . . . . . 0.478 ' H ' ' CG2' ' A' ' 149' ' ' THR . . . -58.88 -47.72 83.95 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.304 179.986 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 76.4 mt-30 -62.76 -29.61 70.82 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.021 0.439 . . . . 0.0 110.394 -179.851 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . -58.38 -42.28 95.59 Favored Glycine 0 CA--C 1.524 0.6 0 N-CA-C 110.691 -0.964 . . . . 0.0 110.691 179.792 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 153' ' ' VAL . . . . . . . . . . . . . 47.3 t -67.67 -41.48 85.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-O 120.834 0.349 . . . . 0.0 110.505 -179.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 8.4 mp -50.95 -38.51 51.02 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.256 -179.374 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -60.96 -47.57 85.83 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 179.12 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 15.3 mm -65.36 -43.57 94.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.034 -179.777 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -53.03 -51.46 61.66 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.247 179.923 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -62.58 -43.99 97.42 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.164 179.495 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 159' ' ' LYS . . . . . 0.42 ' NZ ' ' CG2' ' A' ' 137' ' ' THR . 63.2 tttm -65.11 -29.77 70.66 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.371 179.945 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 160' ' ' MET . . . . . . . . . . . . . 5.4 mtp -71.01 -53.27 15.36 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.48 -179.49 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 73.5 ttt-85 -67.8 -35.65 79.03 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.473 179.847 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 80.1 tt0 -66.97 -47.87 70.25 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.817 -179.08 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 163' ' ' LYS . . . . . . . . . . . . . 1.2 tmtp? -65.97 -33.97 77.02 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.18 -179.394 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 5.8 mt -70.28 -26.61 63.89 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.657 179.942 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 46.5 tp60 -67.21 -35.73 80.22 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.472 -179.155 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 166' ' ' ARG . . . . . 0.519 HH22 ' ND2' ' A' ' 190' ' ' ASN . 10.7 tpt180 -62.49 -28.49 69.86 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.37 0.605 . . . . 0.0 110.575 -179.187 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 167' ' ' VAL . . . . . . . . . . . . . 48.3 t -68.18 -44.01 84.52 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 CA-C-N 115.242 -0.89 . . . . 0.0 110.39 -179.708 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 168' ' ' HIS . . . . . 0.503 ' O ' ' ND1' ' A' ' 168' ' ' HIS . 20.6 t-80 -78.15 -28.83 48.44 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.636 -179.967 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 169' ' ' THR . . . . . . . . . . . . . 23.7 m -73.2 -46.68 49.06 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.301 -0.408 . . . . 0.0 111.156 -179.697 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -58.83 -43.86 90.79 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.555 -179.077 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 171' ' ' ASN . . . . . 0.479 ' ND2' ' O ' ' A' ' 79' ' ' LEU . 20.1 t-20 -72.03 -33.11 67.76 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.62 179.916 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 172' ' ' TYR . . . . . . . . . . . . . 80.7 t80 -75.18 -29.33 60.36 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.786 -179.629 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 11.5 t -74.35 -34.55 63.42 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.046 -179.511 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 174' ' ' THR . . . . . 0.417 ' OG1' ' O ' ' A' ' 70' ' ' SER . 26.2 p -73.04 -35.68 66.77 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.967 -179.268 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 87.0 mt -77.72 -53.1 7.93 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.521 -178.843 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 16.2 ptmt -56.24 -21.72 25.28 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 121.183 0.516 . . . . 0.0 110.37 -179.265 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 177' ' ' LYS . . . . . . . . . . . . . 56.2 tttp -66.38 -13.67 60.98 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.236 -179.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 178' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -81.23 -15.31 56.0 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.857 -179.922 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -55.37 -44.36 75.95 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.505 -179.89 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 180' ' ' ASN . . . . . . . . . . . . . 13.4 m120 -99.18 -84.64 0.4 Allowed 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.095 179.373 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 181' ' ' SER . . . . . 0.524 ' OG ' ' N ' ' A' ' 182' ' ' THR . 2.4 t 171.9 -101.55 0.0 OUTLIER 'General case' 0 C--N 1.333 -0.132 0 N-CA-C 109.974 -0.38 . . . . 0.0 109.974 179.846 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 182' ' ' THR . . . . . 0.524 ' N ' ' OG ' ' A' ' 181' ' ' SER . 68.2 p -150.03 39.43 0.77 Allowed 'General case' 0 N--CA 1.462 0.159 0 CA-C-O 120.868 0.366 . . . . 0.0 110.399 -179.486 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 183' ' ' PHE . . . . . 0.485 ' CD1' ' N ' ' A' ' 184' ' ' THR . 23.0 t80 -55.32 152.99 7.66 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.285 -179.746 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 184' ' ' THR . . . . . 0.485 ' N ' ' CD1' ' A' ' 183' ' ' PHE . 5.6 m -70.46 60.48 0.21 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.713 -179.8 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 185' ' ' ASP . . . . . . . . . . . . . 59.2 m-20 -159.21 -66.21 0.08 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.943 0.401 . . . . 0.0 110.394 179.985 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 186' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -65.14 122.48 17.18 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.59 -179.716 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 7.0 mtpm? -144.91 11.62 1.4 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.497 179.877 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 188' ' ' CYS . . . . . . . . . . . . . 12.0 t 56.05 37.3 28.7 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.567 179.793 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 189' ' ' LYS . . . . . . . . . . . . . 63.5 tttm -69.08 136.31 52.11 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.405 -179.843 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 190' ' ' ASN . . . . . 0.519 ' ND2' HH22 ' A' ' 166' ' ' ARG . 22.1 t-20 -68.07 140.88 56.27 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.553 179.899 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 191' ' ' ASN . . . . . . . . . . . . . 90.5 m-20 . . . . . 0 C--O 1.22 -0.471 0 CA-C-O 117.979 -1.01 . . . . 0.0 110.512 -179.973 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.226 -0.166 0 CA-C-O 120.667 0.27 . . . . 0.0 110.441 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 9.9 m -61.84 -36.3 80.78 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.844 -179.683 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 23.4 tptm -65.11 -57.27 9.04 Favored 'General case' 0 N--CA 1.447 -0.578 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.079 -179.709 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 22.1 pt -62.39 -28.64 45.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.331 -179.578 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 78.8 ttt180 -65.35 -42.27 93.0 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.161 0.505 . . . . 0.0 110.497 179.798 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 17.0 mt -71.89 -32.86 67.85 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.065 -179.9 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 37.7 tp10 -62.48 -51.07 68.91 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.88 -179.551 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 89.3 mtm180 -67.37 -40.62 85.74 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.508 -179.507 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 26.8 t -67.83 -25.21 65.45 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.714 -179.751 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -75.66 -40.3 56.24 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.728 179.681 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -58.41 -39.66 80.34 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.817 -179.595 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 20.1 m-20 -58.14 -22.05 49.47 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 121.059 0.457 . . . . 0.0 110.766 -179.389 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 8.9 mm -64.79 -56.15 17.41 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.953 0 N-CA-C 112.244 0.461 . . . . 0.0 112.244 -178.865 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 52.5 p -76.34 -36.03 58.45 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.559 -179.878 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 95.8 m-20 -64.56 -35.14 80.02 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.688 -177.623 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 56.4 mm-40 -73.25 -57.82 3.75 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.745 -179.588 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.57 HG22 ' HA ' ' A' ' 85' ' ' ALA . 16.0 pt -60.03 -26.94 37.56 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.755 0 O-C-N 123.428 0.455 . . . . 0.0 110.879 -179.37 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 65.3 m-20 -66.54 -38.53 87.35 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.365 -179.567 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -53.9 -27.47 30.7 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.209 -179.288 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 66.3 mt -62.49 -47.47 92.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.118 179.689 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 63.8 mttp -58.76 -39.54 81.28 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.101 -179.465 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 71.6 mmtt -64.85 -44.22 90.48 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.558 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -67.12 -35.49 79.87 Favored 'General case' 0 C--O 1.224 -0.268 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.48 179.822 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -63.69 -29.02 70.3 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.673 -179.844 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -58.66 -35.28 72.31 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.792 -179.526 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.504 HD12 ' N ' ' A' ' 55' ' ' LEU . 10.0 mp . . . . . 0 C--N 1.325 -0.464 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.511 -178.521 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' ASN . . . . . 0.592 HD22 ' N ' ' A' ' 75' ' ' ASN . 0.0 OUTLIER . . . . . 0 C--O 1.236 0.386 0 N-CA-C 111.103 0.038 . . . . 0.0 111.103 . . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_exo -51.05 0.03 0.04 OUTLIER 'Trans proline' 0 C--N 1.312 -1.374 0 C-N-CA 122.611 2.207 . . . . 0.0 111.856 -178.572 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' PHE . . . . . 0.578 ' H ' ' C ' ' A' ' 75' ' ' ASN . 67.8 t80 -61.03 -49.46 77.33 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 116.561 -0.29 . . . . 0.0 110.709 -179.542 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 66.3 mt -64.17 -51.95 62.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.368 -179.854 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.523 ' N ' HD12 ' A' ' 79' ' ' LEU . 10.5 mp -56.52 -53.23 59.93 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.171 -178.616 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 94.9 mt-10 -62.68 -38.92 92.28 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 123.334 0.396 . . . . 0.0 110.221 179.911 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -63.39 -41.47 98.76 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.364 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 35.9 ttmt -52.53 -18.58 1.77 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 121.19 0.519 . . . . 0.0 110.776 -179.597 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 25.4 t -85.51 -48.38 16.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.485 179.722 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 84.4 mtt85 -64.97 -30.27 71.25 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.46 -179.585 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 85' ' ' ALA . . . . . 0.57 ' HA ' HG22 ' A' ' 46' ' ' ILE . . . -70.39 -45.75 65.38 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.748 -179.497 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 86' ' ' THR . . . . . 0.415 ' CB ' HG21 ' A' ' 167' ' ' VAL . 74.2 p -77.6 -11.97 59.92 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.458 -179.163 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 85.6 m -60.34 -52.1 66.68 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.129 -178.736 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.449 HG13 ' N ' ' A' ' 89' ' ' ALA . 11.7 p -69.8 -39.55 77.98 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.77 -179.407 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 89' ' ' ALA . . . . . 0.449 ' N ' HG13 ' A' ' 88' ' ' VAL . . . -61.97 -39.17 91.24 Favored 'General case' 0 C--O 1.223 -0.341 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.107 -178.695 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 38.4 tp10 -50.23 -54.96 17.42 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.852 -179.807 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 9.2 mtmp? -52.58 -34.89 52.59 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.69 -179.504 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.432 ' O ' ' HB3' ' A' ' 95' ' ' ALA . 43.4 t80 -59.17 -43.59 92.15 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.725 -179.248 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 90.6 t -56.76 -47.71 82.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.453 -178.696 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 67.0 mt -53.42 -38.0 31.29 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.104 -179.904 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 95' ' ' ALA . . . . . 0.432 ' HB3' ' O ' ' A' ' 92' ' ' PHE . . . -52.58 -43.38 65.24 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.458 -179.491 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 96' ' ' ILE . . . . . 0.546 ' N ' HD12 ' A' ' 96' ' ' ILE . 1.7 mp -62.16 -44.86 99.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.417 -179.955 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 7.7 tm-20 -61.39 -50.07 74.33 Favored 'General case' 0 C--N 1.323 -0.56 0 O-C-N 123.442 0.464 . . . . 0.0 110.214 -178.616 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 78.4 tt0 -66.06 -39.72 90.32 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.34 -179.47 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 80.2 tt0 -67.54 -32.79 73.82 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.562 -179.676 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -57.49 -40.17 78.03 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.518 -179.496 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 20.2 m -61.69 -47.62 84.49 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.54 179.871 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 64.1 mttp -74.69 -24.64 58.81 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.376 -179.724 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 37.4 tp . . . . . 0 CA--C 1.508 -0.638 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.933 -179.739 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 80.7 p . . . . . 0 C--O 1.232 0.155 0 CA-C-O 120.702 0.287 . . . . 0.0 110.86 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -61.66 -45.45 96.26 Favored Glycine 0 CA--C 1.522 0.505 0 N-CA-C 111.191 -0.764 . . . . 0.0 111.191 -179.826 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 10.5 mm-40 -70.56 -44.05 68.24 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.708 0.29 . . . . 0.0 110.709 -179.646 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 61.5 m-85 -65.52 -36.61 84.34 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.536 -179.938 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 55.1 m -53.87 -33.95 57.97 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.385 179.813 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -65.57 -28.43 69.14 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.416 179.693 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 63.0 mmm -73.78 -41.96 61.69 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.876 -179.792 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 33.6 t80 -64.99 -34.54 78.69 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.439 179.911 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 45.4 t0 -56.67 -46.52 81.08 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.169 -179.346 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 83.6 mt -55.42 -39.01 69.72 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.519 179.761 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 119' ' ' MET . . . . . 0.434 ' C ' ' SD ' ' A' ' 119' ' ' MET . 0.0 OUTLIER -60.63 -53.98 50.86 Favored 'General case' 0 C--N 1.318 -0.769 0 O-C-N 123.544 0.527 . . . . 0.0 110.393 -179.831 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 67.1 t80 -60.77 -47.5 86.02 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.901 -178.76 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 78.9 mm-40 -56.56 -39.74 73.97 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.818 -179.726 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 69.7 t -81.19 -23.69 10.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.582 179.785 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 53.2 p -70.84 -23.0 62.26 Favored 'General case' 0 C--N 1.309 -1.171 0 CA-C-N 116.572 -0.285 . . . . 0.0 110.928 -179.783 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 124' ' ' LYS . . . . . 0.49 ' CB ' ' HD3' ' A' ' 125' ' ' PRO . 16.8 mtmt -72.04 -56.55 4.43 Favored Pre-proline 0 C--N 1.329 -0.297 0 C-N-CA 120.755 -0.378 . . . . 0.0 111.445 -178.71 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 125' ' ' PRO . . . . . 0.49 ' HD3' ' CB ' ' A' ' 124' ' ' LYS . 54.0 Cg_exo -49.22 -44.98 31.68 Favored 'Trans proline' 0 C--N 1.304 -1.787 0 C-N-CA 122.351 2.034 . . . . 0.0 112.172 178.237 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.486 HD22 ' N ' ' A' ' 126' ' ' LEU . 4.3 mm? -70.38 -21.92 62.81 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.24 179.764 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 4.7 tm0? -63.31 -47.37 82.55 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.746 -179.672 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 99.7 mttt -53.58 -44.73 69.58 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 -178.461 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.525 HD23 ' O ' ' A' ' 129' ' ' LEU . 1.1 tt -63.72 -45.08 91.55 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 121.295 0.569 . . . . 0.0 110.556 179.566 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 99.2 90.54 2.01 Favored Glycine 0 N--CA 1.462 0.428 0 N-CA-C 110.815 -0.914 . . . . 0.0 110.815 -179.865 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 131' ' ' ILE . . . . . 0.4 ' O ' ' CG ' ' A' ' 132' ' ' GLN . 47.3 mm -105.81 -71.56 0.7 Allowed 'Isoleucine or valine' 0 CA--C 1.507 -0.699 0 N-CA-C 111.5 0.185 . . . . 0.0 111.5 179.391 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 132' ' ' GLN . . . . . 0.4 ' CG ' ' O ' ' A' ' 131' ' ' ILE . 56.7 mt-30 -159.75 -166.93 1.86 Allowed 'General case' 0 C--N 1.327 -0.393 0 O-C-N 123.511 0.507 . . . . 0.0 110.821 -179.898 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 92.8 mt-10 -88.09 44.44 1.2 Allowed 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 116.184 -0.462 . . . . 0.0 109.81 179.895 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 44.6 tpp -59.21 -58.91 6.54 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.157 -178.833 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 23.3 p -46.42 -26.79 0.91 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.522 -179.14 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 62.4 mttp -90.56 -45.12 9.12 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.007 178.955 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 75.7 m -61.17 -43.56 98.68 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.73 -178.964 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 138' ' ' VAL . . . . . 0.453 HG13 ' N ' ' A' ' 139' ' ' SER . 9.8 p -65.55 -40.88 89.46 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.74 -179.156 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 139' ' ' SER . . . . . 0.453 ' N ' HG13 ' A' ' 138' ' ' VAL . 34.2 t -75.48 -34.09 60.86 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.2 -179.278 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 64.6 t0 -64.11 -28.55 69.85 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.322 0.582 . . . . 0.0 110.642 -179.762 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -73.11 -24.91 60.68 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.945 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -59.58 -33.39 71.38 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.015 0.436 . . . . 0.0 111.0 -179.032 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 143' ' ' GLU . . . . . 0.413 ' OE1' ' N ' ' A' ' 143' ' ' GLU . 38.3 mp0 -73.08 -36.34 66.81 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.5 -0.318 . . . . 0.0 111.201 179.818 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 144' ' ' GLU . . . . . 0.439 ' O ' ' ND2' ' A' ' 145' ' ' ASN . 44.6 tp10 -64.52 -48.11 76.33 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.581 -179.699 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 145' ' ' ASN . . . . . 0.439 ' ND2' ' O ' ' A' ' 144' ' ' GLU . 31.3 m120 -148.47 77.17 9.78 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.228 -179.457 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 146' ' ' PRO . . . . . . . . . . . . . 86.8 Cg_exo -42.79 105.41 0.06 OUTLIER 'Trans proline' 0 N--CA 1.483 0.86 0 C-N-CA 122.923 2.415 . . . . 0.0 112.096 -179.781 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 147' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_exo -45.26 101.66 0.04 OUTLIER 'Trans proline' 0 C--N 1.312 -1.36 0 C-N-CA 122.375 2.05 . . . . 0.0 112.556 -179.251 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 53.4 m -120.17 -13.6 8.92 Favored 'General case' 0 CA--C 1.515 -0.379 0 CA-C-O 120.928 0.394 . . . . 0.0 110.409 179.504 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 149' ' ' THR . . . . . 0.659 HG22 ' N ' ' A' ' 150' ' ' ALA . 50.1 m -136.99 171.19 14.88 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.961 0.41 . . . . 0.0 110.621 179.801 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 150' ' ' ALA . . . . . 0.659 ' N ' HG22 ' A' ' 149' ' ' THR . . . -58.43 -40.39 82.4 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.789 179.798 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 76.1 mt-30 -66.76 -24.52 66.22 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.938 0.399 . . . . 0.0 110.831 179.804 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . -67.33 -40.27 91.82 Favored Glycine 0 CA--C 1.525 0.674 0 N-CA-C 111.155 -0.778 . . . . 0.0 111.155 -179.828 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 153' ' ' VAL . . . . . . . . . . . . . 54.3 t -68.54 -32.26 54.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-O 120.724 0.297 . . . . 0.0 110.636 -179.71 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 7.4 mp -56.56 -36.38 69.23 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.508 -179.955 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -60.11 -53.48 57.26 Favored 'General case' 0 C--N 1.321 -0.633 0 O-C-N 123.607 0.567 . . . . 0.0 109.863 -179.876 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 156' ' ' ILE . . . . . 0.591 HD12 ' N ' ' A' ' 156' ' ' ILE . 1.8 mp -60.38 -44.47 96.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 N-CA-C 109.91 -0.404 . . . . 0.0 109.91 -179.635 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -51.09 -51.72 50.64 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.029 -178.775 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 63.0 mttp -60.13 -41.1 91.94 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.934 0.397 . . . . 0.0 110.11 179.747 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 38.6 mmtm -64.94 -30.56 71.56 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.908 0.385 . . . . 0.0 110.763 179.503 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 160' ' ' MET . . . . . 0.406 ' O ' ' CB ' ' A' ' 164' ' ' LEU . 2.2 mtm -74.23 -53.93 8.77 Favored 'General case' 0 C--O 1.219 -0.505 0 C-N-CA 120.46 -0.496 . . . . 0.0 111.562 -179.757 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 60.8 ttp180 -62.51 -41.3 98.74 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.074 -179.105 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 68.2 mm-40 -62.82 -57.64 10.16 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.694 -179.431 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 163' ' ' LYS . . . . . . . . . . . . . 63.0 tttp -66.66 -52.97 38.9 Favored 'General case' 0 C--N 1.324 -0.52 0 O-C-N 123.5 0.5 . . . . 0.0 111.046 -179.122 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 164' ' ' LEU . . . . . 0.711 ' O ' HG22 ' A' ' 167' ' ' VAL . 53.9 tp -47.81 -37.44 13.7 Favored 'General case' 0 C--O 1.212 -0.891 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.605 -178.772 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 59.2 tt0 -68.93 -27.62 65.92 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.497 -179.662 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 57.4 ttm-85 -55.02 -22.67 16.31 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.888 -179.516 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 167' ' ' VAL . . . . . 0.711 HG22 ' O ' ' A' ' 164' ' ' LEU . 18.2 m -60.47 -42.27 90.61 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.934 0 O-C-N 124.087 0.867 . . . . 0.0 109.923 -179.526 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 168' ' ' HIS . . . . . 0.52 ' N ' HG23 ' A' ' 167' ' ' VAL . 3.5 t60 -77.38 -22.26 51.94 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.554 -179.428 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 169' ' ' THR . . . . . . . . . . . . . 23.7 m -66.35 -47.24 74.08 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.143 -179.921 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 170' ' ' LYS . . . . . 0.476 ' O ' HG23 ' A' ' 174' ' ' THR . 68.9 mttm -63.99 -47.09 81.7 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.513 -179.588 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 171' ' ' ASN . . . . . . . . . . . . . 75.3 m-20 -64.29 -39.63 94.32 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.732 179.959 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 172' ' ' TYR . . . . . . . . . . . . . 85.1 t80 -69.76 -38.6 76.82 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.93 -179.417 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 48.2 t -78.06 -42.44 32.29 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.07 -0.513 . . . . 0.0 111.054 -178.952 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 174' ' ' THR . . . . . 0.476 HG23 ' O ' ' A' ' 170' ' ' LYS . 17.4 p -59.96 -45.88 91.23 Favored 'General case' 0 C--O 1.216 -0.688 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.005 -179.293 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 76.4 mt -63.11 -31.71 72.92 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.21 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 29.9 mttt -64.35 -5.67 5.61 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.933 -179.955 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 177' ' ' LYS . . . . . . . . . . . . . 20.8 ptmt -58.81 -31.2 68.23 Favored 'General case' 0 C--N 1.318 -0.791 0 O-C-N 123.423 0.452 . . . . 0.0 110.315 -179.252 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 178' ' ' LYS . . . . . . . . . . . . . 16.7 mmmt . . . . . 0 N--CA 1.453 -0.301 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.806 -179.795 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.051 0 CA-C-O 120.588 0.232 . . . . 0.0 111.172 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 11.8 m -58.26 -45.6 87.52 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.647 -179.363 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 13.2 tppt? -63.37 -54.19 40.66 Favored 'General case' 0 N--CA 1.442 -0.871 0 C-N-CA 120.406 -0.517 . . . . 0.0 110.942 179.766 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 97.0 mt -59.79 -42.48 89.02 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 N-CA-C 109.373 -0.603 . . . . 0.0 109.373 -178.479 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 72.1 ttt-85 -61.88 -37.6 85.15 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.872 0.368 . . . . 0.0 110.745 -179.431 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 36.1 mt -67.44 -39.81 85.43 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.548 -0.296 . . . . 0.0 111.431 178.961 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 82.3 tt0 -68.3 -44.96 74.31 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.32 -179.766 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 71.7 ttt-85 -65.95 -44.16 85.82 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.357 179.927 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 15.4 m -69.74 -34.03 73.27 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.681 -179.911 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -72.01 -41.54 67.46 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.869 179.993 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -59.53 -31.33 69.3 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.527 -179.79 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 81.1 m-20 -68.15 -22.78 64.84 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.085 0.469 . . . . 0.0 110.807 -178.924 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 68.6 mt -65.89 -53.94 32.67 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.417 -179.457 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 71.0 p -76.01 -35.62 59.47 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.086 0.47 . . . . 0.0 111.274 -179.014 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 67.0 t0 -65.61 -39.97 92.11 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.745 -177.948 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 59.1 mm-40 -68.2 -51.16 48.68 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.95 -179.326 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 8.0 pt -67.68 -27.26 37.54 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.728 0 O-C-N 123.645 0.591 . . . . 0.0 110.694 -179.335 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 12.2 m-20 -62.43 -42.02 99.14 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.133 -179.892 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -52.28 -29.68 24.4 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.136 -179.179 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 57.1 mt -66.01 -43.28 92.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.239 179.363 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -56.15 -44.42 79.25 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 -179.004 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 5.9 mtpm? -64.56 -39.25 93.41 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.722 179.569 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 83.1 m-20 -58.61 -32.34 68.91 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.209 -179.099 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -67.0 -32.19 73.26 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.835 0.35 . . . . 0.0 110.657 179.481 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -57.01 -37.39 71.63 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.673 -179.239 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.531 ' N ' HD12 ' A' ' 55' ' ' LEU . 10.1 mp . . . . . 0 C--N 1.325 -0.471 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.524 -179.691 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 17.6 m120 . . . . . 0 N--CA 1.448 -0.552 0 N-CA-C 110.548 -0.167 . . . . 0.0 110.548 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 69.9 Cg_endo -75.66 -3.82 14.39 Favored 'Trans proline' 0 C--N 1.316 -1.138 0 C-N-CA 122.596 2.197 . . . . 0.0 111.916 179.757 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 69.6 t80 -68.88 -60.02 2.67 Favored 'General case' 0 C--N 1.319 -0.72 0 C-N-CA 120.784 -0.367 . . . . 0.0 111.383 -179.085 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 20.2 tt -76.06 -24.98 16.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.125 -179.001 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 3.3 mp -72.53 -55.0 7.64 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.742 -179.435 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -63.32 -27.94 69.66 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.24 -179.424 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -61.55 -31.47 71.51 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.584 -179.749 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 33.8 ttmt -63.45 -22.68 67.03 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.72 -179.53 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 31.2 t -70.6 -44.74 76.5 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.998 -179.785 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 81.5 mmt-85 -61.71 -35.83 79.18 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.937 -178.993 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -62.47 -47.9 81.96 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.237 -179.827 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 73.6 p -67.25 -27.34 67.13 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.694 -179.716 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 31.2 m -61.35 -54.21 46.67 Favored 'General case' 0 C--N 1.326 -0.436 0 C-N-CA 120.573 -0.451 . . . . 0.0 111.424 -178.709 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 46.2 t -71.51 -45.72 66.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.248 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -56.32 -39.86 73.47 Favored 'General case' 0 C--O 1.218 -0.554 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.7 -178.662 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 79.7 tt0 -55.14 -47.8 74.57 Favored 'General case' 0 C--N 1.319 -0.761 0 C-N-CA 120.842 -0.343 . . . . 0.0 110.574 -179.938 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 53.3 mtpt -53.81 -36.77 62.85 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.587 -179.07 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 73.8 t80 -60.44 -42.21 95.64 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.592 179.663 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 58.7 t -59.1 -48.42 86.81 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.517 -177.924 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 70.4 mt -54.33 -42.06 55.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.393 179.906 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -53.85 -35.02 61.05 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.419 -179.777 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 37.4 mm -62.53 -43.32 98.27 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.781 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 83.4 tt0 -61.22 -44.86 96.59 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.962 -179.469 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 4.0 mp0 -59.55 -37.74 79.22 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.71 -179.728 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 73.1 mm-40 -67.87 -39.14 83.78 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.526 -179.543 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -60.45 -33.96 73.3 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.343 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 97.2 m -62.28 -44.05 97.42 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.395 -179.821 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 65.2 mttp -67.04 -11.13 56.21 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.401 -179.351 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 61.2 mt . . . . . 0 CA--C 1.502 -0.879 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.625 -179.732 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 78.5 p . . . . . 0 C--O 1.231 0.085 0 CA-C-O 120.913 0.387 . . . . 0.0 110.756 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -64.92 -36.27 92.89 Favored Glycine 0 CA--C 1.522 0.501 0 N-CA-C 111.079 -0.808 . . . . 0.0 111.079 -179.769 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 12.5 tm-20 -62.31 -47.52 83.91 Favored 'General case' 0 C--N 1.325 -0.458 0 C-N-CA 120.784 -0.367 . . . . 0.0 110.812 -179.443 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 69.3 m-85 -65.21 -38.53 90.72 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.329 -179.386 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 67.3 m -56.42 -40.93 75.53 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.417 -179.839 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -66.09 -28.31 68.73 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.376 179.405 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 42.1 tpp -74.12 -53.66 9.44 Favored 'General case' 0 C--N 1.333 -0.15 0 C-N-CA 120.66 -0.416 . . . . 0.0 110.713 -179.145 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 41.1 t80 -51.26 -37.83 49.33 Favored 'General case' 0 N--CA 1.461 0.086 0 N-CA-C 110.1 -0.333 . . . . 0.0 110.1 -179.576 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 26.2 m-20 -61.93 -41.65 98.2 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.001 179.552 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.549 HD23 ' O ' ' A' ' 118' ' ' LEU . 1.2 tt -60.1 -41.55 92.78 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-O 120.933 0.397 . . . . 0.0 110.064 -179.636 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 119' ' ' MET . . . . . 0.542 ' SD ' ' SD ' ' A' ' 160' ' ' MET . 14.7 tpt -57.53 -47.69 81.33 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.536 -0.756 . . . . 0.0 109.503 -179.86 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 74.2 t80 -59.63 -43.51 93.8 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.432 -179.514 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 97.6 mt-10 -59.08 -35.74 73.9 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.716 -179.766 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 122' ' ' VAL . . . . . 0.636 ' O ' HD23 ' A' ' 126' ' ' LEU . 87.7 t -82.61 -24.31 8.76 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.662 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.399 -179.855 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 15.6 m -75.53 -27.94 58.9 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-O 121.078 0.466 . . . . 0.0 111.048 -179.324 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 124' ' ' LYS . . . . . 0.538 ' N ' ' HD2' ' A' ' 125' ' ' PRO . 4.0 mmtm -63.02 -58.04 18.26 Favored Pre-proline 0 C--O 1.213 -0.852 0 C-N-CA 120.563 -0.455 . . . . 0.0 112.185 -179.513 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 125' ' ' PRO . . . . . 0.538 ' HD2' ' N ' ' A' ' 124' ' ' LYS . 28.5 Cg_endo -59.8 -30.23 91.47 Favored 'Trans proline' 0 C--N 1.302 -1.893 0 C-N-CA 122.647 2.231 . . . . 0.0 112.532 -178.927 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.636 HD23 ' O ' ' A' ' 122' ' ' VAL . 3.2 mm? -60.72 -35.35 76.1 Favored 'General case' 0 C--N 1.312 -1.045 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.783 -179.635 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 127' ' ' GLN . . . . . 0.404 ' CG ' ' N ' ' A' ' 128' ' ' LYS . 8.3 pt20 -51.5 -38.15 52.61 Favored 'General case' 0 C--N 1.311 -1.108 0 O-C-N 123.825 0.703 . . . . 0.0 110.504 -179.257 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 128' ' ' LYS . . . . . 0.404 ' N ' ' CG ' ' A' ' 127' ' ' GLN . 55.6 mtpt -63.53 -10.4 17.81 Favored 'General case' 0 CA--C 1.514 -0.412 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.922 -178.582 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 15.8 mt -117.61 21.86 12.72 Favored 'General case' 0 CA--C 1.509 -0.625 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.936 179.883 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 130' ' ' GLY . . . . . 0.517 ' O ' ' C ' ' A' ' 131' ' ' ILE . . . 101.15 -121.76 7.35 Favored Glycine 0 CA--C 1.506 -0.474 0 N-CA-C 110.735 -0.946 . . . . 0.0 110.735 179.589 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 131' ' ' ILE . . . . . 0.81 ' N ' HD12 ' A' ' 131' ' ' ILE . 2.0 mp 21.79 81.78 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 CA-C-N 116.591 0.195 . . . . 0.0 111.131 -179.439 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 69.5 tp60 -106.51 74.88 1.04 Allowed 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 -178.564 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 174.81 -6.81 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 O-C-N 123.452 0.47 . . . . 0.0 110.456 179.847 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 7.5 tpt -51.21 -40.33 58.5 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.493 -179.123 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 24.8 m -73.0 -59.76 2.56 Favored 'General case' 0 C--O 1.214 -0.777 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.048 179.444 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 136' ' ' LYS . . . . . 0.41 ' H ' ' HG2' ' A' ' 136' ' ' LYS . 44.9 mmtm -43.46 -50.8 6.9 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.982 -0.377 . . . . 0.0 109.982 -178.798 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 91.5 m -58.54 -52.11 67.06 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.629 -0.428 . . . . 0.0 110.925 179.621 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 48.7 t -64.03 -44.01 97.69 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.856 179.929 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 73.9 m -64.4 -42.19 96.24 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.495 -179.397 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 19.1 m-20 -67.07 -30.53 70.61 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.46 -179.58 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -71.43 -28.29 63.87 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.826 -179.433 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 142' ' ' ALA . . . . . 0.455 ' O ' ' O ' ' A' ' 143' ' ' GLU . . . -75.07 -29.97 60.84 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.695 -179.372 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 143' ' ' GLU . . . . . 0.533 ' O ' ' N ' ' A' ' 145' ' ' ASN . 69.3 tt0 -60.48 -119.47 0.0 OUTLIER 'General case' 0 C--O 1.211 -0.956 0 CA-C-O 119.082 -0.485 . . . . 0.0 109.811 -179.382 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 144' ' ' GLU . . . . . 0.501 ' C ' ' O ' ' A' ' 143' ' ' GLU . 84.0 tt0 18.54 -82.98 0.0 OUTLIER 'General case' 0 CA--C 1.518 -0.263 0 O-C-N 123.696 0.623 . . . . 0.0 111.678 -179.599 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 145' ' ' ASN . . . . . 0.533 ' N ' ' O ' ' A' ' 143' ' ' GLU . 57.7 t30 -127.19 95.58 36.07 Favored Pre-proline 0 CA--C 1.534 0.365 0 CA-C-N 115.467 -0.788 . . . . 0.0 111.24 178.332 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 146' ' ' PRO . . . . . . . . . . . . . 69.8 Cg_exo -50.07 125.16 14.15 Favored 'Trans proline' 0 C--N 1.321 -0.915 0 C-N-CA 122.653 2.235 . . . . 0.0 112.183 179.367 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 147' ' ' PRO . . . . . 0.442 ' C ' ' H ' ' A' ' 149' ' ' THR . 68.2 Cg_endo -75.37 70.52 5.52 Favored 'Trans proline' 0 C--N 1.312 -1.395 0 C-N-CA 122.527 2.151 . . . . 0.0 112.646 -179.402 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 40.2 p -77.88 22.05 0.29 Allowed 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.352 -179.914 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 149' ' ' THR . . . . . 0.478 HG22 ' N ' ' A' ' 150' ' ' ALA . 16.6 m -137.6 163.36 31.41 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.539 179.55 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 150' ' ' ALA . . . . . 0.478 ' N ' HG22 ' A' ' 149' ' ' THR . . . -62.99 -41.39 99.56 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.609 179.432 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 87.9 mt-30 -68.31 -33.68 74.76 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.139 179.804 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . -63.77 -51.42 53.88 Favored Glycine 0 CA--C 1.526 0.724 0 N-CA-C 110.834 -0.906 . . . . 0.0 110.834 -179.843 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 153' ' ' VAL . . . . . . . . . . . . . 69.1 t -60.77 -25.01 34.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 N-CA-C 110.157 -0.312 . . . . 0.0 110.157 -179.589 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 154' ' ' LEU . . . . . 0.535 HD23 ' O ' ' A' ' 154' ' ' LEU . 1.0 OUTLIER -59.03 -39.74 82.9 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 121.133 0.492 . . . . 0.0 109.776 -179.011 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -59.84 -50.92 71.93 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 179.86 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 20.1 mm -54.31 -56.06 11.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 C-N-CA 120.789 -0.364 . . . . 0.0 110.452 -179.417 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -50.32 -49.03 54.98 Favored 'General case' 0 C--N 1.33 -0.277 0 O-C-N 123.502 0.501 . . . . 0.0 110.339 179.9 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 158' ' ' LYS . . . . . 0.459 ' NZ ' ' OE2' ' A' ' 162' ' ' GLU . 63.6 tttm -64.91 -37.28 87.11 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.445 179.004 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 61.5 tttp -66.87 -31.96 72.91 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.308 -179.82 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 160' ' ' MET . . . . . 0.542 ' SD ' ' SD ' ' A' ' 119' ' ' MET . 3.8 mtm -67.3 -44.73 78.48 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.36 179.475 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 78.1 ttt180 -65.59 -33.23 75.43 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.411 -179.888 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 162' ' ' GLU . . . . . 0.459 ' OE2' ' NZ ' ' A' ' 158' ' ' LYS . 95.7 mt-10 -71.25 -29.68 65.4 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.152 -0.477 . . . . 0.0 111.0 -179.711 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 163' ' ' LYS . . . . . . . . . . . . . 2.0 tmtm? -83.11 -42.74 17.04 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-O 121.804 0.811 . . . . 0.0 110.94 -179.104 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 6.0 mt -67.82 -30.74 70.23 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.695 -0.684 . . . . 0.0 112.016 -178.607 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 165' ' ' GLN . . . . . 0.401 ' HG3' ' O ' ' A' ' 162' ' ' GLU . 0.0 OUTLIER -64.28 -31.82 73.17 Favored 'General case' 0 C--N 1.314 -0.963 0 O-C-N 123.776 0.673 . . . . 0.0 110.575 -179.08 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 58.4 ttt85 -65.88 -31.28 72.13 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.049 -179.346 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 167' ' ' VAL . . . . . . . . . . . . . 21.3 t -70.04 -45.22 77.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.066 -179.836 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 38.0 t-80 -77.91 -30.03 50.43 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.627 -178.981 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 169' ' ' THR . . . . . . . . . . . . . 97.0 m -71.39 -46.54 60.03 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.952 -179.697 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 36.2 ttpt -60.76 -44.0 97.3 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.91 -179.286 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 171' ' ' ASN . . . . . . . . . . . . . 10.7 m120 -62.35 -30.88 71.49 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.608 179.725 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 172' ' ' TYR . . . . . . . . . . . . . 43.7 t80 -73.33 -35.29 66.01 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.09 0.472 . . . . 0.0 110.732 -179.981 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 1.9 t -76.61 -31.52 57.48 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.803 -179.375 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 9.2 p -60.82 -48.89 79.73 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.193 -179.1 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 11.0 mp -69.38 -32.19 71.07 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.338 179.23 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 33.9 ttmt -58.84 -28.52 66.14 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.091 -179.693 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 177' ' ' LYS . . . . . . . . . . . . . 58.9 tttm -55.48 -28.84 56.94 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.426 179.659 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 178' ' ' LYS . . . . . . . . . . . . . 25.2 mmtp . . . . . 0 C--N 1.324 -0.539 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.441 -179.119 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.221 -0.426 0 CA-C-O 121.531 0.681 . . . . 0.0 110.822 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 88.9 m -46.2 -34.31 4.26 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.369 -178.551 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 18.6 mmtp -64.25 -24.01 67.51 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.468 179.811 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 44.2 mm -62.0 -42.53 95.2 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.887 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 -179.073 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 45.0 ttm180 -63.32 -42.77 99.03 Favored 'General case' 0 C--N 1.321 -0.668 0 O-C-N 123.488 0.493 . . . . 0.0 110.141 -179.845 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 41.5 mt -66.66 -37.11 84.13 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.441 -179.765 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 80.4 tt0 -62.58 -45.51 92.6 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.6 -179.381 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -66.59 -40.82 89.09 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.329 179.937 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 83.5 p -73.49 -22.76 60.05 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.449 179.824 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -70.09 -49.54 49.9 Favored 'General case' 0 C--O 1.224 -0.27 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.768 -179.807 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 65.3 tttp -54.78 -42.68 72.05 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.567 -179.86 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' ASP . . . . . 0.413 ' OD1' ' N ' ' A' ' 41' ' ' ASP . 2.0 m-20 -50.44 -23.51 2.48 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.642 -179.336 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 72.2 mt -63.71 -50.89 75.96 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.094 -179.703 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 76.0 p -76.03 -38.51 57.15 Favored 'General case' 0 C--O 1.223 -0.3 0 CA-C-O 121.406 0.622 . . . . 0.0 110.797 -178.686 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 48.2 t0 -61.86 -35.99 79.93 Favored 'General case' 0 CA--C 1.519 -0.239 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.66 -177.472 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 66.1 mm-40 -71.26 -53.32 14.74 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.24 -179.76 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 9.3 pt -69.34 -31.84 51.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.706 -178.879 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 35.5 t0 -63.76 -29.45 70.66 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.181 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -67.31 -36.03 80.65 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.411 -0.358 . . . . 0.0 110.709 -179.763 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 70.4 mt -59.21 -48.42 86.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.137 -179.07 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 9.4 mtmp? -64.76 -36.4 84.19 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.469 179.707 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -62.74 -44.33 96.5 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.998 -0.547 . . . . 0.0 110.536 -179.688 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 60.1 m-20 -77.14 -35.34 56.23 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 116.511 -0.313 . . . . 0.0 110.896 -179.95 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -70.26 -38.81 75.2 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.799 -179.895 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' ALA . . . . . 0.526 ' O ' ' C ' ' A' ' 55' ' ' LEU . . . -50.79 -52.67 38.72 Favored 'General case' 0 CA--C 1.501 -0.936 0 CA-C-O 118.832 -0.604 . . . . 0.0 111.093 -178.929 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.53 ' H ' ' CD2' ' A' ' 55' ' ' LEU . 4.5 mm? . . . . . 0 CA--C 1.497 -1.095 0 O-C-N 124.423 1.077 . . . . 0.0 111.469 -179.744 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' ASN . . . . . 0.639 HD22 ' N ' ' A' ' 75' ' ' ASN . 0.0 OUTLIER . . . . . 0 CA--C 1.544 0.717 0 CA-C-O 119.817 -0.135 . . . . 0.0 110.858 . . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -51.14 -1.22 0.05 OUTLIER 'Trans proline' 0 C--N 1.31 -1.454 0 C-N-CA 122.564 2.176 . . . . 0.0 112.2 -179.038 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' PHE . . . . . 0.557 ' H ' ' C ' ' A' ' 75' ' ' ASN . 20.1 m-85 -66.79 -46.93 73.71 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-O 120.668 0.271 . . . . 0.0 110.662 -179.763 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 77.4 mt -72.17 -32.64 43.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-O 121.127 0.489 . . . . 0.0 110.358 -179.248 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.687 HD22 ' N ' ' A' ' 79' ' ' LEU . 3.2 mm? -66.88 -48.31 69.16 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.801 -178.723 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -69.31 -27.13 65.11 Favored 'General case' 0 C--N 1.317 -0.836 0 O-C-N 123.698 0.624 . . . . 0.0 109.969 179.664 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -79.24 -19.56 50.37 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.086 0.47 . . . . 0.0 110.837 179.988 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 82' ' ' LYS . . . . . 0.47 ' NZ ' ' CG2' ' A' ' 167' ' ' VAL . 53.1 tttm -70.5 -46.34 63.88 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.606 -179.499 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 16.4 m -71.59 -38.11 66.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.494 179.807 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -62.6 -38.64 90.95 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.662 -179.754 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -58.97 -42.26 89.5 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.698 -179.811 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 33.3 p -81.33 -20.0 41.65 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.706 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 85.9 m -62.09 -53.11 60.1 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 120.666 -0.413 . . . . 0.0 110.984 -178.471 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 48.9 t -69.37 -41.3 80.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 121.147 0.499 . . . . 0.0 110.639 -179.427 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -62.96 -36.81 84.71 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.769 -178.859 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 79.2 tt0 -54.94 -31.35 60.38 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.637 -179.906 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 63.8 mttp -66.51 -36.2 82.13 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.565 -179.969 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 87.6 t80 -62.35 -60.65 3.25 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.429 -178.624 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 16.5 m -51.65 -40.99 27.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-O 121.093 0.473 . . . . 0.0 110.602 -178.72 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 49.3 mt -57.04 -41.79 78.13 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 N-CA-C 109.783 -0.451 . . . . 0.0 109.783 -179.94 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.99 -36.56 79.76 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.081 -179.77 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 30.5 mm -63.87 -43.94 97.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.535 -179.857 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 75.7 tt0 -58.34 -46.78 85.59 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.358 -179.404 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -70.74 -35.44 72.68 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.97 0.414 . . . . 0.0 110.793 -179.48 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 47.8 tp10 -62.75 -46.67 86.99 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.686 -179.27 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -56.12 -38.62 71.05 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.877 0.37 . . . . 0.0 110.478 -179.17 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 19.5 m -61.64 -41.86 98.09 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.653 -179.652 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -64.38 -40.76 96.45 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.912 -178.826 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 33.9 mt . . . . . 0 C--O 1.2 -1.542 0 CA-C-O 116.993 -1.479 . . . . 0.0 111.013 -178.702 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 77.9 p . . . . . 0 N--CA 1.457 -0.122 0 CA-C-O 120.79 0.329 . . . . 0.0 110.555 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -63.61 -40.69 98.92 Favored Glycine 0 CA--C 1.524 0.62 0 N-CA-C 111.127 -0.789 . . . . 0.0 111.127 -179.548 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -67.58 -41.58 83.92 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.649 0.261 . . . . 0.0 110.586 -179.801 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 40.8 m-85 -63.06 -39.57 95.12 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.35 179.923 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 36.9 t -55.2 -38.21 68.09 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.144 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -69.88 -24.08 63.36 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.624 178.923 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 36.8 tpp -76.68 -45.79 28.29 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.063 -179.841 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 37.3 t80 -64.11 -36.24 83.37 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.877 0.37 . . . . 0.0 110.26 -179.374 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -65.6 -29.34 69.92 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.382 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.572 ' O ' HD23 ' A' ' 118' ' ' LEU . 3.1 tt -64.18 -49.3 72.57 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 122.134 0.969 . . . . 0.0 110.723 -179.564 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 15.8 tpt -50.54 -41.64 54.25 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.146 -179.29 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 51.9 t80 -60.29 -41.97 94.48 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.059 0.457 . . . . 0.0 111.326 -179.83 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -58.98 -51.95 67.87 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.913 -178.991 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 29.1 m -72.94 -24.0 20.77 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-O 121.096 0.474 . . . . 0.0 110.856 -179.431 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 40.5 t -61.55 -27.18 68.44 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.454 -179.906 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 124' ' ' LYS . . . . . 0.45 ' CB ' ' CD ' ' A' ' 125' ' ' PRO . 16.2 mmtt -64.47 -59.19 11.29 Favored Pre-proline 0 C--O 1.222 -0.391 0 C-N-CA 120.575 -0.45 . . . . 0.0 111.775 -179.19 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 125' ' ' PRO . . . . . 0.45 ' CD ' ' CB ' ' A' ' 124' ' ' LYS . 61.1 Cg_exo -41.22 -36.89 2.69 Favored 'Trans proline' 0 C--N 1.306 -1.695 0 C-N-CA 122.537 2.158 . . . . 0.0 112.199 178.039 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 31.7 mt -67.52 -22.86 65.42 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.068 -179.438 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 127' ' ' GLN . . . . . 0.477 ' C ' ' H ' ' A' ' 129' ' ' LEU . 84.3 mt-30 -66.13 -50.93 62.3 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.995 0.426 . . . . 0.0 110.922 -179.621 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 73.8 mmtt -55.01 -6.11 0.12 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.609 179.713 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.477 ' H ' ' C ' ' A' ' 127' ' ' GLN . 12.1 mt -118.08 19.25 13.66 Favored 'General case' 0 N--CA 1.465 0.299 0 O-C-N 123.451 0.47 . . . . 0.0 110.826 179.328 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 130' ' ' GLY . . . . . 0.544 ' O ' ' HB ' ' A' ' 131' ' ' ILE . . . 73.02 -177.13 42.73 Favored Glycine 0 CA--C 1.493 -1.333 0 N-CA-C 109.608 -1.397 . . . . 0.0 109.608 179.623 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 131' ' ' ILE . . . . . 0.919 ' O ' ' O ' ' A' ' 132' ' ' GLN . 60.9 mt 85.7 -20.91 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.476 -1.893 0 CA-C-O 116.996 -1.478 . . . . 0.0 110.78 178.576 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 132' ' ' GLN . . . . . 0.919 ' O ' ' O ' ' A' ' 131' ' ' ILE . 67.8 mt-30 -8.19 -145.58 0.0 OUTLIER 'General case' 0 N--CA 1.479 0.976 0 O-C-N 125.544 1.778 . . . . 0.0 112.097 -179.727 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 51.53 4.44 0.02 OUTLIER 'General case' 0 C--N 1.303 -1.417 0 O-C-N 120.032 -1.667 . . . . 0.0 111.409 179.385 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 134' ' ' MET . . . . . 0.58 ' N ' ' O ' ' A' ' 132' ' ' GLN . 0.0 OUTLIER -63.19 -43.35 98.44 Favored 'General case' 0 N--CA 1.444 -0.751 0 N-CA-C 109.926 -0.398 . . . . 0.0 109.926 -179.229 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 38.6 p -71.1 -22.4 62.09 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.737 -0.665 . . . . 0.0 109.97 179.655 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 16.3 ttmm -76.6 -57.05 4.08 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.323 -178.946 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 96.6 m -52.04 -53.17 45.21 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 120.686 -0.406 . . . . 0.0 110.628 -179.296 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 138' ' ' VAL . . . . . 0.472 HG13 ' N ' ' A' ' 139' ' ' SER . 13.8 p -62.4 -39.64 85.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.787 -179.26 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 139' ' ' SER . . . . . 0.472 ' N ' HG13 ' A' ' 138' ' ' VAL . 4.5 t -57.25 -33.29 67.44 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.382 -179.345 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -60.53 -39.85 89.34 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.47 -179.775 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -58.27 -51.28 70.42 Favored 'General case' 0 CA--C 1.515 -0.368 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.433 -179.752 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -41.29 -42.08 2.08 Favored 'General case' 0 CA--C 1.533 0.315 0 O-C-N 123.176 0.298 . . . . 0.0 110.482 -179.093 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 94.4 mt-10 -85.78 66.66 9.73 Favored 'General case' 0 C--N 1.322 -0.602 0 O-C-N 123.781 0.676 . . . . 0.0 109.727 177.993 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -179.45 -21.76 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 O-C-N 123.546 0.529 . . . . 0.0 110.606 179.813 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 145' ' ' ASN . . . . . . . . . . . . . 4.3 p30 -173.04 68.31 0.37 Allowed Pre-proline 0 C--N 1.327 -0.41 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.247 -179.512 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 146' ' ' PRO . . . . . 0.541 ' O ' ' N ' ' A' ' 148' ' ' THR . 94.1 Cg_exo -37.39 118.27 0.24 Allowed 'Trans proline' 0 C--N 1.317 -1.131 0 C-N-CA 123.139 2.559 . . . . 0.0 111.69 -179.845 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 147' ' ' PRO . . . . . 0.419 ' C ' ' H ' ' A' ' 149' ' ' THR . 31.2 Cg_exo -59.98 39.86 0.05 OUTLIER 'Trans proline' 0 N--CA 1.498 1.794 0 C-N-CA 122.826 2.35 . . . . 0.0 112.408 178.931 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 148' ' ' THR . . . . . 0.541 ' N ' ' O ' ' A' ' 146' ' ' PRO . 20.6 p -65.61 0.39 1.65 Allowed 'General case' 0 N--CA 1.448 -0.573 0 N-CA-C 110.031 -0.359 . . . . 0.0 110.031 179.69 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 149' ' ' THR . . . . . 0.419 ' H ' ' C ' ' A' ' 147' ' ' PRO . 24.3 p -141.54 166.33 25.03 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.392 179.693 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -68.42 -41.31 80.59 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.626 179.778 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 99.1 mm-40 -66.76 -25.71 66.62 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.209 -179.63 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . -68.77 -33.71 76.23 Favored Glycine 0 CA--C 1.521 0.444 0 N-CA-C 111.237 -0.745 . . . . 0.0 111.237 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 153' ' ' VAL . . . . . . . . . . . . . 57.5 t -60.5 -26.48 37.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-O 120.921 0.391 . . . . 0.0 110.756 -178.786 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 154' ' ' LEU . . . . . 0.561 HD22 ' N ' ' A' ' 154' ' ' LEU . 4.0 mm? -62.97 -37.75 88.37 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.315 -179.073 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 42.3 tp10 -64.39 -32.93 74.74 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.064 -179.708 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 156' ' ' ILE . . . . . 0.548 HD12 ' N ' ' A' ' 156' ' ' ILE . 1.6 mp -77.06 -45.1 30.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.659 179.334 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -55.6 -43.2 75.83 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.541 -177.953 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -55.67 -47.28 76.99 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.022 -179.714 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 32.5 mmtp -65.66 -32.6 74.26 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.475 -0.33 . . . . 0.0 110.692 179.812 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 160' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -70.98 -53.23 15.62 Favored 'General case' 0 CA--C 1.515 -0.369 0 C-N-CA 120.505 -0.478 . . . . 0.0 111.309 -179.52 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 60.2 ttp180 -65.77 -42.58 90.65 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.736 -179.524 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 52.6 tp10 -57.8 -53.96 52.29 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.94 -179.061 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 163' ' ' LYS . . . . . . . . . . . . . 52.9 tptt -57.03 -35.26 69.08 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.708 -178.813 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 23.1 mt -69.57 -38.86 77.55 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.244 0.545 . . . . 0.0 111.709 -179.449 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 84.8 mt-30 -72.71 -32.11 65.5 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.648 -178.776 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 75.0 ttt180 -66.66 -40.96 88.84 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-O 121.951 0.882 . . . . 0.0 111.298 -178.622 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 167' ' ' VAL . . . . . 0.47 ' CG2' ' NZ ' ' A' ' 82' ' ' LYS . 7.7 p -75.17 -34.27 30.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 115.723 -0.672 . . . . 0.0 110.965 -179.958 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 168' ' ' HIS . . . . . 0.429 ' C ' ' ND1' ' A' ' 168' ' ' HIS . 14.6 t-80 -76.92 -41.66 42.61 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.935 -179.076 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 169' ' ' THR . . . . . . . . . . . . . 35.3 m -66.88 -43.8 82.52 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.235 -179.928 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 64.6 tttm -59.84 -48.19 82.69 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.842 -178.542 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 171' ' ' ASN . . . . . . . . . . . . . 20.0 t-20 -67.27 -40.72 86.21 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.009 0.433 . . . . 0.0 110.836 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 172' ' ' TYR . . . . . . . . . . . . . 64.1 t80 -68.76 -25.41 64.71 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.549 -179.293 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 17.0 t -78.47 -30.15 47.19 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.822 -179.209 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 22.7 p -73.06 -34.7 66.42 Favored 'General case' 0 C--O 1.222 -0.394 0 CA-C-O 121.333 0.587 . . . . 0.0 110.615 -178.983 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 99.0 mt -64.72 -43.54 93.11 Favored 'General case' 0 C--N 1.317 -0.828 0 C-N-CA 120.667 -0.413 . . . . 0.0 111.793 -178.617 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 17.7 ptpt -73.76 -14.25 61.09 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.009 -179.1 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 177' ' ' LYS . . . . . . . . . . . . . 14.9 pttp -46.93 -30.15 2.4 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.477 -0.329 . . . . 0.0 110.54 -178.98 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 178' ' ' LYS . . . . . . . . . . . . . 9.1 mtmp? . . . . . 0 C--N 1.329 -0.32 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.858 -178.111 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.371 0 CA-C-O 121.086 0.47 . . . . 0.0 111.062 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 11.1 m -64.04 -32.74 74.39 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.351 -179.924 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 1.9 tmtp? -61.95 -50.36 72.43 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.785 179.678 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 64.8 mt -64.75 -28.94 45.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.455 -179.558 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 59.9 ttm-85 -69.27 -42.63 75.27 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.628 -179.421 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 79.4 mt -65.72 -35.0 79.49 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.637 -179.589 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 80.2 mm-40 -67.19 -50.24 61.68 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.761 179.879 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 23.3 mmm180 -63.42 -43.75 96.58 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.923 0.392 . . . . 0.0 110.832 -179.234 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 78.7 p -66.86 -38.59 86.63 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.319 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -70.62 -37.08 73.77 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.872 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 33.8 tptt -62.31 -31.92 72.6 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.846 -179.252 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 82.3 m-20 -67.02 -23.6 65.93 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.86 -179.384 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 73.3 mt -62.45 -53.39 47.89 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.365 0 C-N-CA 120.731 -0.388 . . . . 0.0 110.995 -179.391 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 52.6 p -74.1 -39.99 63.03 Favored 'General case' 0 C--O 1.226 -0.183 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.475 -178.583 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -60.26 -39.54 87.16 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.119 -0.491 . . . . 0.0 112.03 -178.435 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 43.2 tp10 -70.33 -53.5 16.47 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.092 0.473 . . . . 0.0 111.385 -178.612 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 6.5 pt -67.27 -27.05 37.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.588 -179.056 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 31.7 t0 -61.82 -40.92 96.95 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 120.576 -0.449 . . . . 0.0 110.388 179.9 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -52.96 -24.85 10.24 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.383 -178.875 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 62.3 mt -64.55 -46.56 92.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.298 179.65 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 49.0 mtmt -56.53 -41.29 76.54 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.28 -178.5 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 71.4 mmtt -65.98 -41.68 90.83 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.192 179.613 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -61.87 -41.48 97.91 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.471 -179.834 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -61.34 -31.39 71.26 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.669 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -61.89 -34.06 75.34 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.763 -179.759 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 52.3 mt . . . . . 0 C--N 1.329 -0.321 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.948 -179.374 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 6.2 m-20 . . . . . 0 CA--C 1.547 0.858 0 N-CA-C 110.33 -0.248 . . . . 0.0 110.33 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -75.59 -14.14 20.0 Favored 'Trans proline' 0 N--CA 1.496 1.628 0 C-N-CA 121.709 1.606 . . . . 0.0 112.027 -179.932 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 59.3 t80 -74.31 -51.04 16.4 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-O 120.853 0.359 . . . . 0.0 111.555 -179.611 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 71.8 mt -67.47 -30.45 48.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.691 -179.482 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 8.5 mp -75.93 -48.85 19.61 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 121.097 0.475 . . . . 0.0 110.016 179.337 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -62.14 -28.06 69.38 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.937 -0.574 . . . . 0.0 109.963 179.742 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -66.37 -37.57 85.58 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.663 179.82 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 36.6 ttpt -62.82 -26.64 68.84 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.799 -179.794 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 54.0 t -70.43 -44.96 76.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.398 179.609 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 44.0 ttm180 -64.16 -35.69 81.62 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.089 -179.529 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -63.12 -41.74 99.4 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.949 0.404 . . . . 0.0 111.176 -179.333 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 41.3 p -72.76 -23.72 60.86 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.427 179.719 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 25.2 m -60.71 -51.18 70.47 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 120.787 -0.365 . . . . 0.0 111.0 -179.473 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 21.9 t -78.54 -48.24 22.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-O 121.209 0.528 . . . . 0.0 111.92 179.791 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -54.62 -45.59 73.73 Favored 'General case' 0 C--O 1.223 -0.331 0 CA-C-N 115.397 -0.819 . . . . 0.0 111.62 -177.387 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.423 ' CG ' ' N ' ' A' ' 91' ' ' LYS . 14.3 pt-20 -59.75 -42.57 93.52 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.989 0.424 . . . . 0.0 110.594 -179.569 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 91' ' ' LYS . . . . . 0.423 ' N ' ' CG ' ' A' ' 90' ' ' GLU . 67.6 mttm -59.09 -38.3 79.17 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.35 -179.221 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.412 ' CE2' HD11 ' A' ' 96' ' ' ILE . 88.2 t80 -60.81 -38.49 85.59 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.654 179.532 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 52.9 t -59.02 -44.65 91.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.247 -178.492 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 71.7 mt -54.69 -37.34 39.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.247 -179.787 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.33 -37.67 81.36 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.577 -179.867 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 96' ' ' ILE . . . . . 0.412 HD11 ' CE2' ' A' ' 92' ' ' PHE . 38.4 mm -61.94 -43.95 98.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 120.91 0.386 . . . . 0.0 110.031 -179.751 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 81.6 tt0 -65.04 -41.83 94.87 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 120.683 -0.407 . . . . 0.0 110.707 179.489 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 40.9 tp10 -59.77 -46.46 89.11 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.924 0.392 . . . . 0.0 110.563 -178.908 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 80.2 mm-40 -60.96 -37.45 82.46 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.225 -179.743 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -64.82 -38.07 89.74 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.606 179.867 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 18.7 m -64.08 -47.7 79.05 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.062 -179.455 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -75.15 -18.94 60.11 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.3 -179.462 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 39.1 tp . . . . . 0 N--CA 1.466 0.339 0 CA-C-O 121.179 0.514 . . . . 0.0 110.218 -179.766 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 39.9 p . . . . . 0 CA--C 1.528 0.118 0 CA-C-O 120.857 0.361 . . . . 0.0 110.318 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -65.59 -30.19 76.87 Favored Glycine 0 CA--C 1.524 0.617 0 N-CA-C 110.881 -0.888 . . . . 0.0 110.881 179.819 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 78.4 tt0 -60.31 -38.13 82.72 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.69 0.281 . . . . 0.0 110.498 -179.601 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 54.7 m-85 -60.6 -44.91 95.74 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.537 -0.301 . . . . 0.0 110.557 -179.829 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 70.0 m -50.78 -30.58 14.51 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.698 -179.52 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -62.13 -32.18 72.74 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.75 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 50.6 mmm -67.76 -40.64 84.06 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-O 121.058 0.456 . . . . 0.0 110.906 -179.744 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 55.8 m-85 -62.74 -30.85 71.74 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.183 -179.938 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -55.91 -37.99 69.65 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.994 0.426 . . . . 0.0 110.618 -179.612 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.512 HD22 ' N ' ' A' ' 118' ' ' LEU . 4.1 mm? -61.42 -40.36 94.14 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.819 -0.628 . . . . 0.0 109.682 -179.178 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 119' ' ' MET . . . . . 0.408 ' C ' ' SD ' ' A' ' 119' ' ' MET . 0.0 OUTLIER -60.46 -53.21 60.28 Favored 'General case' 0 C--N 1.319 -0.727 0 C-N-CA 119.745 -0.782 . . . . 0.0 109.906 -179.632 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 20.1 m-85 -61.52 -46.36 90.3 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.667 -179.717 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 9.7 tm-20 -58.0 -44.87 87.48 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.185 -179.062 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 86.9 t -75.95 -21.47 15.67 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.33 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.078 179.804 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 32.2 t -71.43 -26.85 62.92 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 120.467 -0.493 . . . . 0.0 111.288 179.775 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 124' ' ' LYS . . . . . 0.428 ' N ' ' HD2' ' A' ' 125' ' ' PRO . 2.4 mptm? -58.8 -59.29 14.19 Favored Pre-proline 0 CA--C 1.542 0.64 0 C-N-CA 120.911 -0.316 . . . . 0.0 110.738 -179.827 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 125' ' ' PRO . . . . . 0.428 ' HD2' ' N ' ' A' ' 124' ' ' LYS . 37.3 Cg_endo -61.86 -50.04 5.85 Favored 'Trans proline' 0 N--CA 1.494 1.511 0 C-N-CA 122.039 1.826 . . . . 0.0 111.493 179.183 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.583 ' HB3' HD12 ' A' ' 131' ' ' ILE . 8.1 mp -56.71 -43.13 80.28 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.113 -179.16 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 11.9 tm0? -64.15 -49.98 70.01 Favored 'General case' 0 C--N 1.316 -0.849 0 C-N-CA 119.975 -0.69 . . . . 0.0 109.819 179.571 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -56.29 -19.38 14.02 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.188 -179.869 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 1.7 tt -93.72 -65.65 0.98 Allowed 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.742 179.886 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -151.8 -136.85 2.51 Favored Glycine 0 N--CA 1.462 0.374 0 N-CA-C 110.944 -0.862 . . . . 0.0 110.944 -178.955 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 131' ' ' ILE . . . . . 0.65 HG22 ' N ' ' A' ' 132' ' ' GLN . 81.2 mt 52.01 -114.58 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.333 -0.126 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 -178.977 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 132' ' ' GLN . . . . . 0.65 ' N ' HG22 ' A' ' 131' ' ' ILE . 57.6 tp60 97.15 55.4 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.803 0 O-C-N 124.138 0.899 . . . . 0.0 110.705 179.137 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 25.1 tt0 -170.42 -21.38 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 120.339 -0.544 . . . . 0.0 111.038 179.786 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 134' ' ' MET . . . . . 0.585 ' HG3' HG21 ' A' ' 131' ' ' ILE . 0.3 OUTLIER -52.26 -53.21 46.75 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.191 0.52 . . . . 0.0 110.618 -178.766 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 24.5 m -61.47 -28.54 69.36 Favored 'General case' 0 C--N 1.314 -0.945 0 C-N-CA 120.655 -0.418 . . . . 0.0 110.526 -179.494 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 30.3 ttpt -79.76 -57.05 3.85 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 116.14 -0.482 . . . . 0.0 112.141 -178.505 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 137' ' ' THR . . . . . 0.503 HG23 ' N ' ' A' ' 138' ' ' VAL . 14.1 t -59.71 -43.35 94.15 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.291 -178.298 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 138' ' ' VAL . . . . . 0.503 ' N ' HG23 ' A' ' 137' ' ' THR . 70.3 t -63.78 -44.77 98.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.425 -179.753 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 77.9 p -62.53 -38.25 89.24 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.845 0.355 . . . . 0.0 110.69 -179.593 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 93.8 m-20 -70.78 -30.58 67.1 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.584 179.857 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -65.11 -26.3 68.15 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.991 -179.873 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 142' ' ' ALA . . . . . 0.473 ' O ' ' O ' ' A' ' 143' ' ' GLU . . . -65.64 -29.01 69.52 Favored 'General case' 0 CA--C 1.51 -0.592 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.646 -179.3 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 143' ' ' GLU . . . . . 0.577 ' O ' ' N ' ' A' ' 145' ' ' ASN . 14.2 mm-40 -59.39 -123.49 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 -179.878 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 144' ' ' GLU . . . . . 0.406 ' C ' ' O ' ' A' ' 143' ' ' GLU . 72.0 mm-40 26.05 -81.09 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 123.574 0.749 . . . . 0.0 111.844 -179.981 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 145' ' ' ASN . . . . . 0.577 ' N ' ' O ' ' A' ' 143' ' ' GLU . 24.7 t30 -129.67 91.66 39.94 Favored Pre-proline 0 CA--C 1.55 0.964 0 CA-C-N 115.584 -0.735 . . . . 0.0 110.38 178.27 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 146' ' ' PRO . . . . . 0.487 ' O ' ' N ' ' A' ' 148' ' ' THR . 96.1 Cg_exo -43.67 106.73 0.08 OUTLIER 'Trans proline' 0 N--CA 1.501 1.939 0 C-N-CA 122.738 2.292 . . . . 0.0 112.052 -179.796 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 147' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_exo -48.48 81.78 0.02 OUTLIER 'Trans proline' 0 N--CA 1.5 1.87 0 C-N-CA 122.299 1.999 . . . . 0.0 112.661 179.848 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 148' ' ' THR . . . . . 0.487 ' N ' ' O ' ' A' ' 146' ' ' PRO . 1.2 m -97.12 14.42 25.84 Favored 'General case' 0 N--CA 1.47 0.556 0 O-C-N 122.14 -0.35 . . . . 0.0 110.112 179.994 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 149' ' ' THR . . . . . . . . . . . . . 28.4 p -140.82 167.91 21.05 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.518 -179.811 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -62.26 -44.15 97.21 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.503 -179.851 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -66.28 -37.0 84.4 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.756 -179.763 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . -55.53 -46.9 79.79 Favored Glycine 0 CA--C 1.523 0.59 0 N-CA-C 110.985 -0.846 . . . . 0.0 110.985 -179.26 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 153' ' ' VAL . . . . . . . . . . . . . 55.0 t -64.14 -24.69 36.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-O 120.828 0.347 . . . . 0.0 110.334 -179.62 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 154' ' ' LEU . . . . . 0.492 ' O ' HD23 ' A' ' 154' ' ' LEU . 1.1 tt -60.46 -40.44 91.21 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 109.558 -0.534 . . . . 0.0 109.558 -178.887 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -57.54 -46.07 84.31 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.062 179.535 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 156' ' ' ILE . . . . . 0.489 HG22 ' SD ' ' A' ' 160' ' ' MET . 16.0 mm -61.36 -43.63 97.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 -178.521 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -54.51 -50.02 68.83 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.38 179.202 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 158' ' ' LYS . . . . . 0.492 ' NZ ' ' OE2' ' A' ' 162' ' ' GLU . 65.1 tttm -62.72 -40.96 98.81 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.05 179.862 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 65.1 mmtt -65.92 -31.97 73.2 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.217 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 160' ' ' MET . . . . . 0.489 ' SD ' HG22 ' A' ' 156' ' ' ILE . 2.0 mtp -67.71 -47.89 68.1 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.228 0.537 . . . . 0.0 110.334 -179.5 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 62.4 ttp180 -66.44 -34.04 77.05 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.604 -179.716 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 162' ' ' GLU . . . . . 0.492 ' OE2' ' NZ ' ' A' ' 158' ' ' LYS . 48.5 mt-10 -69.95 -40.0 75.72 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.995 179.927 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 163' ' ' LYS . . . . . . . . . . . . . 17.0 tptp -67.35 -40.85 85.85 Favored 'General case' 0 C--N 1.325 -0.458 0 C-N-CA 120.553 -0.459 . . . . 0.0 111.135 -179.299 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 7.9 mt -69.15 -26.33 64.82 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.269 -179.628 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 50.7 tt0 -59.98 -45.3 93.17 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.728 -179.146 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 84.8 mtp180 -61.8 -29.46 70.17 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.35 0.595 . . . . 0.0 110.889 -179.723 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 167' ' ' VAL . . . . . . . . . . . . . 22.3 t -67.93 -46.85 81.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.491 -179.827 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 168' ' ' HIS . . . . . 0.463 ' O ' ' ND1' ' A' ' 168' ' ' HIS . 29.4 t-80 -79.23 -28.99 42.53 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.28 179.943 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 169' ' ' THR . . . . . . . . . . . . . 27.8 m -72.72 -48.52 38.04 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.781 0.324 . . . . 0.0 111.351 -179.562 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 56.0 mtpt -64.08 -43.39 95.57 Favored 'General case' 0 C--N 1.326 -0.436 0 C-N-CA 120.756 -0.377 . . . . 0.0 110.692 -179.52 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 171' ' ' ASN . . . . . . . . . . . . . 42.8 t-20 -65.79 -35.04 79.59 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.597 -179.866 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 172' ' ' TYR . . . . . . . . . . . . . 89.4 t80 -74.65 -45.06 47.2 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.734 -0.667 . . . . 0.0 110.639 179.699 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 16.8 t -66.82 -44.04 82.19 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.177 -179.381 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 12.6 p -60.92 -46.34 91.06 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.186 -179.648 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 33.8 tp -63.85 -31.98 73.34 Favored 'General case' 0 C--N 1.319 -0.741 0 C-N-CA 120.581 -0.448 . . . . 0.0 110.719 -179.227 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 2.7 tptm -65.04 -2.85 3.0 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.648 -178.729 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 177' ' ' LYS . . . . . . . . . . . . . 20.7 ptmt -61.66 -16.04 45.2 Favored 'General case' 0 C--N 1.318 -0.769 0 C-N-CA 120.651 -0.419 . . . . 0.0 111.183 -178.962 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 178' ' ' LYS . . . . . . . . . . . . . 74.5 mmtt . . . . . 0 C--N 1.325 -0.493 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.893 -179.324 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.458 -0.074 0 CA-C-O 120.953 0.406 . . . . 0.0 110.554 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.419 HG23 HH21 ' A' ' 34' ' ' ARG . 86.0 m -50.47 -39.73 48.95 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.473 -179.953 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 6.2 tmtt? -49.77 -29.35 7.61 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.673 -179.766 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 96.4 mt -52.86 -52.96 23.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.697 -179.19 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.419 HH21 HG23 ' A' ' 31' ' ' THR . 87.9 mtm180 -62.19 -41.31 98.23 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.458 -179.472 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.55 ' N ' HD22 ' A' ' 35' ' ' LEU . 4.2 mm? -64.17 -52.01 61.04 Favored 'General case' 0 N--CA 1.455 -0.22 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.037 -179.705 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 83.7 tt0 -65.27 -46.17 81.55 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.598 -179.401 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 44.7 ttm180 -64.59 -45.43 87.03 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.794 -179.148 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 30.2 t -72.14 -37.11 69.51 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.916 -178.725 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -71.51 -49.69 38.6 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.231 -178.383 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 64.3 mmtt -57.77 -30.64 65.79 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.683 -178.667 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 86.1 m-20 -68.36 -24.43 64.79 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.87 -178.268 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 63.0 mt -63.03 -56.74 15.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.281 -178.278 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 55.8 p -75.78 -38.36 58.34 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.143 -178.455 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 96.3 m-20 -61.5 -38.53 87.69 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.978 -176.99 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 14.3 tm-20 -72.22 -58.5 3.36 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.114 -0.493 . . . . 0.0 111.248 -178.057 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 7.4 pt -61.22 -28.53 44.0 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.188 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.782 -178.539 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -66.51 -38.58 87.52 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.814 179.288 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' ALA . . . . . 0.414 ' O ' ' OD2' ' A' ' 52' ' ' ASP . . . -55.92 -25.1 41.55 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.485 -179.904 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 66.9 mt -58.39 -43.02 85.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.678 -179.631 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -60.6 -34.21 73.89 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.57 -179.8 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -61.72 -51.75 67.11 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.964 -179.036 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' ASP . . . . . 0.414 ' OD2' ' O ' ' A' ' 48' ' ' ALA . 0.4 OUTLIER -70.21 -19.8 63.14 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.753 -179.189 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -72.92 -32.92 65.65 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.734 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -58.06 -25.79 61.7 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.63 -179.786 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 79.3 mt . . . . . 0 C--N 1.33 -0.239 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.366 -179.346 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 33.6 m120 . . . . . 0 C--O 1.233 0.215 0 CA-C-O 120.553 0.216 . . . . 0.0 110.91 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -71.08 4.4 2.79 Favored 'Trans proline' 0 C--N 1.301 -1.925 0 C-N-CA 122.794 2.329 . . . . 0.0 112.353 -178.968 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 52.5 t80 -63.74 -51.63 64.06 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.774 -179.261 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 76.6 mt -70.08 -48.08 64.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.9 -179.158 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.546 ' N ' HD12 ' A' ' 79' ' ' LEU . 10.0 mp -52.23 -51.42 58.4 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.499 -179.073 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.416 ' O ' ' NH1' ' A' ' 84' ' ' ARG . 96.1 mt-10 -65.52 -31.83 73.11 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.438 -179.982 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -65.25 -38.14 89.4 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.634 -179.684 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -54.58 -24.93 23.23 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.425 -179.618 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 44.2 t -72.5 -43.85 62.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.978 -179.446 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 84' ' ' ARG . . . . . 0.416 ' NH1' ' O ' ' A' ' 80' ' ' GLU . 12.0 mpt_? -61.8 -29.21 70.0 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.6 -179.101 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -64.08 -44.93 90.86 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.917 -178.725 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 54.9 p -71.18 -20.18 62.31 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.769 -179.216 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 26.0 m -64.33 -53.89 41.6 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.218 -178.642 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 41.3 t -69.27 -46.5 77.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.094 -178.311 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -57.35 -37.44 72.59 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.744 -178.094 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 17.3 mm-40 -55.22 -42.24 73.1 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.701 -179.391 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 14.6 mptt -64.75 -23.37 67.23 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.639 -178.406 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 53.8 t80 -74.1 -59.57 2.66 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.316 -177.924 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 4.5 m -49.92 -38.3 13.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.674 -177.64 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 81.1 mt -58.91 -39.42 77.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.136 179.475 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -51.55 -40.77 60.33 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.569 -179.521 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 96' ' ' ILE . . . . . 0.563 ' N ' HD12 ' A' ' 96' ' ' ILE . 1.7 mp -61.99 -41.64 91.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.597 -179.809 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 75.6 mt-10 -60.54 -49.43 77.59 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.962 -178.718 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 39.7 tp10 -68.3 -42.51 79.35 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.852 -178.878 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 91.1 mt-10 -69.48 -32.27 71.05 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.762 -178.911 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -57.38 -30.95 65.31 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.566 -179.588 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 21.1 m -63.65 -52.84 59.01 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.738 -179.253 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -66.76 -28.75 68.65 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.351 179.754 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.478 HD13 ' O ' ' A' ' 103' ' ' LEU . 0.1 OUTLIER . . . . . 0 N--CA 1.451 -0.388 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.836 179.994 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 18.9 p . . . . . 0 C--O 1.231 0.128 0 CA-C-O 120.756 0.312 . . . . 0.0 110.386 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -75.52 -28.67 61.05 Favored Glycine 0 CA--C 1.525 0.682 0 N-CA-C 111.008 -0.837 . . . . 0.0 111.008 178.896 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 111' ' ' GLU . . . . . 0.459 ' OE1' ' N ' ' A' ' 111' ' ' GLU . 13.1 mp0 -56.78 -27.53 59.84 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.76 0.314 . . . . 0.0 110.536 -179.354 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 30.6 m-85 -53.28 -26.03 16.9 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.456 179.618 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 66.5 m -50.9 -34.48 28.54 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.538 179.934 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -57.41 -31.52 65.93 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.394 179.175 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 115' ' ' MET . . . . . 0.434 ' SD ' HG23 ' A' ' 96' ' ' ILE . 45.7 ttm -77.99 -40.45 39.1 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.936 179.448 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 30.4 t80 -64.06 -31.69 72.97 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.431 179.606 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 94.2 m-20 -59.92 -35.75 75.56 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.606 -179.409 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 81.5 mt -56.62 -38.61 72.33 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.326 179.743 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 119' ' ' MET . . . . . 0.478 ' C ' ' SD ' ' A' ' 119' ' ' MET . 0.0 OUTLIER -56.4 -50.13 72.48 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.476 179.612 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 68.6 t80 -63.84 -44.3 93.58 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.959 0.409 . . . . 0.0 110.693 -179.735 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 121' ' ' GLU . . . . . 0.405 ' O ' ' CD ' ' A' ' 125' ' ' PRO . 78.0 tt0 -53.98 -40.11 66.63 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.566 -179.706 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 95.1 t -83.42 -18.97 10.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.746 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 51.4 p -71.31 -30.29 66.06 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.809 -178.874 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 124' ' ' LYS . . . . . 0.534 ' CB ' ' HD3' ' A' ' 125' ' ' PRO . 5.6 mmtp -69.58 -55.2 9.63 Favored Pre-proline 0 C--N 1.33 -0.241 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.279 -177.509 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 125' ' ' PRO . . . . . 0.534 ' HD3' ' CB ' ' A' ' 124' ' ' LYS . 68.3 Cg_exo -50.66 -44.45 40.44 Favored 'Trans proline' 0 C--N 1.306 -1.707 0 C-N-CA 122.61 2.207 . . . . 0.0 111.887 179.06 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 75.4 mt -64.01 -21.2 66.4 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.575 -179.479 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 6.4 tm0? -62.91 -49.47 74.67 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.863 -179.627 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 70.7 mmtt -62.11 -6.75 3.23 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.443 -179.718 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.503 HD23 ' O ' ' A' ' 129' ' ' LEU . 1.1 tt -108.2 -50.71 3.0 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.562 179.792 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 130' ' ' GLY . . . . . 0.593 ' O ' ' C ' ' A' ' 131' ' ' ILE . . . 170.83 -120.97 0.88 Allowed Glycine 0 CA--C 1.52 0.36 0 N-CA-C 110.935 -0.866 . . . . 0.0 110.935 -179.688 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 131' ' ' ILE . . . . . 0.593 ' C ' ' O ' ' A' ' 130' ' ' GLY . 81.1 mt 21.83 94.23 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 120.65 0.262 . . . . 0.0 110.712 179.976 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 132' ' ' GLN . . . . . 0.474 ' O ' ' HG2' ' A' ' 133' ' ' GLU . 47.0 tt0 -117.59 158.66 24.23 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.542 -179.642 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 133' ' ' GLU . . . . . 0.474 ' HG2' ' O ' ' A' ' 132' ' ' GLN . 0.6 OUTLIER 79.57 -12.17 1.1 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.539 179.173 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 26.4 ttm -58.5 -22.41 55.05 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.508 -179.997 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 34.9 m -67.79 -65.85 0.64 Allowed 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.689 179.559 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 136' ' ' LYS . . . . . 0.477 ' O ' ' N ' ' A' ' 140' ' ' ASP . 19.4 ttmm -51.4 -33.57 30.79 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.676 -0.491 . . . . 0.0 109.676 179.135 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 99.8 m -54.19 -66.05 0.46 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.654 -179.448 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 7.2 p -62.39 -33.38 58.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.624 -179.127 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 1.2 p -71.31 -31.93 68.02 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.613 -179.881 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 140' ' ' ASP . . . . . 0.477 ' N ' ' O ' ' A' ' 136' ' ' LYS . 49.9 t0 -68.89 -27.6 65.93 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.497 -179.816 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -69.36 -25.97 64.44 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.953 -178.84 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -64.6 -29.12 70.13 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.815 -178.513 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 80.9 mm-40 -67.19 -37.62 83.97 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.678 -179.455 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -65.56 -33.24 75.46 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.599 -179.728 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 145' ' ' ASN . . . . . . . . . . . . . 48.4 t30 -159.75 83.92 2.24 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.529 -179.358 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 146' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_exo -47.13 106.36 0.1 Allowed 'Trans proline' 0 C--N 1.305 -1.739 0 C-N-CA 122.875 2.384 . . . . 0.0 112.098 179.898 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 147' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_exo -48.72 110.57 0.36 Allowed 'Trans proline' 0 C--N 1.304 -1.815 0 C-N-CA 122.774 2.316 . . . . 0.0 112.252 -179.534 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 10.0 t -124.17 1.51 8.51 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.377 179.314 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 149' ' ' THR . . . . . 0.421 HG23 ' H ' ' A' ' 152' ' ' GLY . 5.1 t -162.12 -178.99 6.74 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.636 -179.843 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 150' ' ' ALA . . . . . 0.4 ' N ' ' OG1' ' A' ' 149' ' ' THR . . . -62.79 -34.27 76.93 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.583 -179.59 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 12.6 tt0 -66.21 -45.14 81.79 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.741 -179.707 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 152' ' ' GLY . . . . . 0.421 ' H ' HG23 ' A' ' 149' ' ' THR . . . -61.43 -44.75 97.63 Favored Glycine 0 CA--C 1.524 0.655 0 N-CA-C 110.869 -0.892 . . . . 0.0 110.869 -179.884 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 153' ' ' VAL . . . . . . . . . . . . . 99.4 t -65.77 -42.78 93.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-O 120.836 0.35 . . . . 0.0 110.468 -179.86 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 7.8 mt -51.46 -31.96 25.19 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.36 179.68 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 34.4 tp10 -64.68 -47.3 78.9 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.327 179.056 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 156' ' ' ILE . . . . . 0.57 HD12 ' N ' ' A' ' 156' ' ' ILE . 1.7 mp -64.12 -43.53 97.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.479 179.472 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -49.46 -46.89 48.51 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.358 -179.407 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 63.9 tttp -61.91 -41.91 98.46 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.092 178.89 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -65.42 -31.1 72.02 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.394 179.713 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 160' ' ' MET . . . . . . . . . . . . . 1.6 mtm -67.89 -51.49 47.39 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.869 179.689 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 76.1 ttt180 -67.77 -35.36 78.55 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.455 -179.939 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 81.1 tt0 -62.61 -48.7 78.24 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.89 -178.853 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 163' ' ' LYS . . . . . . . . . . . . . 41.1 tptt -65.42 -33.91 77.06 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.548 -179.43 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 14.2 mt -67.17 -30.45 70.42 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.915 -178.884 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 90.1 mt-30 -66.11 -35.17 79.8 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.741 -179.146 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 92.3 mtt-85 -64.73 -34.08 77.49 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.451 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 167' ' ' VAL . . . . . . . . . . . . . 11.1 t -68.39 -43.31 84.25 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.426 0 CA-C-O 120.893 0.378 . . . . 0.0 110.762 179.992 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 168' ' ' HIS . . . . . 0.402 ' ND1' ' O ' ' A' ' 168' ' ' HIS . 24.9 t-80 -80.01 -33.48 39.21 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.767 -179.546 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 169' ' ' THR . . . . . . . . . . . . . 91.5 m -70.15 -45.29 67.08 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.991 -178.542 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 58.9 mmtt -60.13 -44.27 95.03 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.612 -179.278 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 171' ' ' ASN . . . . . . . . . . . . . 48.6 t-20 -68.76 -33.05 73.25 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.992 0.425 . . . . 0.0 110.597 -179.703 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 172' ' ' TYR . . . . . 0.567 ' CE2' ' NZ ' ' A' ' 176' ' ' LYS . 53.7 t80 -62.93 -47.39 83.45 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.639 -179.442 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 68.7 m -73.75 -37.63 64.98 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.708 -179.332 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 89.5 m -62.03 -48.37 80.56 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.588 -179.315 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 12.3 tp -66.42 -34.32 77.67 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.548 -179.933 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 176' ' ' LYS . . . . . 0.567 ' NZ ' ' CE2' ' A' ' 172' ' ' TYR . 23.5 mmtp -78.01 -8.0 57.61 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.972 -179.266 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 177' ' ' LYS . . . . . . . . . . . . . 13.7 ptmt -62.5 -22.8 66.55 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.411 -179.696 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 178' ' ' LYS . . . . . . . . . . . . . 31.7 ttmt . . . . . 0 N--CA 1.455 -0.203 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.836 -179.328 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.527 0.088 0 CA-C-O 120.802 0.334 . . . . 0.0 110.492 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 98.0 m -61.53 -23.53 66.0 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.465 179.725 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 17.2 tptp -68.45 -47.21 67.75 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.245 0.545 . . . . 0.0 110.817 179.606 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.585 ' N ' HD12 ' A' ' 33' ' ' ILE . 1.7 mp -57.17 -45.49 84.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 N-CA-C 109.152 -0.684 . . . . 0.0 109.152 -179.33 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 44.8 ttm180 -69.79 -27.79 65.2 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.047 0.451 . . . . 0.0 109.968 -179.703 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 44.5 tp -68.44 -47.9 65.97 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.066 -179.605 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 22.1 pt-20 -76.83 -39.8 50.04 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.612 -179.731 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 79.5 ttt180 -62.94 -42.71 99.89 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.028 -0.533 . . . . 0.0 109.997 -179.15 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 78.0 p -63.84 -26.45 68.62 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.097 0.475 . . . . 0.0 110.256 -179.755 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -83.16 -32.22 26.73 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.067 0.461 . . . . 0.0 111.105 179.366 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -63.81 -35.18 79.77 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.015 -0.538 . . . . 0.0 111.0 -179.003 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' ASP . . . . . 0.496 ' OD1' ' N ' ' A' ' 42' ' ' ILE . 15.2 p30 -61.92 -23.62 66.46 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.669 -179.261 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.496 ' N ' ' OD1' ' A' ' 41' ' ' ASP . 75.3 mt -59.84 -49.74 82.73 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.633 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.676 -179.097 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 40.3 p -72.6 -36.73 68.17 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.047 0.451 . . . . 0.0 111.305 -178.76 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 66.4 t0 -63.0 -39.94 96.26 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.96 -178.232 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 68.2 mm-40 -71.16 -55.92 7.16 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 112.233 0.456 . . . . 0.0 112.233 -179.285 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 7.0 pt -62.0 -26.33 39.73 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.107 -178.788 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -65.47 -39.09 91.57 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.91 -0.587 . . . . 0.0 110.687 -179.836 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.16 -24.33 67.12 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-O 121.059 0.457 . . . . 0.0 110.687 -178.89 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 65.2 mt -65.94 -52.82 44.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.007 -0.542 . . . . 0.0 112.365 -178.249 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 38.5 pttt -59.33 -30.19 68.18 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.857 -178.554 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 49.6 mtpt -63.89 -43.98 94.38 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.33 -179.678 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -65.42 -43.47 90.44 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.559 -179.895 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -58.34 -30.45 66.74 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.754 -179.578 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -66.47 -35.61 80.69 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.006 -179.858 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 53.7 mt . . . . . 0 C--N 1.325 -0.468 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.31 -178.945 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 17.1 m120 . . . . . 0 CA--C 1.532 0.284 0 N-CA-C 110.265 -0.272 . . . . 0.0 110.265 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -73.52 -8.23 21.38 Favored 'Trans proline' 0 N--CA 1.489 1.236 0 C-N-CA 122.79 2.327 . . . . 0.0 112.003 -179.343 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 53.4 t80 -76.96 -50.94 12.06 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.04 0.448 . . . . 0.0 110.275 -179.92 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 16.8 tt -75.48 -27.58 19.26 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.144 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.307 -179.883 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 3.1 mp -74.0 -37.96 64.25 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.6 179.776 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 10.5 mm-40 -63.14 -25.19 68.24 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.377 -179.858 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -65.98 -45.21 82.47 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.747 -179.35 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 6.5 ttpm? -55.97 -25.75 45.22 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.627 -179.735 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 26.9 t -74.49 -46.17 43.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.724 179.685 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 91.2 mtm180 -67.25 -28.03 67.71 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.167 0.508 . . . . 0.0 110.377 -179.705 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -58.41 -41.37 84.78 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.012 -179.204 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 68.7 p -76.86 -24.1 52.65 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.716 -179.906 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 86.2 m -60.23 -51.92 67.51 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.805 -178.947 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 56.1 t -67.92 -43.34 85.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.693 -179.396 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -64.13 -31.8 73.13 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.854 -179.065 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -55.43 -41.81 73.31 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.004 -179.579 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -58.09 -34.04 69.75 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.595 -179.325 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.602 ' O ' ' HB3' ' A' ' 95' ' ' ALA . 46.0 t80 -71.29 -45.48 63.0 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.902 -179.91 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 57.3 t -53.18 -56.87 6.14 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.793 -177.627 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.402 HG21 HD13 ' A' ' 94' ' ' ILE . 23.3 pt -54.14 -30.71 20.68 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.661 -179.959 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 95' ' ' ALA . . . . . 0.602 ' HB3' ' O ' ' A' ' 92' ' ' PHE . . . -52.56 -41.89 63.97 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.351 -179.641 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 96' ' ' ILE . . . . . 0.54 ' N ' HD12 ' A' ' 96' ' ' ILE . 1.6 mp -63.87 -41.81 93.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 116.073 -0.512 . . . . 0.0 109.945 179.255 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 79.4 tt0 -61.18 -49.89 75.38 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.073 -178.452 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 80.9 mm-40 -68.04 -41.41 82.13 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.42 -179.988 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 48.5 tp10 -62.1 -43.07 99.64 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.284 -179.88 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -62.36 -35.66 79.84 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.877 0.37 . . . . 0.0 110.572 -179.545 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 99.3 m -59.3 -43.4 92.62 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.164 -179.698 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 60.1 mttp -55.69 -36.43 67.13 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.237 -0.438 . . . . 0.0 109.849 -179.459 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.536 HD22 ' N ' ' A' ' 103' ' ' LEU . 4.2 mm? . . . . . 0 CA--C 1.511 -0.556 0 N-CA-C 109.916 -0.402 . . . . 0.0 109.916 179.112 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.462 0.166 0 CA-C-O 120.924 0.392 . . . . 0.0 110.449 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -66.97 -28.03 73.64 Favored Glycine 0 CA--C 1.523 0.559 0 N-CA-C 110.686 -0.966 . . . . 0.0 110.686 -179.9 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 82.0 tt0 -61.23 -43.29 99.12 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.794 0.33 . . . . 0.0 110.544 -179.312 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 70.2 m-85 -65.43 -40.15 92.98 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.608 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 59.8 p -57.12 -31.91 65.8 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.33 -179.509 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -63.9 -29.58 70.75 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.445 179.592 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 37.3 mtp -74.95 -51.93 12.48 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.485 -179.221 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 41.6 t80 -50.15 -35.88 27.85 Favored 'General case' 0 N--CA 1.463 0.194 0 N-CA-C 110.042 -0.355 . . . . 0.0 110.042 -179.427 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 97.2 m-20 -61.8 -41.89 98.32 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.184 -0.462 . . . . 0.0 109.841 179.352 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.512 ' O ' HD23 ' A' ' 118' ' ' LEU . 1.4 tt -59.66 -40.56 88.16 Favored 'General case' 0 C--O 1.222 -0.343 0 CA-C-O 121.369 0.604 . . . . 0.0 109.685 -179.761 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 119' ' ' MET . . . . . 0.444 ' C ' ' SD ' ' A' ' 119' ' ' MET . 0.1 OUTLIER -53.15 -45.96 68.63 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.187 0.518 . . . . 0.0 109.858 -179.456 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 50.5 t80 -63.43 -41.21 98.69 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.176 0.512 . . . . 0.0 110.652 -179.013 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 14.5 mm-40 -55.48 -48.48 74.48 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.289 -178.903 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 31.1 m -71.27 -16.93 19.58 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.524 0 O-C-N 123.429 0.456 . . . . 0.0 110.819 -179.491 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 9.4 m -72.34 -24.98 61.37 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-O 121.191 0.519 . . . . 0.0 110.748 179.593 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 124' ' ' LYS . . . . . 0.541 ' N ' ' HD2' ' A' ' 125' ' ' PRO . 2.5 mptp? -65.05 -57.8 14.56 Favored Pre-proline 0 C--N 1.323 -0.578 0 CA-C-N 116.194 -0.457 . . . . 0.0 112.113 -179.376 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 125' ' ' PRO . . . . . 0.541 ' HD2' ' N ' ' A' ' 124' ' ' LYS . 30.2 Cg_endo -60.32 -30.63 91.48 Favored 'Trans proline' 0 C--N 1.307 -1.644 0 C-N-CA 122.441 2.094 . . . . 0.0 112.453 -179.01 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 92.6 mt -70.69 -24.82 62.74 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.71 179.854 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 55.2 tt0 -65.21 -39.43 92.77 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.148 -179.99 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 17.0 tptm -50.27 -44.37 53.7 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 120.576 -0.449 . . . . 0.0 110.546 -178.249 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 18.5 mt -57.52 -110.37 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.824 178.727 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 130' ' ' GLY . . . . . 0.42 ' C ' ' NE2' ' A' ' 132' ' ' GLN . . . -147.85 17.25 1.41 Allowed Glycine 0 C--N 1.332 0.356 0 N-CA-C 110.876 -0.889 . . . . 0.0 110.876 -179.489 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 76.3 mt -111.71 115.22 49.26 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.393 0 CA-C-O 120.904 0.383 . . . . 0.0 110.247 179.816 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 132' ' ' GLN . . . . . 0.478 ' O ' ' HB2' ' A' ' 133' ' ' GLU . 8.1 mp0 -139.93 -178.71 5.56 Favored 'General case' 0 CA--C 1.508 -0.645 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.077 -179.701 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 133' ' ' GLU . . . . . 0.478 ' HB2' ' O ' ' A' ' 132' ' ' GLN . 75.0 mt-10 75.48 -21.91 0.29 Allowed 'General case' 0 CA--C 1.52 -0.195 0 O-C-N 123.895 0.747 . . . . 0.0 110.622 179.497 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 134' ' ' MET . . . . . 0.462 ' H ' ' C ' ' A' ' 132' ' ' GLN . 48.5 mtp -51.27 -23.25 3.34 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.165 179.662 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 34.7 p -63.0 -63.82 1.09 Allowed 'General case' 0 C--O 1.221 -0.411 0 CA-C-O 121.486 0.66 . . . . 0.0 109.251 179.625 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 136' ' ' LYS . . . . . 0.432 ' HG2' ' H ' ' A' ' 136' ' ' LYS . 59.0 mmtt -51.38 -38.3 52.63 Favored 'General case' 0 C--N 1.318 -0.791 0 O-C-N 121.661 -0.649 . . . . 0.0 109.827 179.549 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 46.1 m -54.84 -66.01 0.48 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.548 -179.547 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 14.8 p -63.33 -34.65 68.4 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.146 -178.902 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 5.8 p -73.22 -33.55 65.41 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.758 -178.967 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 140' ' ' ASP . . . . . 0.403 ' N ' ' O ' ' A' ' 136' ' ' LYS . 8.9 t70 -65.1 -30.73 71.7 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.427 -179.614 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -62.91 -27.22 69.22 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.778 -179.176 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -59.85 -28.91 67.91 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.67 -179.169 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 70.0 mm-40 -81.53 66.16 6.97 Favored 'General case' 0 CA--C 1.517 -0.291 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.543 -179.777 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER 175.78 -37.93 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.783 -179.981 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 145' ' ' ASN . . . . . . . . . . . . . 21.1 t-20 -143.62 73.83 17.04 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.138 -179.318 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 146' ' ' PRO . . . . . 0.629 ' C ' ' H ' ' A' ' 148' ' ' THR . 86.8 Cg_exo -38.7 106.47 0.05 OUTLIER 'Trans proline' 0 C--N 1.32 -0.956 0 C-N-CA 122.945 2.43 . . . . 0.0 111.8 179.89 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 147' ' ' PRO . . . . . 0.538 ' C ' ' H ' ' A' ' 149' ' ' THR . 49.6 Cg_exo -55.17 10.27 0.03 OUTLIER 'Trans proline' 0 C--N 1.309 -1.551 0 C-N-CA 122.665 2.243 . . . . 0.0 112.4 179.224 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 148' ' ' THR . . . . . 0.629 ' H ' ' C ' ' A' ' 146' ' ' PRO . 61.8 m -55.38 -2.65 0.05 OUTLIER 'General case' 0 N--CA 1.445 -0.713 0 CA-C-O 120.744 0.307 . . . . 0.0 110.714 179.303 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 149' ' ' THR . . . . . 0.538 ' H ' ' C ' ' A' ' 147' ' ' PRO . 62.5 p -124.28 162.55 23.51 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-O 121.012 0.434 . . . . 0.0 110.223 179.458 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -68.05 -47.53 68.11 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.716 -179.814 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 87.1 mt-30 -66.14 -30.27 70.73 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.621 -179.812 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . -59.98 -34.29 82.67 Favored Glycine 0 CA--C 1.523 0.553 0 N-CA-C 111.085 -0.806 . . . . 0.0 111.085 -179.287 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 153' ' ' VAL . . . . . . . . . . . . . 62.4 t -65.61 -41.68 91.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 120.783 0.325 . . . . 0.0 110.688 -179.798 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 78.9 mt -45.31 -37.58 4.94 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.598 -179.108 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -62.3 -58.82 6.31 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.136 178.989 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 24.0 mm -53.68 -42.63 51.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.735 -179.439 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -56.71 -47.58 79.63 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 123.562 0.539 . . . . 0.0 110.548 178.948 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 34.8 tptt -61.66 -36.61 81.32 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.376 -179.797 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -72.32 -30.19 64.53 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.476 -179.658 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 160' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -66.11 -50.95 62.25 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.266 179.742 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 61.6 ttp180 -65.0 -31.24 72.38 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.099 179.522 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 40.9 tp10 -64.34 -61.31 2.31 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.124 -178.77 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 163' ' ' LYS . . . . . . . . . . . . . 23.9 tptp -60.36 -34.36 73.75 Favored 'General case' 0 N--CA 1.447 -0.605 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.533 -179.981 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 38.3 tp -66.21 -37.84 86.52 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.249 -179.881 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 65.9 mm-40 -70.14 -28.37 65.31 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.909 -179.64 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 166' ' ' ARG . . . . . 0.644 HH21 ' HZ1' ' A' ' 170' ' ' LYS . 76.0 ttt180 -63.76 -34.13 77.21 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.399 -179.91 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 167' ' ' VAL . . . . . . . . . . . . . 70.1 t -67.04 -43.69 88.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.321 -179.667 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 12.6 t60 -78.59 -31.57 47.24 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.816 -179.277 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 169' ' ' THR . . . . . . . . . . . . . 92.6 m -68.5 -47.03 68.07 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.849 -179.49 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 170' ' ' LYS . . . . . 0.644 ' HZ1' HH21 ' A' ' 166' ' ' ARG . 28.1 mmtp -60.74 -45.39 94.48 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.694 -179.539 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 171' ' ' ASN . . . . . . . . . . . . . 6.8 m120 -66.61 -36.82 83.53 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.51 179.58 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 172' ' ' TYR . . . . . . . . . . . . . 84.4 t80 -66.53 -41.6 88.51 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.67 -179.434 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 41.0 t -67.75 -39.64 84.2 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.685 -179.444 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 174' ' ' THR . . . . . 0.405 HG23 ' O ' ' A' ' 170' ' ' LYS . 31.4 p -66.01 -34.94 79.23 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.794 -179.62 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 6.3 mt -64.17 -38.45 91.11 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.032 179.497 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 66.3 mmtt -62.4 -5.76 2.74 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.527 179.979 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 177' ' ' LYS . . . . . . . . . . . . . 62.9 tttp -63.76 -42.16 97.86 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.823 179.548 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 178' ' ' LYS . . . . . . . . . . . . . 98.9 mttt . . . . . 0 C--N 1.326 -0.443 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.649 -179.827 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.172 0 CA-C-O 120.892 0.377 . . . . 0.0 110.648 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 24.8 m -64.14 -31.18 72.27 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.1 179.568 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 55.7 tptt -63.36 -50.19 70.91 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 120.315 -0.554 . . . . 0.0 110.646 -179.478 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 71.4 mt -63.16 -27.95 44.12 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.003 -178.921 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 41.4 ttm180 -71.41 -39.46 71.11 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.889 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 64.9 mt -68.93 -37.71 79.07 Favored 'General case' 0 CA--C 1.514 -0.415 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.73 -179.583 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 47.0 tp10 -73.21 -43.37 61.41 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.496 -179.741 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 43.7 ttm180 -63.4 -43.75 96.64 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.588 -179.324 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 37.9 m -69.0 -29.68 67.92 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.273 -179.961 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -75.05 -36.27 61.84 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.902 179.855 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -65.42 -31.42 72.51 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.832 -179.556 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 10.9 m-20 -66.93 -24.67 66.11 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.967 -179.635 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 98.3 mt -64.37 -48.42 85.37 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.311 0 C-N-CA 120.678 -0.409 . . . . 0.0 111.088 -179.19 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 77.2 p -73.23 -38.66 65.97 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.102 -178.712 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 65.6 t0 -64.0 -37.89 89.09 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.663 -179.364 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 9.9 tm-20 -67.36 -49.53 63.59 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.922 0.391 . . . . 0.0 111.434 -179.352 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 8.4 pt -72.18 -26.71 25.3 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.732 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.46 -179.614 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -62.33 -42.31 99.28 Favored 'General case' 0 C--N 1.322 -0.609 0 C-N-CA 120.729 -0.389 . . . . 0.0 110.525 179.337 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -53.22 -27.68 23.15 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.215 -178.918 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 66.2 mt -63.11 -45.76 97.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.077 179.62 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 23.3 mmtp -54.57 -41.31 69.7 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.153 -179.17 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 28.3 mmtp -65.51 -43.73 89.18 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.588 179.624 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 47.3 t0 -62.06 -43.86 97.92 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.386 -179.731 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -58.99 -30.73 68.19 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.909 -179.809 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -56.09 -37.45 69.38 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.054 -179.392 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.513 ' N ' HD12 ' A' ' 55' ' ' LEU . 10.0 mp . . . . . 0 C--N 1.326 -0.455 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.131 -178.487 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' ASN . . . . . 0.452 ' N ' ' OD1' ' A' ' 75' ' ' ASN . 1.4 m-20 . . . . . 0 CA--C 1.535 0.388 0 N-CA-C 110.664 -0.124 . . . . 0.0 110.664 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -70.19 6.07 1.6 Allowed 'Trans proline' 0 N--CA 1.494 1.53 0 C-N-CA 122.156 1.904 . . . . 0.0 112.156 -179.26 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 68.0 t80 -77.52 -58.99 2.97 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.948 0.404 . . . . 0.0 111.515 -179.946 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 19.6 tt -75.64 -27.98 19.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.768 -179.643 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 82.9 mt -73.54 -49.95 23.84 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.463 -178.855 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 99.2 mt-10 -64.45 -22.79 67.07 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.298 179.859 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -59.69 -28.44 67.3 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.867 0.365 . . . . 0.0 110.912 -179.862 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -69.44 -20.48 63.77 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.536 -179.921 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 50.3 t -73.66 -45.08 51.75 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-O 120.998 0.428 . . . . 0.0 110.805 179.621 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 84.3 mtp180 -66.95 -35.39 79.87 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.553 -179.799 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -66.15 -39.36 89.77 Favored 'General case' 0 CA--C 1.517 -0.324 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.58 -179.701 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 34.0 p -78.91 -14.5 59.19 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.716 -179.944 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 33.4 m -62.07 -54.5 40.46 Favored 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 120.417 -0.513 . . . . 0.0 111.456 -179.224 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.517 HG13 ' N ' ' A' ' 89' ' ' ALA . 13.2 p -79.76 -44.55 23.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-O 121.35 0.595 . . . . 0.0 111.491 179.008 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 89' ' ' ALA . . . . . 0.517 ' N ' HG13 ' A' ' 88' ' ' VAL . . . -53.58 -49.36 67.9 Favored 'General case' 0 CA--C 1.52 -0.208 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.324 -176.672 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.451 ' CG ' ' N ' ' A' ' 91' ' ' LYS . 16.0 pt-20 -58.74 -45.67 89.14 Favored 'General case' 0 C--N 1.315 -0.911 0 C-N-CA 120.793 -0.363 . . . . 0.0 110.807 -179.91 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 91' ' ' LYS . . . . . 0.451 ' N ' ' CG ' ' A' ' 90' ' ' GLU . 98.3 mttt -58.23 -36.51 73.28 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.064 -0.517 . . . . 0.0 109.856 -179.194 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 56.4 t80 -62.43 -41.6 98.84 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.834 179.612 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 81.0 t -58.27 -45.08 89.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.203 -179.142 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 65.4 mt -53.93 -42.12 52.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-O 120.802 0.334 . . . . 0.0 110.331 -179.818 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -52.47 -36.99 56.06 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.22 -179.679 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 34.9 mm -65.45 -43.54 94.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.301 -179.773 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -64.87 -49.24 71.3 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.752 -179.674 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 80.8 tt0 -63.54 -38.98 93.19 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.011 0.434 . . . . 0.0 110.413 -179.364 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -71.19 -28.98 64.62 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.296 -179.954 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -65.84 -52.38 50.93 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.657 -179.181 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 101' ' ' THR . . . . . 0.405 ' H ' HG22 ' A' ' 101' ' ' THR . 1.7 t -58.27 -35.41 71.74 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.812 -179.535 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 47.3 mttp -63.77 -29.06 70.31 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.666 179.806 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 67.1 mt . . . . . 0 C--N 1.33 -0.264 0 CA-C-O 120.732 0.301 . . . . 0.0 110.691 -179.476 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 69.0 p . . . . . 0 N--CA 1.466 0.341 0 CA-C-O 120.904 0.383 . . . . 0.0 110.432 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -72.25 -28.31 68.35 Favored Glycine 0 CA--C 1.525 0.657 0 N-CA-C 111.341 -0.704 . . . . 0.0 111.341 179.666 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 79.9 tt0 -54.38 -34.29 60.92 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.71 0.291 . . . . 0.0 110.753 -179.129 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 61.4 m-85 -61.25 -39.04 88.84 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.607 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 40.0 t -58.84 -39.9 82.63 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.34 -179.793 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -63.7 -35.71 81.47 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.79 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 96.1 mtp -68.1 -40.35 82.62 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.131 -179.901 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 29.7 t80 -58.67 -28.13 65.45 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.313 179.87 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 66.3 t0 -57.54 -35.26 70.08 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.91 0.386 . . . . 0.0 110.48 -179.112 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 21.3 mt -58.5 -40.48 82.92 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.052 0.453 . . . . 0.0 110.034 -179.62 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.26 -53.6 52.75 Favored 'General case' 0 C--N 1.313 -0.996 0 C-N-CA 120.083 -0.647 . . . . 0.0 110.058 -179.335 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 52.8 t80 -59.36 -47.05 86.91 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.112 -179.316 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 51.3 tp10 -60.16 -35.38 75.19 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.089 -179.496 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 42.8 t -83.45 -19.85 9.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 N-CA-C 110.001 -0.37 . . . . 0.0 110.001 179.841 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 60.0 p -74.88 -27.2 60.15 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.931 0.396 . . . . 0.0 111.213 -179.612 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 124' ' ' LYS . . . . . 0.501 ' N ' ' HD2' ' A' ' 125' ' ' PRO . 8.0 mmtp -66.29 -57.25 13.28 Favored Pre-proline 0 C--N 1.323 -0.585 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.53 -179.541 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 125' ' ' PRO . . . . . 0.501 ' HD2' ' N ' ' A' ' 124' ' ' LYS . 23.8 Cg_endo -58.44 -31.66 94.63 Favored 'Trans proline' 0 C--N 1.314 -1.242 0 C-N-CA 122.24 1.96 . . . . 0.0 111.837 -179.358 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 81.2 mt -68.34 -32.53 72.71 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.676 -179.942 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -59.24 -47.05 86.78 Favored 'General case' 0 C--N 1.317 -0.82 0 C-N-CA 120.406 -0.517 . . . . 0.0 110.421 -179.29 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -69.67 -11.74 61.08 Favored 'General case' 0 CA--C 1.509 -0.619 0 CA-C-N 116.041 -0.527 . . . . 0.0 109.799 -179.614 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.422 HD22 ' HA ' ' A' ' 129' ' ' LEU . 0.2 OUTLIER -87.45 -55.93 3.58 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.168 0.509 . . . . 0.0 110.5 -179.741 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -175.67 -137.68 2.62 Favored Glycine 0 N--CA 1.451 -0.353 0 N-CA-C 110.675 -0.97 . . . . 0.0 110.675 -179.084 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 131' ' ' ILE . . . . . 0.687 HG22 ' H ' ' A' ' 132' ' ' GLN . 1.7 mt 54.26 -150.38 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 N-CA-C 109.944 -0.391 . . . . 0.0 109.944 179.309 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 132' ' ' GLN . . . . . 0.687 ' H ' HG22 ' A' ' 131' ' ' ILE . 4.6 tt0 179.99 138.15 0.12 Allowed 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.424 179.785 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 51.06 24.74 2.0 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.882 0.372 . . . . 0.0 110.848 178.479 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 10.4 tpt -58.95 -40.19 83.94 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.895 -0.593 . . . . 0.0 109.985 -179.605 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 21.7 m -74.19 -61.34 1.89 Allowed 'General case' 0 N--CA 1.467 0.413 0 CA-C-O 121.606 0.717 . . . . 0.0 110.284 -179.996 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 2.2 tppp? -49.31 -42.17 40.58 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-O 121.518 0.675 . . . . 0.0 110.451 -178.354 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 23.0 m -56.11 -68.49 0.2 Allowed 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.298 -0.864 . . . . 0.0 111.194 -179.241 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 14.6 p -55.92 -34.74 38.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 C-N-CA 120.723 -0.391 . . . . 0.0 110.681 -178.629 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 25.0 p -63.91 -36.89 85.44 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.622 -179.863 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 57.0 t0 -66.19 -28.06 68.48 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.594 179.811 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -67.23 -42.34 84.18 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-O 120.837 0.351 . . . . 0.0 111.1 -179.655 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -62.94 -30.13 71.33 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.396 -179.513 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 77.5 tt0 -68.31 -39.98 81.85 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.768 0.318 . . . . 0.0 110.71 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 78.7 tt0 -70.27 -41.32 73.58 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.904 -179.591 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 145' ' ' ASN . . . . . . . . . . . . . 30.0 m120 -135.27 76.57 56.54 Favored Pre-proline 0 N--CA 1.468 0.45 0 CA-C-N 116.607 -0.269 . . . . 0.0 110.556 -179.459 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 146' ' ' PRO . . . . . . . . . . . . . 78.5 Cg_exo -48.72 109.59 0.27 Allowed 'Trans proline' 0 N--CA 1.492 1.4 0 C-N-CA 122.601 2.201 . . . . 0.0 111.45 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 147' ' ' PRO . . . . . . . . . . . . . 85.1 Cg_exo -46.86 116.93 1.87 Allowed 'Trans proline' 0 N--CA 1.494 1.505 0 C-N-CA 121.813 1.675 . . . . 0.0 112.472 -179.759 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 9.1 m -130.7 -7.64 4.06 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.637 179.247 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 149' ' ' THR . . . . . 0.585 HG22 ' N ' ' A' ' 150' ' ' ALA . 85.3 m -159.51 167.34 28.84 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.849 0.357 . . . . 0.0 110.266 179.506 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 150' ' ' ALA . . . . . 0.585 ' N ' HG22 ' A' ' 149' ' ' THR . . . -51.91 -28.91 17.92 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.131 179.769 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 84.7 mt-30 -73.07 -40.48 65.0 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.476 179.501 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . -59.53 -46.09 94.53 Favored Glycine 0 C--O 1.223 -0.555 0 N-CA-C 111.015 -0.834 . . . . 0.0 111.015 -179.593 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 153' ' ' VAL . . . . . . . . . . . . . 58.3 t -63.4 -42.25 95.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-O 120.831 0.348 . . . . 0.0 110.459 -179.807 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 154' ' ' LEU . . . . . 0.406 HD23 ' O ' ' A' ' 154' ' ' LEU . 0.8 OUTLIER -51.28 -36.17 40.92 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.254 -178.881 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 97.3 mt-10 -67.51 -33.79 75.8 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.082 -179.952 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 11.6 mm -77.82 -39.08 25.81 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.275 0 CA-C-O 121.028 0.442 . . . . 0.0 111.024 179.496 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -62.4 -40.69 97.31 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.641 -179.127 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -60.11 -45.87 91.51 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.045 0.45 . . . . 0.0 110.041 -179.802 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 61.8 tttm -66.65 -27.56 67.77 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.92 -179.716 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 160' ' ' MET . . . . . . . . . . . . . 22.6 mtp -74.17 -51.63 14.95 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.883 0.373 . . . . 0.0 110.451 -179.492 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 28.7 ttm180 -64.56 -37.47 87.67 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.671 -179.196 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 51.4 mm-40 -62.21 -42.73 99.56 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.854 -179.214 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 163' ' ' LYS . . . . . . . . . . . . . 86.5 tttt -65.44 -55.22 19.17 Favored 'General case' 0 C--N 1.323 -0.547 0 C-N-CA 120.316 -0.553 . . . . 0.0 110.653 -179.191 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 9.1 mp -53.34 -32.45 49.17 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.948 0.404 . . . . 0.0 110.152 -179.333 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 61.2 tp60 -62.09 -45.92 91.39 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.439 -179.412 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 69.2 ttp85 -64.3 -30.76 71.79 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.24 0.543 . . . . 0.0 111.041 -179.845 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 167' ' ' VAL . . . . . . . . . . . . . 56.0 t -69.56 -44.84 79.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 115.41 -0.814 . . . . 0.0 110.511 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 168' ' ' HIS . . . . . 0.423 ' O ' ' ND1' ' A' ' 168' ' ' HIS . 31.0 t-80 -77.7 -30.3 51.76 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.081 179.995 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 169' ' ' THR . . . . . 0.442 ' O ' ' SG ' ' A' ' 173' ' ' CYS . 91.3 m -69.26 -49.84 52.5 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.841 -179.913 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 28.5 mmtp -63.73 -45.05 91.65 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.828 0.346 . . . . 0.0 111.068 -179.263 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 171' ' ' ASN . . . . . . . . . . . . . 97.9 m-20 -65.21 -39.71 93.14 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.121 -179.753 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 172' ' ' TYR . . . . . . . . . . . . . 66.2 t80 -75.04 -34.42 61.86 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.799 179.83 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 173' ' ' CYS . . . . . 0.442 ' SG ' ' O ' ' A' ' 169' ' ' THR . 66.9 m -71.62 -23.05 61.64 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.482 179.95 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 19.3 m -62.25 -42.77 99.62 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.689 -179.815 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 175' ' ' LEU . . . . . 0.498 ' N ' HD12 ' A' ' 175' ' ' LEU . 10.1 mp -65.83 -34.61 78.55 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.575 -179.238 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -55.49 -30.79 61.27 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.322 -179.553 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 177' ' ' LYS . . . . . . . . . . . . . 85.8 tttt -61.08 -33.75 73.83 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.57 179.543 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 178' ' ' LYS . . . . . . . . . . . . . 55.7 mtpt . . . . . 0 C--N 1.32 -0.68 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.085 -179.912 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.144 0 CA-C-O 120.957 0.408 . . . . 0.0 110.315 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 19.6 m -65.4 -35.38 80.76 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.585 179.653 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 64.0 tttp -62.72 -53.14 58.95 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.046 0.45 . . . . 0.0 110.685 -179.57 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 71.1 mt -63.1 -30.23 49.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.093 -179.842 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 40.5 ttm180 -67.23 -41.97 84.82 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.754 -179.85 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 46.8 mt -73.47 -36.37 65.82 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.504 -0.316 . . . . 0.0 111.132 -179.61 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 78.6 tt0 -63.18 -50.77 69.03 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.537 -179.112 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -69.93 -44.61 69.23 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.841 0.353 . . . . 0.0 110.628 -179.671 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 70.3 m -62.68 -35.81 80.87 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.614 -179.974 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -73.69 -39.65 64.23 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.351 -179.913 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 37.4 ttmt -61.44 -31.94 71.9 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.66 -179.051 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -68.18 -23.52 64.86 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.73 -179.437 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 63.5 mt -64.91 -50.38 75.36 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 C-N-CA 120.627 -0.429 . . . . 0.0 111.333 -179.143 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 71.9 p -75.24 -42.28 55.64 Favored 'General case' 0 C--O 1.223 -0.321 0 CA-C-O 121.043 0.449 . . . . 0.0 111.762 -178.662 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 82.2 m-20 -62.11 -34.34 76.15 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.773 -178.322 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 55.5 mm-40 -72.76 -56.1 5.76 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.874 0.369 . . . . 0.0 111.571 -179.529 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.562 ' O ' HG22 ' A' ' 49' ' ' ILE . 9.7 pt -63.81 -27.75 43.52 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.069 -178.838 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 88.4 m-20 -70.72 -35.08 72.54 Favored 'General case' 0 N--CA 1.465 0.275 0 O-C-N 123.342 0.401 . . . . 0.0 110.907 179.841 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -52.66 -21.18 3.69 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.45 -179.501 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.562 HG22 ' O ' ' A' ' 46' ' ' ILE . 16.9 tt -60.61 -40.55 84.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.837 -179.501 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.441 ' N ' HG23 ' A' ' 49' ' ' ILE . 56.0 mtpt -51.6 -34.92 39.43 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.505 -178.744 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 34.4 mmtp -66.87 -39.5 87.55 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.61 179.865 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 50.5 t0 -70.35 -51.82 27.15 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.776 0.322 . . . . 0.0 110.844 -179.756 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -55.07 -34.34 63.51 Favored 'General case' 0 C--O 1.222 -0.351 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.445 -179.5 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -58.66 -31.69 68.41 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.887 0.375 . . . . 0.0 110.819 179.956 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 61.0 mt . . . . . 0 C--N 1.326 -0.426 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.937 -179.268 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 75' ' ' ASN . . . . . 0.577 ' C ' ' H ' ' A' ' 77' ' ' PHE . 8.0 m120 . . . . . 0 N--CA 1.472 0.653 0 N-CA-C 109.465 -0.569 . . . . 0.0 109.465 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_exo -59.3 18.62 0.03 OUTLIER 'Trans proline' 0 N--CA 1.498 1.789 0 C-N-CA 122.642 2.228 . . . . 0.0 112.401 179.656 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' PHE . . . . . 0.577 ' H ' ' C ' ' A' ' 75' ' ' ASN . 75.3 t80 -75.06 -52.75 10.28 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.017 0.437 . . . . 0.0 110.925 179.803 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 15.1 tt -76.33 -27.57 17.66 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.244 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.319 -179.879 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 56.6 mt -72.99 -43.69 61.92 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.032 0.444 . . . . 0.0 111.377 -179.684 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 92.0 mt-10 -67.6 -24.17 65.45 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.54 179.477 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -64.92 -34.33 78.16 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.878 0.37 . . . . 0.0 111.004 -179.9 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 48.7 mtmt -72.89 -20.64 61.05 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.698 -179.663 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 48.3 t -72.81 -44.89 57.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 121.016 0.436 . . . . 0.0 110.61 179.865 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 91.4 mtt-85 -71.14 -30.03 65.98 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.361 -179.874 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -65.07 -46.4 81.31 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.047 0.451 . . . . 0.0 111.568 -179.146 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 5.7 t -75.43 -20.87 58.6 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.288 179.966 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 96.3 m -62.05 -53.54 54.13 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.528 -0.469 . . . . 0.0 111.244 -179.218 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 35.4 t -70.41 -44.32 77.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-O 121.092 0.473 . . . . 0.0 110.829 -179.591 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -59.17 -36.7 75.78 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.971 -0.558 . . . . 0.0 110.601 -179.052 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 84.3 tt0 -56.68 -44.93 81.93 Favored 'General case' 0 C--N 1.323 -0.577 0 C-N-CA 120.565 -0.454 . . . . 0.0 110.515 -179.933 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 9.7 mtpm? -56.66 -39.18 73.29 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.371 -179.3 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 76.9 t80 -59.3 -45.97 89.84 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.806 -179.855 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 65.2 t -56.03 -44.86 79.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-O 120.83 0.348 . . . . 0.0 110.401 -178.817 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 96.7 mt -58.94 -41.17 82.26 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 -179.335 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -56.1 -44.7 79.32 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.464 -0.334 . . . . 0.0 110.751 -179.452 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 44.4 mm -61.42 -41.78 91.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.177 -179.682 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 83.7 tt0 -60.61 -48.57 81.2 Favored 'General case' 0 C--N 1.323 -0.58 0 C-N-CA 120.651 -0.42 . . . . 0.0 110.586 -179.825 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 14.8 mm-40 -66.22 -32.22 73.52 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.561 -179.55 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -59.7 -39.65 85.32 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.417 -179.152 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -59.28 -27.59 65.96 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.037 -0.528 . . . . 0.0 110.302 -179.416 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 8.5 m -60.65 -43.33 97.71 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.504 -179.48 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -71.22 -16.57 62.51 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.472 -179.603 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 77.8 mt . . . . . 0 CA--C 1.5 -0.966 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.406 -179.341 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 15.0 m . . . . . 0 CA--C 1.527 0.091 0 CA-C-O 120.844 0.354 . . . . 0.0 110.449 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -59.04 -33.36 73.99 Favored Glycine 0 CA--C 1.522 0.487 0 N-CA-C 110.792 -0.923 . . . . 0.0 110.792 -179.658 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 42.7 tp10 -66.73 -43.34 84.5 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 120.77 -0.372 . . . . 0.0 110.3 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 112' ' ' PHE . . . . . 0.436 ' O ' ' N ' ' A' ' 115' ' ' MET . 48.3 m-85 -67.62 -37.57 82.68 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.625 -179.956 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 59.9 p -47.31 -34.71 7.08 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.967 0.413 . . . . 0.0 110.67 -179.039 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -76.44 -28.85 56.74 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.778 178.854 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 115' ' ' MET . . . . . 0.436 ' N ' ' O ' ' A' ' 112' ' ' PHE . 60.9 mmm -73.38 -44.71 58.0 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.234 -179.844 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 7.4 m-85 -60.24 -49.43 77.64 Favored 'General case' 0 CA--C 1.513 -0.445 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 -179.388 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 66.8 t0 -47.75 -32.15 5.58 Favored 'General case' 0 N--CA 1.453 -0.28 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 -179.084 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.515 ' O ' HD13 ' A' ' 118' ' ' LEU . 0.2 OUTLIER -62.23 -44.81 95.72 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.73 -179.992 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 119' ' ' MET . . . . . 0.415 ' C ' ' SD ' ' A' ' 119' ' ' MET . 0.0 OUTLIER -52.16 -42.91 63.79 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.238 -0.892 . . . . 0.0 109.724 -178.988 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 85.4 m-85 -68.06 -39.61 82.97 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.06 -179.828 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 87.7 mt-10 -59.61 -45.76 90.96 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.779 -179.344 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 122' ' ' VAL . . . . . 0.552 ' O ' HD23 ' A' ' 126' ' ' LEU . 7.7 p -75.08 -24.66 17.88 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.822 0 O-C-N 123.314 0.384 . . . . 0.0 110.042 179.344 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 23.0 t -75.5 -25.75 57.55 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.832 0.348 . . . . 0.0 111.037 179.862 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 124' ' ' LYS . . . . . 0.481 ' N ' ' HD2' ' A' ' 125' ' ' PRO . 43.6 tptt -59.55 -57.25 28.32 Favored Pre-proline 0 CA--C 1.549 0.92 0 C-N-CA 120.557 -0.457 . . . . 0.0 110.777 179.797 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 125' ' ' PRO . . . . . 0.481 ' HD2' ' N ' ' A' ' 124' ' ' LYS . 31.8 Cg_endo -60.28 -25.78 81.02 Favored 'Trans proline' 0 N--CA 1.489 1.208 0 C-N-CA 122.597 2.198 . . . . 0.0 111.783 -178.387 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.552 HD23 ' O ' ' A' ' 122' ' ' VAL . 2.5 mm? -64.65 -32.77 74.57 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.69 -179.211 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 78.6 mt-30 -57.28 -38.22 73.58 Favored 'General case' 0 C--N 1.31 -1.129 0 C-N-CA 120.403 -0.519 . . . . 0.0 110.306 -179.859 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 32.4 mmtp -61.61 -10.98 9.45 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.752 -179.614 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 15.4 mt -114.47 -2.52 13.18 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.973 179.743 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 130' ' ' GLY . . . . . 0.525 ' O ' ' C ' ' A' ' 131' ' ' ILE . . . 114.43 -94.78 0.7 Allowed Glycine 0 CA--C 1.503 -0.687 0 N-CA-C 109.82 -1.312 . . . . 0.0 109.82 179.942 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 131' ' ' ILE . . . . . 0.525 ' C ' ' O ' ' A' ' 130' ' ' GLY . 4.8 mp -3.46 88.46 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.084 0 O-C-N 124.902 1.001 . . . . 0.0 110.703 179.837 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 132' ' ' GLN . . . . . 0.489 ' O ' ' HB2' ' A' ' 133' ' ' GLU . 19.4 tt0 -123.51 162.62 22.54 Favored 'General case' 0 CA--C 1.486 -1.514 0 N-CA-C 107.294 -1.372 . . . . 0.0 107.294 -178.583 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 133' ' ' GLU . . . . . 0.489 ' HB2' ' O ' ' A' ' 132' ' ' GLN . 92.4 mt-10 106.22 -19.4 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.972 0 O-C-N 125.785 1.928 . . . . 0.0 109.757 179.536 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 5.0 mtp -52.85 -48.2 67.22 Favored 'General case' 0 C--N 1.319 -0.735 0 C-N-CA 120.36 -0.536 . . . . 0.0 110.899 -179.277 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 65.7 p -52.58 -21.62 4.07 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.57 178.796 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 70.3 mmtt -83.31 -48.09 10.8 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 115.626 -0.715 . . . . 0.0 111.304 -179.651 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 46.5 p -54.05 -50.22 67.2 Favored 'General case' 0 C--N 1.324 -0.505 0 C-N-CA 120.827 -0.349 . . . . 0.0 110.745 -178.983 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 58.3 t -68.72 -44.35 82.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.088 -179.881 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 47.6 t -65.34 -41.29 94.07 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.954 0.407 . . . . 0.0 111.14 -179.846 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -64.21 -42.1 96.76 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.665 -179.539 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -63.54 -47.59 80.96 Favored 'General case' 0 CA--C 1.519 -0.248 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.998 -179.626 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -46.54 -35.46 5.8 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.944 -179.292 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -90.61 77.15 6.43 Favored 'General case' 0 CA--C 1.517 -0.301 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 179.509 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 79.2 tt0 -177.64 -61.23 0.01 OUTLIER 'General case' 0 C--N 1.334 -0.077 0 O-C-N 123.593 0.558 . . . . 0.0 110.434 179.644 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 145' ' ' ASN . . . . . . . . . . . . . 7.2 p-10 -143.01 64.63 14.71 Favored Pre-proline 0 N--CA 1.467 0.402 0 CA-C-N 116.196 -0.457 . . . . 0.0 109.897 -179.575 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 146' ' ' PRO . . . . . 0.547 ' O ' ' N ' ' A' ' 148' ' ' THR . 80.7 Cg_exo -34.24 98.78 0.02 OUTLIER 'Trans proline' 0 N--CA 1.491 1.329 0 C-N-CA 123.304 2.669 . . . . 0.0 111.722 -179.503 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 147' ' ' PRO . . . . . 0.526 ' C ' ' H ' ' A' ' 149' ' ' THR . 59.6 Cg_exo -51.48 74.2 0.02 OUTLIER 'Trans proline' 0 N--CA 1.496 1.671 0 C-N-CA 122.354 2.036 . . . . 0.0 113.14 -179.294 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 148' ' ' THR . . . . . 0.547 ' N ' ' O ' ' A' ' 146' ' ' PRO . 8.1 p -73.17 21.43 0.08 Allowed 'General case' 0 C--N 1.329 -0.309 0 O-C-N 121.997 -0.439 . . . . 0.0 109.981 179.883 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 149' ' ' THR . . . . . 0.656 HG23 ' H ' ' A' ' 152' ' ' GLY . 1.2 t -148.52 156.36 42.34 Favored 'General case' 0 CA--C 1.52 -0.176 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.161 -179.881 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -64.75 -33.78 76.78 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.958 -179.784 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 56.7 tt0 -68.74 -44.41 73.85 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.881 0.372 . . . . 0.0 110.753 -179.784 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 152' ' ' GLY . . . . . 0.656 ' H ' HG23 ' A' ' 149' ' ' THR . . . -56.53 -38.3 79.97 Favored Glycine 0 CA--C 1.52 0.366 0 N-CA-C 110.871 -0.892 . . . . 0.0 110.871 -179.198 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 153' ' ' VAL . . . . . . . . . . . . . 75.9 t -53.51 -32.53 20.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 C-N-CA 120.923 -0.311 . . . . 0.0 110.503 -179.392 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 72.5 mt -56.85 -27.47 60.37 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.94 0.4 . . . . 0.0 110.112 -179.505 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 67.3 mm-40 -66.92 -32.82 74.33 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.258 179.583 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 156' ' ' ILE . . . . . 0.428 HG22 ' SD ' ' A' ' 160' ' ' MET . 14.7 mm -75.23 -41.53 44.07 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.182 0 CA-C-O 120.931 0.396 . . . . 0.0 110.88 179.605 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -50.8 -39.22 52.3 Favored 'General case' 0 CA--C 1.516 -0.341 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.379 -179.646 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 158' ' ' LYS . . . . . 0.436 ' O ' ' CB ' ' A' ' 162' ' ' GLU . 99.6 mttt -56.38 -56.63 18.76 Favored 'General case' 0 C--O 1.216 -0.664 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.447 179.787 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 42.7 mmtm -57.96 -36.49 72.66 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.757 0.313 . . . . 0.0 111.007 -179.375 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 160' ' ' MET . . . . . 0.428 ' SD ' HG22 ' A' ' 156' ' ' ILE . 6.2 mtp -67.44 -57.4 6.61 Favored 'General case' 0 C--N 1.322 -0.588 0 C-N-CA 120.398 -0.521 . . . . 0.0 110.826 -179.526 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 61.4 ttp180 -68.71 -35.86 77.71 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.881 -179.483 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 162' ' ' GLU . . . . . 0.436 ' CB ' ' O ' ' A' ' 158' ' ' LYS . 81.2 tt0 -65.14 -35.54 81.42 Favored 'General case' 0 CA--C 1.512 -0.495 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.536 -179.275 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 163' ' ' LYS . . . . . . . . . . . . . 23.3 tptm -70.58 -56.5 6.37 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 119.992 -0.683 . . . . 0.0 110.845 -179.131 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 4.8 mt -55.17 -28.96 56.67 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.187 0.518 . . . . 0.0 110.081 -178.519 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 54.3 tt0 -61.71 -47.82 83.56 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.718 -0.673 . . . . 0.0 110.388 -179.71 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -62.09 -30.52 71.06 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.4 0.619 . . . . 0.0 110.731 -179.595 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 167' ' ' VAL . . . . . . . . . . . . . 51.8 t -67.2 -46.57 83.89 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-N 115.038 -0.983 . . . . 0.0 110.693 -179.694 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 168' ' ' HIS . . . . . 0.469 ' O ' ' ND1' ' A' ' 168' ' ' HIS . 23.6 t-80 -79.68 -30.52 41.15 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.193 -179.791 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 169' ' ' THR . . . . . . . . . . . . . 27.5 m -72.99 -45.35 58.41 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.409 -179.904 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 64.7 tttm -61.9 -42.26 98.87 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.663 -179.047 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 171' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 -69.84 -31.47 69.35 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.609 179.829 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 172' ' ' TYR . . . . . . . . . . . . . 74.2 t80 -70.05 -32.26 70.29 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.887 -179.833 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 86.5 m -76.24 -32.93 59.15 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.734 -179.822 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 21.4 p -63.62 -37.17 86.33 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.842 0.353 . . . . 0.0 110.477 -179.856 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 94.9 mt -65.49 -34.78 79.07 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.39 -179.928 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 72.6 mmtt -63.44 -8.63 9.64 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.477 -179.818 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 177' ' ' LYS . . . . . . . . . . . . . 62.7 tttm -63.42 -35.86 81.84 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.658 179.124 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 178' ' ' LYS . . . . . . . . . . . . . 99.5 mttt . . . . . 0 C--N 1.325 -0.491 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.863 179.897 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.55 0 CA-C-O 120.988 0.423 . . . . 0.0 109.963 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 25.4 m -49.18 -29.32 5.36 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.55 -178.86 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 21.0 pttp -61.94 -26.3 68.11 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.5 179.596 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 96.6 mt -59.07 -45.12 92.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 -178.549 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 10.1 tpt180 -65.61 -53.07 46.73 Favored 'General case' 0 C--N 1.324 -0.506 0 C-N-CA 120.158 -0.617 . . . . 0.0 110.365 -179.69 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.441 HD12 ' N ' ' A' ' 35' ' ' LEU . 11.0 mp -59.87 -44.9 93.92 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.054 -0.521 . . . . 0.0 109.696 -178.635 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 80.9 tt0 -58.94 -51.01 71.89 Favored 'General case' 0 C--N 1.32 -0.717 0 C-N-CA 120.479 -0.488 . . . . 0.0 110.234 -179.505 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 16.5 mmm180 -68.69 -42.43 77.8 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.962 0.411 . . . . 0.0 110.968 -179.766 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 52.0 m -67.52 -40.08 85.08 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.609 -179.89 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -61.01 -49.49 77.23 Favored 'General case' 0 C--O 1.219 -0.51 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.491 -179.536 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -54.4 -42.75 70.79 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 120.683 -0.407 . . . . 0.0 110.25 -179.09 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 23.9 m-20 -52.93 -22.87 6.11 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.713 179.594 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 81.1 mt -65.81 -59.01 4.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 C-N-CA 120.184 -0.606 . . . . 0.0 110.98 -179.819 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 82.8 p -76.71 -37.22 56.47 Favored 'General case' 0 C--O 1.225 -0.188 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.657 -179.009 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 52.6 t0 -61.94 -41.04 97.5 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.836 -0.62 . . . . 0.0 112.427 -178.088 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 64.8 mm-40 -69.1 -51.76 35.28 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.873 0.368 . . . . 0.0 111.419 -179.194 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 10.2 pt -66.91 -28.59 43.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.531 -179.333 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -61.43 -40.47 94.56 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 110.036 -0.357 . . . . 0.0 110.036 -179.785 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -53.41 -30.07 38.29 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.331 -179.15 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 62.8 mt -67.6 -43.42 86.96 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.333 179.454 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 69.0 mttm -58.21 -46.28 86.12 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.159 -179.087 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 52.1 mtmt -65.62 -41.07 93.11 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.662 179.401 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 96.6 m-20 -61.59 -39.37 90.93 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.029 -179.377 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -60.86 -31.97 71.4 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.596 -179.992 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -59.35 -30.82 68.67 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.892 0.377 . . . . 0.0 110.921 -179.701 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 57.3 mt . . . . . 0 C--N 1.325 -0.494 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.609 -179.349 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 69.8 m-20 . . . . . 0 CA--C 1.534 0.347 0 N-CA-C 110.321 -0.252 . . . . 0.0 110.321 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -74.53 -5.67 17.21 Favored 'Trans proline' 0 N--CA 1.495 1.58 0 C-N-CA 122.443 2.095 . . . . 0.0 111.971 179.903 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 53.5 t80 -72.36 -50.95 22.92 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.907 0.384 . . . . 0.0 111.513 -179.413 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 64.7 mt -69.74 -29.0 39.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.935 -179.296 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.421 ' N ' HD12 ' A' ' 79' ' ' LEU . 8.1 mp -77.01 -48.71 17.18 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 120.862 0.363 . . . . 0.0 110.174 179.778 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -65.44 -29.33 69.99 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.095 -0.502 . . . . 0.0 109.922 179.937 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -66.78 -37.28 84.27 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.706 179.662 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 37.0 ttpt -63.78 -24.2 67.67 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.744 -179.596 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 32.3 t -70.69 -46.6 68.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.668 179.859 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 57.8 ttt85 -62.28 -33.18 74.14 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.32 -179.642 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -59.28 -37.6 78.08 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.121 0.486 . . . . 0.0 110.895 -179.427 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 61.3 p -72.11 -27.7 62.8 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.36 179.638 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 25.0 m -57.61 -53.77 54.4 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 120.443 -0.503 . . . . 0.0 111.252 -178.778 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.565 HG23 ' N ' ' A' ' 89' ' ' ALA . 26.8 m -72.46 -50.8 32.57 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-O 120.92 0.39 . . . . 0.0 111.338 179.668 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 89' ' ' ALA . . . . . 0.565 ' N ' HG23 ' A' ' 88' ' ' VAL . . . -55.57 -44.25 76.71 Favored 'General case' 0 C--O 1.222 -0.376 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.341 -178.323 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 77.8 tt0 -58.2 -45.45 87.57 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.193 0.52 . . . . 0.0 110.584 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 57.3 mtpt -60.87 -29.65 69.67 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.63 -179.206 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.455 ' CZ ' HD12 ' A' ' 118' ' ' LEU . 82.7 t80 -71.05 -59.38 2.81 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.987 -178.859 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 8.4 m -49.4 -40.29 14.23 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.448 0 N-CA-C 109.921 -0.4 . . . . 0.0 109.921 -178.801 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 88.9 mt -61.94 -43.06 96.97 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 N-CA-C 109.888 -0.412 . . . . 0.0 109.888 179.52 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -57.52 -30.98 65.6 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 120.876 -0.33 . . . . 0.0 110.801 -179.112 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 40.7 mm -59.87 -36.51 67.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.44 -179.512 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -65.78 -34.41 78.12 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.938 179.907 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -65.05 -39.53 93.43 Favored 'General case' 0 C--N 1.326 -0.45 0 C-N-CA 120.851 -0.34 . . . . 0.0 110.358 -179.469 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 80.7 mm-40 -67.38 -39.0 85.59 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.908 0.385 . . . . 0.0 110.744 -179.832 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -53.27 -48.34 68.39 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.956 0.408 . . . . 0.0 110.81 -179.634 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 11.9 m -60.1 -48.24 82.57 Favored 'General case' 0 C--N 1.321 -0.652 0 C-N-CA 120.472 -0.491 . . . . 0.0 110.847 -179.392 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 5.8 mptp? -67.21 -31.57 72.03 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.802 0.334 . . . . 0.0 111.009 179.935 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 27.1 mt . . . . . 0 C--N 1.321 -0.635 0 CA-C-O 120.869 0.366 . . . . 0.0 110.679 -178.803 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 91.4 p . . . . . 0 N--CA 1.469 0.493 0 CA-C-O 120.675 0.274 . . . . 0.0 110.366 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -71.76 -52.79 10.97 Favored Glycine 0 CA--C 1.526 0.754 0 N-CA-C 111.355 -0.698 . . . . 0.0 111.355 179.89 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 111' ' ' GLU . . . . . 0.505 ' CD ' ' H ' ' A' ' 111' ' ' GLU . 2.5 mp0 -68.31 -22.62 64.7 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.916 0.389 . . . . 0.0 110.876 -179.491 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -59.42 -43.79 92.98 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.24 -178.987 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 43.8 t -60.1 -43.44 95.56 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.212 -179.891 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -65.11 -28.89 69.75 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.733 179.642 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 50.1 tpp -76.11 -52.54 9.92 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.245 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 36.9 t80 -62.08 -50.18 72.97 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 109.777 -0.453 . . . . 0.0 109.777 -179.685 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 52.2 t0 -48.58 -27.73 2.97 Favored 'General case' 0 CA--C 1.517 -0.29 0 N-CA-C 109.652 -0.499 . . . . 0.0 109.652 -179.073 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.49 ' O ' HD13 ' A' ' 118' ' ' LEU . 0.2 OUTLIER -64.68 -46.14 83.7 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.498 0.666 . . . . 0.0 109.893 -179.926 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 14.4 tpt -57.96 -34.26 69.74 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 114.987 -1.006 . . . . 0.0 109.638 -179.305 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 68.1 t80 -71.0 -41.1 71.38 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.317 -0.401 . . . . 0.0 112.046 -179.41 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 65.5 mm-40 -63.45 -44.87 93.24 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.87 -178.937 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 28.9 m -75.22 -23.97 17.37 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.405 0 O-C-N 123.326 0.391 . . . . 0.0 110.749 -179.898 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 21.2 t -68.0 -33.16 74.08 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.631 179.69 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 17.1 mttp -60.24 -56.68 33.06 Favored Pre-proline 0 CA--C 1.541 0.626 0 C-N-CA 121.05 -0.26 . . . . 0.0 110.833 -179.421 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 75.8 Cg_exo -43.58 -36.5 7.18 Favored 'Trans proline' 0 C--N 1.317 -1.113 0 C-N-CA 122.14 1.893 . . . . 0.0 112.442 178.402 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.51 ' HB3' HD13 ' A' ' 131' ' ' ILE . 10.1 mp -70.29 -35.13 73.51 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.981 -179.862 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 17.2 mm100 -61.51 -52.41 64.6 Favored 'General case' 0 C--N 1.32 -0.683 0 C-N-CA 120.248 -0.581 . . . . 0.0 110.728 -179.427 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 50.1 mtmt -63.78 -10.98 22.82 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.18 -179.57 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.412 ' C ' HD23 ' A' ' 129' ' ' LEU . 2.5 tt -97.86 -67.62 0.84 Allowed 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.278 -179.778 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 130' ' ' GLY . . . . . 0.66 ' C ' HD12 ' A' ' 131' ' ' ILE . . . -155.51 -138.51 2.58 Favored Glycine 0 CA--C 1.518 0.259 0 N-CA-C 110.688 -0.965 . . . . 0.0 110.688 -179.231 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 131' ' ' ILE . . . . . 1.042 HG22 ' H ' ' A' ' 132' ' ' GLN . 3.3 mp 53.28 -158.41 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.517 -0.298 0 N-CA-C 109.654 -0.499 . . . . 0.0 109.654 -179.771 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 132' ' ' GLN . . . . . 1.042 ' H ' HG22 ' A' ' 131' ' ' ILE . 6.0 tp60 177.43 139.52 0.08 Allowed 'General case' 0 N--CA 1.446 -0.654 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 179.866 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 94.1 mt-10 59.28 26.12 14.88 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-O 120.966 0.412 . . . . 0.0 111.455 178.135 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 9.3 tpt -57.79 -39.93 78.69 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.087 -179.798 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 56.8 p -75.22 -61.72 1.8 Allowed 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 121.363 0.602 . . . . 0.0 110.696 -179.699 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 17.7 ttmm -49.24 -44.27 43.41 Favored 'General case' 0 C--N 1.32 -0.679 0 C-N-CA 120.455 -0.498 . . . . 0.0 110.524 -178.327 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 76.8 m -55.52 -68.44 0.2 Allowed 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.323 -179.299 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 138' ' ' VAL . . . . . 0.41 HG13 ' N ' ' A' ' 139' ' ' SER . 11.7 p -59.86 -38.89 78.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.993 0.425 . . . . 0.0 110.469 -178.891 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 139' ' ' SER . . . . . 0.41 ' N ' HG13 ' A' ' 138' ' ' VAL . 15.9 m -63.23 -38.5 91.4 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.753 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -63.09 -31.42 72.56 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.009 -0.542 . . . . 0.0 110.522 -179.859 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -64.43 -46.03 84.93 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.86 0.362 . . . . 0.0 111.119 -179.598 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -57.75 -31.18 66.24 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.713 -179.207 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 14.3 mm-40 -75.13 -44.59 46.18 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.861 0.362 . . . . 0.0 111.117 -179.99 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 46.3 tp10 -72.12 -45.79 59.17 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.022 -179.106 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 145' ' ' ASN . . . . . . . . . . . . . 4.4 p30 -128.54 68.98 78.81 Favored Pre-proline 0 N--CA 1.469 0.513 0 CA-C-N 116.376 -0.374 . . . . 0.0 110.09 -179.045 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 146' ' ' PRO . . . . . . . . . . . . . 23.2 Cg_endo -60.28 112.69 1.39 Allowed 'Trans proline' 0 N--CA 1.492 1.418 0 C-N-CA 122.38 2.053 . . . . 0.0 111.303 -179.7 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 147' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -79.3 136.36 12.62 Favored 'Trans proline' 0 N--CA 1.491 1.378 0 C-N-CA 122.115 1.876 . . . . 0.0 111.768 -179.902 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 36.5 p -129.53 18.96 5.76 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.236 179.327 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 149' ' ' THR . . . . . . . . . . . . . 8.5 m -151.96 152.46 32.52 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 120.661 0.267 . . . . 0.0 110.354 179.578 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -49.47 -36.11 21.71 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.795 0.331 . . . . 0.0 110.559 -179.077 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 14.9 pt20 -77.74 -40.64 40.41 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.649 179.216 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . -56.4 -36.97 71.92 Favored Glycine 0 CA--C 1.519 0.302 0 N-CA-C 110.887 -0.885 . . . . 0.0 110.887 -178.839 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 153' ' ' VAL . . . . . 0.44 ' O ' ' N ' ' A' ' 156' ' ' ILE . 86.1 t -60.88 -42.07 91.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 C-N-CA 121.21 -0.196 . . . . 0.0 110.508 -179.839 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 79.3 mt -43.56 -23.42 0.07 Allowed 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 120.912 0.387 . . . . 0.0 110.86 -179.295 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 155' ' ' GLU . . . . . 0.411 ' N ' ' C ' ' A' ' 153' ' ' VAL . 95.2 mt-10 -64.86 -40.4 95.08 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.004 179.268 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 156' ' ' ILE . . . . . 0.651 HG22 ' SD ' ' A' ' 160' ' ' MET . 10.2 mm -71.48 -35.74 57.94 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.154 -179.709 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -60.13 -41.75 93.34 Favored 'General case' 0 N--CA 1.453 -0.278 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.864 -179.686 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 17.3 ttmm -60.74 -44.68 96.37 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.496 -179.405 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 53.6 tttm -73.77 -30.09 62.57 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.83 -179.371 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 160' ' ' MET . . . . . 0.651 ' SD ' HG22 ' A' ' 156' ' ' ILE . 12.0 mtp -67.49 -54.05 23.48 Favored 'General case' 0 C--O 1.221 -0.436 0 C-N-CA 120.508 -0.477 . . . . 0.0 110.174 -178.976 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 80.8 mtp180 -61.99 -31.75 72.15 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.394 179.922 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -58.4 -46.34 86.59 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.222 -179.269 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 163' ' ' LYS . . . . . . . . . . . . . 54.0 tttp -65.08 -52.28 56.52 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 120.357 -0.537 . . . . 0.0 110.78 -179.064 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -51.98 -36.08 48.54 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.998 0.427 . . . . 0.0 110.285 -179.071 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 57.6 tt0 -62.09 -40.04 94.48 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.325 179.896 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 20.3 mmt85 -65.89 -34.66 78.65 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.453 0.644 . . . . 0.0 111.434 -179.585 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 167' ' ' VAL . . . . . . . . . . . . . 38.6 t -66.76 -47.44 82.93 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.769 0 CA-C-N 115.139 -0.937 . . . . 0.0 110.284 -179.53 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 42.8 t-80 -79.44 -31.11 42.5 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.519 -179.471 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 169' ' ' THR . . . . . . . . . . . . . 90.2 m -71.64 -44.43 64.35 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.126 -179.828 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 59.8 mmtt -62.01 -41.76 98.43 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.99 0.424 . . . . 0.0 110.733 -179.021 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 171' ' ' ASN . . . . . . . . . . . . . 10.3 m120 -68.63 -34.92 76.57 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.628 179.473 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 172' ' ' TYR . . . . . 0.414 ' CZ ' ' NZ ' ' A' ' 176' ' ' LYS . 86.8 t80 -63.85 -40.46 96.64 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.115 -179.524 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 7.2 t -76.11 -46.85 26.83 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.783 -178.679 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 24.5 p -58.2 -47.83 82.23 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.078 -178.808 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -64.1 -35.14 79.78 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-O 120.808 0.337 . . . . 0.0 110.721 -179.911 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 176' ' ' LYS . . . . . 0.414 ' NZ ' ' CZ ' ' A' ' 172' ' ' TYR . 14.2 tptt -54.71 -19.3 5.93 Favored 'General case' 0 C--N 1.313 -1.003 0 C-N-CA 120.274 -0.57 . . . . 0.0 110.461 -179.158 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 177' ' ' LYS . . . . . . . . . . . . . 61.0 tttm -68.98 -39.77 79.21 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 121.712 0.768 . . . . 0.0 111.368 179.846 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 178' ' ' LYS . . . . . . . . . . . . . 20.0 mtpp . . . . . 0 C--N 1.31 -1.138 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.024 -178.721 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.156 0 CA-C-O 120.796 0.331 . . . . 0.0 110.583 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 24.7 m -64.63 -30.29 71.3 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.351 -179.969 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 63.9 tttp -68.48 -50.7 50.44 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.807 179.973 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 65.0 mt -60.38 -42.48 91.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.361 -179.196 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 -56.35 -42.64 78.08 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.75 -179.517 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 26.8 mt -68.97 -34.18 74.9 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.55 0.214 . . . . 0.0 111.319 -179.147 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -64.93 -52.76 54.61 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.868 -179.43 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 50.3 ptt85 -71.81 -39.71 69.65 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.882 0.372 . . . . 0.0 110.799 -179.625 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 39.4 t -64.85 -39.25 93.27 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.965 -179.595 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -76.53 -34.0 58.56 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.1 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 64.8 tttm -66.36 -33.01 74.77 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.905 -179.623 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 39.7 m-20 -67.35 -27.04 66.8 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.821 -179.307 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 52.8 mt -61.47 -50.19 81.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 C-N-CA 120.885 -0.326 . . . . 0.0 110.846 -179.08 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 68.4 p -73.73 -36.5 65.2 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.801 0.334 . . . . 0.0 111.46 -178.294 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 85.7 m-20 -66.2 -35.09 79.54 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.561 -178.306 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 68.8 mm-40 -74.4 -57.77 3.73 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.933 0.397 . . . . 0.0 111.513 -178.935 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 6.7 pt -58.56 -23.14 22.12 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.637 -178.92 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -62.94 -39.24 94.01 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.072 0.463 . . . . 0.0 110.502 179.459 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -55.24 -22.5 18.33 Favored 'General case' 0 C--N 1.319 -0.728 0 C-N-CA 120.669 -0.412 . . . . 0.0 110.676 -179.924 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 81.4 mt -60.25 -52.72 58.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.462 -178.549 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 5.1 ptmm? -65.85 -30.92 71.61 Favored 'General case' 0 C--N 1.324 -0.542 0 C-N-CA 120.693 -0.403 . . . . 0.0 110.366 -179.167 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 37.7 ttmt -63.83 -47.72 79.69 Favored 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 120.756 -0.378 . . . . 0.0 110.227 179.859 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 95.1 m-20 -65.47 -33.3 75.6 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.17 179.816 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -64.01 -28.39 69.77 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.835 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -60.05 -32.51 70.99 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.891 -179.673 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 55.0 mt . . . . . 0 C--N 1.325 -0.475 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.438 -179.216 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 75' ' ' ASN . . . . . 0.469 ' ND2' HD12 ' A' ' 78' ' ' ILE . 2.0 p30 . . . . . 0 CA--C 1.541 0.623 0 N-CA-C 109.41 -0.589 . . . . 0.0 109.41 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 77.0 Cg_exo -43.79 -19.94 0.23 Allowed 'Trans proline' 0 N--CA 1.496 1.659 0 C-N-CA 122.505 2.137 . . . . 0.0 112.226 -179.46 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' PHE . . . . . 0.428 ' N ' ' O ' ' A' ' 75' ' ' ASN . 58.0 t80 -62.26 -52.78 62.36 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.632 -0.427 . . . . 0.0 110.711 -179.872 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 78' ' ' ILE . . . . . 0.469 HD12 ' ND2' ' A' ' 75' ' ' ASN . 94.4 mt -69.35 -46.16 77.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.427 179.819 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.479 ' O ' ' ND2' ' A' ' 171' ' ' ASN . 39.9 mt -55.57 -51.63 66.45 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.095 -178.442 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 95.6 mt-10 -63.49 -36.0 82.32 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.191 179.475 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -64.46 -40.43 95.7 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.499 179.967 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 33.9 ttmt -54.88 -19.37 6.45 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.088 0.471 . . . . 0.0 110.528 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 5.6 t -79.43 -44.65 23.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.818 179.943 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 84.7 mtp180 -62.96 -31.4 72.49 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.413 -179.672 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -67.32 -42.77 83.07 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.91 0.386 . . . . 0.0 111.274 -179.341 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 38.3 p -67.77 -21.51 65.25 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.245 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 24.5 m -59.0 -54.03 51.75 Favored 'General case' 0 C--N 1.323 -0.571 0 C-N-CA 120.506 -0.478 . . . . 0.0 111.027 -179.051 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 45.2 t -73.13 -49.18 40.12 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-O 121.057 0.456 . . . . 0.0 111.3 -179.445 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -57.18 -43.15 82.37 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.672 -178.896 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 7.1 tm-20 -56.28 -47.83 77.83 Favored 'General case' 0 C--N 1.317 -0.84 0 C-N-CA 120.404 -0.518 . . . . 0.0 110.718 -179.613 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 70.0 mmtt -59.0 -36.75 75.43 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.895 -178.97 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 87.7 t80 -56.99 -38.88 73.67 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.506 -179.926 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 49.0 t -58.03 -41.93 81.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-O 120.926 0.393 . . . . 0.0 110.173 -179.02 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 64.3 mt -54.51 -39.91 47.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.327 179.944 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -53.3 -45.32 68.93 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.631 -179.762 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 96' ' ' ILE . . . . . 0.52 ' N ' HD12 ' A' ' 96' ' ' ILE . 1.6 mp -60.63 -44.37 96.76 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 116.311 -0.404 . . . . 0.0 109.986 -179.586 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 14.1 tm-20 -64.43 -49.36 71.81 Favored 'General case' 0 C--N 1.32 -0.71 0 C-N-CA 120.576 -0.45 . . . . 0.0 110.649 -178.995 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 83.0 tt0 -63.15 -46.48 86.99 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.58 -179.166 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 79.3 mm-40 -65.86 -35.13 79.81 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.743 -179.794 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -60.68 -41.63 95.49 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.57 -179.853 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 33.0 m -63.32 -49.07 75.43 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.643 -179.996 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 35.3 ttmt -69.32 -19.67 63.88 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.508 -179.924 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 41.1 tp . . . . . 0 C--N 1.326 -0.452 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.433 -179.402 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 54.4 p . . . . . 0 N--CA 1.456 -0.154 0 CA-C-O 120.816 0.341 . . . . 0.0 110.507 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -62.55 -31.38 79.58 Favored Glycine 0 CA--C 1.521 0.425 0 N-CA-C 110.876 -0.89 . . . . 0.0 110.876 -179.961 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 44.9 tp10 -53.72 -45.61 70.52 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.864 0.364 . . . . 0.0 110.368 -179.544 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 65.1 m-85 -65.23 -41.17 94.65 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.575 -179.869 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 6.1 t -57.17 -33.28 67.27 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.499 -179.725 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -61.9 -35.89 79.69 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.452 -179.92 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 28.9 tpp -66.4 -47.65 72.61 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.958 0.409 . . . . 0.0 110.91 -179.871 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 37.1 t80 -51.12 -32.17 21.82 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.548 -179.542 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 63.6 t0 -60.05 -44.71 94.5 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.756 -179.889 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.472 ' N ' HD12 ' A' ' 118' ' ' LEU . 10.8 mp -58.33 -39.21 78.84 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.289 -0.414 . . . . 0.0 109.922 -179.222 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 13.4 tpt -61.84 -32.29 72.61 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.365 179.941 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 120' ' ' PHE . . . . . 0.566 ' CZ ' ' NZ ' ' A' ' 124' ' ' LYS . 14.6 t80 -77.42 -46.01 24.01 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.353 0.597 . . . . 0.0 111.035 -179.851 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -59.91 -42.46 93.92 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.699 -178.424 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 122' ' ' VAL . . . . . 0.432 ' O ' HD13 ' A' ' 126' ' ' LEU . 11.1 p -74.53 -25.86 19.62 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.385 0 CA-C-O 120.942 0.401 . . . . 0.0 110.687 -179.785 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 11.5 t -65.47 -21.08 66.6 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 116.611 -0.268 . . . . 0.0 111.193 179.912 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 124' ' ' LYS . . . . . 0.566 ' NZ ' ' CZ ' ' A' ' 120' ' ' PHE . 5.1 mptt -71.3 -59.31 3.33 Favored Pre-proline 0 C--N 1.324 -0.511 0 N-CA-C 112.139 0.422 . . . . 0.0 112.139 -178.906 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 125' ' ' PRO . . . . . 0.481 ' HD2' ' N ' ' A' ' 124' ' ' LYS . 18.6 Cg_endo -56.6 -32.01 88.84 Favored 'Trans proline' 0 C--N 1.309 -1.506 0 C-N-CA 122.204 1.936 . . . . 0.0 112.106 -178.036 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.432 HD13 ' O ' ' A' ' 122' ' ' VAL . 7.4 mp -60.98 -39.61 90.28 Favored 'General case' 0 CA--C 1.51 -0.57 0 CA-C-N 116.431 -0.349 . . . . 0.0 110.552 -179.839 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -44.69 -28.71 0.65 Allowed 'General case' 0 C--N 1.318 -0.791 0 CA-C-O 120.922 0.391 . . . . 0.0 110.923 179.858 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 128' ' ' LYS . . . . . 0.484 ' C ' HD22 ' A' ' 129' ' ' LEU . 97.9 mttt -64.99 -8.55 16.35 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.83 -179.399 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.49 HD22 ' N ' ' A' ' 129' ' ' LEU . 4.2 mm? -102.75 -10.35 19.24 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.604 -179.663 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 83.65 17.61 65.64 Favored Glycine 0 CA--C 1.52 0.381 0 N-CA-C 110.438 -1.065 . . . . 0.0 110.438 179.684 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 131' ' ' ILE . . . . . 0.72 HG22 ' O ' ' A' ' 131' ' ' ILE . 81.4 mt -77.82 15.36 0.25 Allowed 'Isoleucine or valine' 0 CA--C 1.518 -0.27 0 N-CA-C 110.038 -0.356 . . . . 0.0 110.038 -179.835 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 132' ' ' GLN . . . . . 0.531 ' C ' ' O ' ' A' ' 131' ' ' ILE . 59.1 tt0 -25.84 122.9 0.07 Allowed 'General case' 0 CA--C 1.507 -0.694 0 CA-C-O 118.941 -0.552 . . . . 0.0 109.666 179.968 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 133' ' ' GLU . . . . . 0.503 ' CB ' ' O ' ' A' ' 132' ' ' GLN . 8.6 mm-40 148.22 -21.95 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.201 0 O-C-N 124.677 1.236 . . . . 0.0 110.343 -178.858 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 134' ' ' MET . . . . . 0.502 ' O ' HG12 ' A' ' 138' ' ' VAL . 24.6 mmt -62.01 -61.92 2.15 Favored 'General case' 0 C--N 1.319 -0.724 0 C-N-CA 120.849 -0.341 . . . . 0.0 111.138 -178.378 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 71.4 p -56.96 -30.38 64.02 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.834 -178.799 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 50.8 mtmt -82.69 -52.81 6.44 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.347 -179.745 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 137' ' ' THR . . . . . 0.42 ' CG2' ' NZ ' ' A' ' 159' ' ' LYS . 30.2 m -60.57 -46.12 91.41 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.857 -179.023 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 138' ' ' VAL . . . . . 0.502 HG12 ' O ' ' A' ' 134' ' ' MET . 9.0 p -61.4 -40.61 86.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-O 121.051 0.453 . . . . 0.0 110.68 -178.92 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 139' ' ' SER . . . . . 0.45 ' N ' HG13 ' A' ' 138' ' ' VAL . 23.7 t -72.5 -36.37 68.36 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.648 -179.841 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 84.7 m-20 -64.74 -30.18 71.18 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.64 -179.589 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -74.97 -28.23 60.49 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.81 -179.924 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -64.57 -34.09 77.44 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.114 -179.283 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 94.9 mt-10 -70.8 -36.91 73.22 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.743 0.306 . . . . 0.0 110.834 -179.422 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 47.6 tp10 -74.05 -43.49 57.64 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.012 -179.475 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 145' ' ' ASN . . . . . . . . . . . . . 33.5 m120 -144.28 82.68 10.53 Favored Pre-proline 0 N--CA 1.466 0.349 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.197 -179.53 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 146' ' ' PRO . . . . . 0.456 ' O ' ' N ' ' A' ' 148' ' ' THR . 24.4 Cg_endo -61.02 113.05 1.56 Allowed 'Trans proline' 0 N--CA 1.493 1.446 0 C-N-CA 122.394 2.063 . . . . 0.0 111.694 -178.846 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 147' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_exo -45.79 87.61 0.02 OUTLIER 'Trans proline' 0 N--CA 1.493 1.489 0 C-N-CA 122.397 2.065 . . . . 0.0 112.786 -179.364 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 148' ' ' THR . . . . . 0.456 ' N ' ' O ' ' A' ' 146' ' ' PRO . 31.2 m -111.56 -15.43 13.5 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.335 179.284 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 149' ' ' THR . . . . . 0.634 HG22 ' N ' ' A' ' 150' ' ' ALA . 30.8 m -138.8 172.27 13.11 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.639 179.845 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 150' ' ' ALA . . . . . 0.634 ' N ' HG22 ' A' ' 149' ' ' THR . . . -58.88 -47.72 83.95 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.304 179.986 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 76.4 mt-30 -62.76 -29.61 70.82 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.021 0.439 . . . . 0.0 110.394 -179.851 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . -58.38 -42.28 95.59 Favored Glycine 0 CA--C 1.524 0.6 0 N-CA-C 110.691 -0.964 . . . . 0.0 110.691 179.792 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 153' ' ' VAL . . . . . . . . . . . . . 47.3 t -67.67 -41.48 85.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-O 120.834 0.349 . . . . 0.0 110.505 -179.986 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 8.4 mp -50.95 -38.51 51.02 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.256 -179.374 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -60.96 -47.57 85.83 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 179.12 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 156' ' ' ILE . . . . . 0.809 HG22 ' SD ' ' A' ' 160' ' ' MET . 15.3 mm -65.36 -43.57 94.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.034 -179.777 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -53.03 -51.46 61.66 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.247 179.923 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -62.58 -43.99 97.42 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.164 179.495 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 159' ' ' LYS . . . . . 0.42 ' NZ ' ' CG2' ' A' ' 137' ' ' THR . 63.2 tttm -65.11 -29.77 70.66 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.371 179.945 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 160' ' ' MET . . . . . 0.809 ' SD ' HG22 ' A' ' 156' ' ' ILE . 5.4 mtp -71.01 -53.27 15.36 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.48 -179.49 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 73.5 ttt-85 -67.8 -35.65 79.03 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.473 179.847 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 80.1 tt0 -66.97 -47.87 70.25 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.817 -179.08 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 163' ' ' LYS . . . . . 0.42 ' HZ1' ' HB3' ' A' ' 133' ' ' GLU . 1.2 tmtp? -65.97 -33.97 77.02 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.18 -179.394 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 5.8 mt -70.28 -26.61 63.89 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.657 179.942 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 46.5 tp60 -67.21 -35.73 80.22 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.472 -179.155 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 10.7 tpt180 -62.49 -28.49 69.86 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.37 0.605 . . . . 0.0 110.575 -179.187 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 167' ' ' VAL . . . . . . . . . . . . . 48.3 t -68.18 -44.01 84.52 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 CA-C-N 115.242 -0.89 . . . . 0.0 110.39 -179.708 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 168' ' ' HIS . . . . . 0.503 ' O ' ' ND1' ' A' ' 168' ' ' HIS . 20.6 t-80 -78.15 -28.83 48.44 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.636 -179.967 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 169' ' ' THR . . . . . . . . . . . . . 23.7 m -73.2 -46.68 49.06 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.301 -0.408 . . . . 0.0 111.156 -179.697 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -58.83 -43.86 90.79 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.555 -179.077 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 171' ' ' ASN . . . . . 0.479 ' ND2' ' O ' ' A' ' 79' ' ' LEU . 20.1 t-20 -72.03 -33.11 67.76 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.62 179.916 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 172' ' ' TYR . . . . . . . . . . . . . 80.7 t80 -75.18 -29.33 60.36 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.786 -179.629 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 11.5 t -74.35 -34.55 63.42 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.046 -179.511 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 26.2 p -73.04 -35.68 66.77 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.967 -179.268 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 87.0 mt -77.72 -53.1 7.93 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.521 -178.843 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 16.2 ptmt -56.24 -21.72 25.28 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 121.183 0.516 . . . . 0.0 110.37 -179.265 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 177' ' ' LYS . . . . . . . . . . . . . 56.2 tttp -66.38 -13.67 60.98 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.236 -179.966 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 178' ' ' LYS . . . . . . . . . . . . . 99.2 mttt . . . . . 0 C--N 1.322 -0.589 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.857 -179.922 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 33.0 t . . . . . 0 N--CA 1.49 1.547 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -68.21 82.29 0.23 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.717 -179.86 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 176.17 113.24 0.33 Allowed Glycine 0 CA--C 1.516 0.155 0 N-CA-C 110.781 -0.928 . . . . 0.0 110.781 179.817 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.521 ' O ' HD23 ' A' ' 27' ' ' LEU . 1.0 OUTLIER -141.2 -44.9 0.38 Allowed 'General case' 0 C--N 1.334 -0.107 0 CA-C-O 120.835 0.35 . . . . 0.0 110.627 179.525 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 46.9 p 40.37 -149.1 0.02 OUTLIER 'General case' 0 C--O 1.234 0.253 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.803 -179.282 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -77.52 -130.08 0.47 Allowed Glycine 0 CA--C 1.521 0.455 0 N-CA-C 110.952 -0.859 . . . . 0.0 110.952 179.387 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -83.48 3.54 31.73 Favored 'General case' 0 C--N 1.329 -0.294 0 O-C-N 122.716 -0.285 . . . . 0.0 110.441 -179.832 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 9.9 m -61.84 -36.3 80.78 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.844 -179.683 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 23.4 tptm -65.11 -57.27 9.04 Favored 'General case' 0 N--CA 1.447 -0.578 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.079 -179.709 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 22.1 pt -62.39 -28.64 45.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.331 -179.578 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 78.8 ttt180 -65.35 -42.27 93.0 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.161 0.505 . . . . 0.0 110.497 179.798 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 17.0 mt -71.89 -32.86 67.85 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.065 -179.9 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 37.7 tp10 -62.48 -51.07 68.91 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.88 -179.551 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 89.3 mtm180 -67.37 -40.62 85.74 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.508 -179.507 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 26.8 t -67.83 -25.21 65.45 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.714 -179.751 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -75.66 -40.3 56.24 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.728 179.681 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -58.41 -39.66 80.34 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.817 -179.595 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 20.1 m-20 -58.14 -22.05 49.47 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 121.059 0.457 . . . . 0.0 110.766 -179.389 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 8.9 mm -64.79 -56.15 17.41 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.953 0 N-CA-C 112.244 0.461 . . . . 0.0 112.244 -178.865 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 52.5 p -76.34 -36.03 58.45 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.559 -179.878 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 95.8 m-20 -64.56 -35.14 80.02 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.688 -177.623 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 56.4 mm-40 -73.25 -57.82 3.75 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.745 -179.588 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.57 HG22 ' HA ' ' A' ' 85' ' ' ALA . 16.0 pt -60.03 -26.94 37.56 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.755 0 O-C-N 123.428 0.455 . . . . 0.0 110.879 -179.37 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 65.3 m-20 -66.54 -38.53 87.35 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.365 -179.567 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -53.9 -27.47 30.7 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.209 -179.288 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 66.3 mt -62.49 -47.47 92.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.118 179.689 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 63.8 mttp -58.76 -39.54 81.28 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.101 -179.465 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 71.6 mmtt -64.85 -44.22 90.48 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.558 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -67.12 -35.49 79.87 Favored 'General case' 0 C--O 1.224 -0.268 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.48 179.822 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.444 ' O ' ' O ' ' A' ' 56' ' ' LYS . . . -63.69 -29.02 70.3 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.673 -179.844 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -58.66 -35.28 72.31 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.792 -179.526 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.504 HD12 ' N ' ' A' ' 55' ' ' LEU . 10.0 mp -56.21 -44.75 79.79 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.511 -178.521 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.444 ' O ' ' O ' ' A' ' 53' ' ' ALA . 20.7 mtpp -109.02 139.79 43.41 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-O 121.113 0.482 . . . . 0.0 110.332 179.876 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -70.25 102.06 0.97 Allowed Glycine 0 CA--C 1.516 0.096 0 N-CA-C 110.795 -0.922 . . . . 0.0 110.795 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.47 HG22 ' H ' ' A' ' 60' ' ' PHE . 5.5 p -132.6 142.71 41.78 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.374 0 CA-C-O 120.974 0.416 . . . . 0.0 110.46 179.961 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 3.9 p-10 -60.68 -44.35 96.61 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.927 179.765 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' PHE . . . . . 0.47 ' H ' HG22 ' A' ' 58' ' ' VAL . 81.3 t80 52.88 72.93 0.38 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.428 179.826 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' ASP . . . . . 0.47 ' H ' HD11 ' A' ' 78' ' ' ILE . 4.0 p30 172.23 -99.0 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.011 0.434 . . . . 0.0 110.189 -179.861 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.455 ' N ' ' OD1' ' A' ' 61' ' ' ASP . . . 47.1 31.61 1.68 Allowed 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.932 -179.863 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' PHE . . . . . 0.473 ' CZ ' ' O ' ' A' ' 129' ' ' LEU . 56.8 m-85 -89.09 9.99 23.38 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.134 -179.855 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 53.3 mtmt -61.7 125.46 23.9 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.615 -179.758 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 32.8 t70 49.79 -94.79 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.621 -179.883 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -140.89 138.48 33.93 Favored 'General case' 0 CA--C 1.52 -0.196 0 CA-C-O 121.19 0.519 . . . . 0.0 110.377 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 10.1 ptpp? -88.43 146.67 25.09 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.497 179.698 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 82.7 m -136.97 131.24 32.69 Favored 'General case' 0 CA--C 1.519 -0.249 0 CA-C-O 121.042 0.449 . . . . 0.0 110.473 179.794 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 150.38 -37.82 0.9 Allowed Glycine 0 CA--C 1.523 0.546 0 N-CA-C 110.805 -0.918 . . . . 0.0 110.805 179.613 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 23.3 m 53.43 80.7 0.1 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.81 0.338 . . . . 0.0 110.518 -179.72 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 72.21 -57.64 1.51 Allowed Glycine 0 CA--C 1.528 0.885 0 N-CA-C 110.763 -0.935 . . . . 0.0 110.763 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 47.5 t -61.11 133.13 26.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 O-C-N 122.689 -0.3 . . . . 0.0 110.303 -179.597 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 1.4 m 70.61 -59.24 0.53 Allowed 'General case' 0 C--N 1.334 -0.101 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.378 -179.584 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' GLU . . . . . 0.552 ' O ' ' C ' ' A' ' 75' ' ' ASN . 41.6 tp10 -68.75 91.92 0.46 Allowed 'General case' 0 N--CA 1.446 -0.645 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.715 -179.265 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 75' ' ' ASN . . . . . 0.578 ' C ' ' H ' ' A' ' 77' ' ' PHE . 11.7 p-10 -18.82 98.33 0.05 OUTLIER Pre-proline 0 C--O 1.236 0.386 0 O-C-N 123.84 0.712 . . . . 0.0 111.103 179.166 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_exo -51.05 0.03 0.04 OUTLIER 'Trans proline' 0 C--N 1.312 -1.374 0 C-N-CA 122.611 2.207 . . . . 0.0 111.856 -178.572 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' PHE . . . . . 0.578 ' H ' ' C ' ' A' ' 75' ' ' ASN . 67.8 t80 -61.03 -49.46 77.33 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 116.561 -0.29 . . . . 0.0 110.709 -179.542 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 78' ' ' ILE . . . . . 0.47 HD11 ' H ' ' A' ' 61' ' ' ASP . 66.3 mt -64.17 -51.95 62.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.368 -179.854 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.523 ' N ' HD12 ' A' ' 79' ' ' LEU . 10.5 mp -56.52 -53.23 59.93 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.171 -178.616 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 94.9 mt-10 -62.68 -38.92 92.28 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 123.334 0.396 . . . . 0.0 110.221 179.911 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -63.39 -41.47 98.76 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.364 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 35.9 ttmt -52.53 -18.58 1.77 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 121.19 0.519 . . . . 0.0 110.776 -179.597 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 25.4 t -85.51 -48.38 16.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.485 179.722 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 84.4 mtt85 -64.97 -30.27 71.25 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.46 -179.585 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' ALA . . . . . 0.57 ' HA ' HG22 ' A' ' 46' ' ' ILE . . . -70.39 -45.75 65.38 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.748 -179.497 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 86' ' ' THR . . . . . 0.415 ' CB ' HG21 ' A' ' 167' ' ' VAL . 74.2 p -77.6 -11.97 59.92 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.458 -179.163 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 85.6 m -60.34 -52.1 66.68 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.129 -178.736 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.449 HG13 ' N ' ' A' ' 89' ' ' ALA . 11.7 p -69.8 -39.55 77.98 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.77 -179.407 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 89' ' ' ALA . . . . . 0.449 ' N ' HG13 ' A' ' 88' ' ' VAL . . . -61.97 -39.17 91.24 Favored 'General case' 0 C--O 1.223 -0.341 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.107 -178.695 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 38.4 tp10 -50.23 -54.96 17.42 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.852 -179.807 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 9.2 mtmp? -52.58 -34.89 52.59 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.69 -179.504 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.432 ' O ' ' HB3' ' A' ' 95' ' ' ALA . 43.4 t80 -59.17 -43.59 92.15 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.725 -179.248 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 90.6 t -56.76 -47.71 82.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.453 -178.696 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 67.0 mt -53.42 -38.0 31.29 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.104 -179.904 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.432 ' HB3' ' O ' ' A' ' 92' ' ' PHE . . . -52.58 -43.38 65.24 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.458 -179.491 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 0.546 ' N ' HD12 ' A' ' 96' ' ' ILE . 1.7 mp -62.16 -44.86 99.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.417 -179.955 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 7.7 tm-20 -61.39 -50.07 74.33 Favored 'General case' 0 C--N 1.323 -0.56 0 O-C-N 123.442 0.464 . . . . 0.0 110.214 -178.616 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 78.4 tt0 -66.06 -39.72 90.32 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.34 -179.47 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 80.2 tt0 -67.54 -32.79 73.82 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.562 -179.676 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -57.49 -40.17 78.03 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.518 -179.496 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 20.2 m -61.69 -47.62 84.49 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.54 179.871 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 64.1 mttp -74.69 -24.64 58.81 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.376 -179.724 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.496 ' O ' ' C ' ' A' ' 104' ' ' LYS . 37.4 tp -73.53 -27.87 61.58 Favored 'General case' 0 CA--C 1.508 -0.638 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.933 -179.739 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.496 ' C ' ' O ' ' A' ' 103' ' ' LEU . 64.0 tttm -25.52 -50.31 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.616 0 O-C-N 123.499 0.5 . . . . 0.0 111.063 -179.637 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 105' ' ' GLU . . . . . 0.59 ' O ' ' N ' ' A' ' 107' ' ' GLY . 80.9 mm-40 -47.72 165.34 0.04 OUTLIER 'General case' 0 C--O 1.219 -0.511 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.905 178.682 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 106' ' ' THR . . . . . 0.499 ' OG1' ' N ' ' A' ' 107' ' ' GLY . 32.0 p 55.29 -75.9 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.014 0.435 . . . . 0.0 110.762 -179.613 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 107' ' ' GLY . . . . . 0.59 ' N ' ' O ' ' A' ' 105' ' ' GLU . . . 82.17 -136.63 15.92 Favored Glycine 0 C--O 1.226 -0.381 0 N-CA-C 110.761 -0.936 . . . . 0.0 110.761 179.627 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 1.1 m 70.31 138.06 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 110.202 -0.296 . . . . 0.0 110.202 -179.594 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 80.7 p -57.65 -24.67 57.85 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.86 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -61.66 -45.45 96.26 Favored Glycine 0 CA--C 1.522 0.505 0 N-CA-C 111.191 -0.764 . . . . 0.0 111.191 -179.826 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 10.5 mm-40 -70.56 -44.05 68.24 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.708 0.29 . . . . 0.0 110.709 -179.646 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 61.5 m-85 -65.52 -36.61 84.34 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.536 -179.938 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 55.1 m -53.87 -33.95 57.97 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.385 179.813 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -65.57 -28.43 69.14 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.416 179.693 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 63.0 mmm -73.78 -41.96 61.69 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.876 -179.792 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 33.6 t80 -64.99 -34.54 78.69 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.439 179.911 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 45.4 t0 -56.67 -46.52 81.08 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.169 -179.346 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 83.6 mt -55.42 -39.01 69.72 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.519 179.761 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 119' ' ' MET . . . . . 0.434 ' C ' ' SD ' ' A' ' 119' ' ' MET . 0.0 OUTLIER -60.63 -53.98 50.86 Favored 'General case' 0 C--N 1.318 -0.769 0 O-C-N 123.544 0.527 . . . . 0.0 110.393 -179.831 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 67.1 t80 -60.77 -47.5 86.02 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.901 -178.76 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 78.9 mm-40 -56.56 -39.74 73.97 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.818 -179.726 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 69.7 t -81.19 -23.69 10.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.582 179.785 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 53.2 p -70.84 -23.0 62.26 Favored 'General case' 0 C--N 1.309 -1.171 0 CA-C-N 116.572 -0.285 . . . . 0.0 110.928 -179.783 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 124' ' ' LYS . . . . . 0.49 ' CB ' ' HD3' ' A' ' 125' ' ' PRO . 16.8 mtmt -72.04 -56.55 4.43 Favored Pre-proline 0 C--N 1.329 -0.297 0 C-N-CA 120.755 -0.378 . . . . 0.0 111.445 -178.71 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 125' ' ' PRO . . . . . 0.49 ' HD3' ' CB ' ' A' ' 124' ' ' LYS . 54.0 Cg_exo -49.22 -44.98 31.68 Favored 'Trans proline' 0 C--N 1.304 -1.787 0 C-N-CA 122.351 2.034 . . . . 0.0 112.172 178.237 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.486 HD22 ' N ' ' A' ' 126' ' ' LEU . 4.3 mm? -70.38 -21.92 62.81 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.24 179.764 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 4.7 tm0? -63.31 -47.37 82.55 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.746 -179.672 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 99.7 mttt -53.58 -44.73 69.58 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 -178.461 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.525 HD23 ' O ' ' A' ' 129' ' ' LEU . 1.1 tt -63.72 -45.08 91.55 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 121.295 0.569 . . . . 0.0 110.556 179.566 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 99.2 90.54 2.01 Favored Glycine 0 N--CA 1.462 0.428 0 N-CA-C 110.815 -0.914 . . . . 0.0 110.815 -179.865 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 131' ' ' ILE . . . . . 0.4 ' O ' ' CG ' ' A' ' 132' ' ' GLN . 47.3 mm -105.81 -71.56 0.7 Allowed 'Isoleucine or valine' 0 CA--C 1.507 -0.699 0 N-CA-C 111.5 0.185 . . . . 0.0 111.5 179.391 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 132' ' ' GLN . . . . . 0.4 ' CG ' ' O ' ' A' ' 131' ' ' ILE . 56.7 mt-30 -159.75 -166.93 1.86 Allowed 'General case' 0 C--N 1.327 -0.393 0 O-C-N 123.511 0.507 . . . . 0.0 110.821 -179.898 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 92.8 mt-10 -88.09 44.44 1.2 Allowed 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 116.184 -0.462 . . . . 0.0 109.81 179.895 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 44.6 tpp -59.21 -58.91 6.54 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.157 -178.833 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 23.3 p -46.42 -26.79 0.91 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.522 -179.14 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 62.4 mttp -90.56 -45.12 9.12 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.007 178.955 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 75.7 m -61.17 -43.56 98.68 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.73 -178.964 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 138' ' ' VAL . . . . . 0.453 HG13 ' N ' ' A' ' 139' ' ' SER . 9.8 p -65.55 -40.88 89.46 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.74 -179.156 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 139' ' ' SER . . . . . 0.453 ' N ' HG13 ' A' ' 138' ' ' VAL . 34.2 t -75.48 -34.09 60.86 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.2 -179.278 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 64.6 t0 -64.11 -28.55 69.85 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.322 0.582 . . . . 0.0 110.642 -179.762 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -73.11 -24.91 60.68 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.945 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -59.58 -33.39 71.38 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.015 0.436 . . . . 0.0 111.0 -179.032 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 143' ' ' GLU . . . . . 0.413 ' OE1' ' N ' ' A' ' 143' ' ' GLU . 38.3 mp0 -73.08 -36.34 66.81 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.5 -0.318 . . . . 0.0 111.201 179.818 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 144' ' ' GLU . . . . . 0.439 ' O ' ' ND2' ' A' ' 145' ' ' ASN . 44.6 tp10 -64.52 -48.11 76.33 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.581 -179.699 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 145' ' ' ASN . . . . . 0.439 ' ND2' ' O ' ' A' ' 144' ' ' GLU . 31.3 m120 -148.47 77.17 9.78 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.228 -179.457 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 146' ' ' PRO . . . . . . . . . . . . . 86.8 Cg_exo -42.79 105.41 0.06 OUTLIER 'Trans proline' 0 N--CA 1.483 0.86 0 C-N-CA 122.923 2.415 . . . . 0.0 112.096 -179.781 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 147' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_exo -45.26 101.66 0.04 OUTLIER 'Trans proline' 0 C--N 1.312 -1.36 0 C-N-CA 122.375 2.05 . . . . 0.0 112.556 -179.251 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 53.4 m -120.17 -13.6 8.92 Favored 'General case' 0 CA--C 1.515 -0.379 0 CA-C-O 120.928 0.394 . . . . 0.0 110.409 179.504 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 149' ' ' THR . . . . . 0.659 HG22 ' N ' ' A' ' 150' ' ' ALA . 50.1 m -136.99 171.19 14.88 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.961 0.41 . . . . 0.0 110.621 179.801 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 150' ' ' ALA . . . . . 0.659 ' N ' HG22 ' A' ' 149' ' ' THR . . . -58.43 -40.39 82.4 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.789 179.798 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 76.1 mt-30 -66.76 -24.52 66.22 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.938 0.399 . . . . 0.0 110.831 179.804 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . -67.33 -40.27 91.82 Favored Glycine 0 CA--C 1.525 0.674 0 N-CA-C 111.155 -0.778 . . . . 0.0 111.155 -179.828 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 153' ' ' VAL . . . . . . . . . . . . . 54.3 t -68.54 -32.26 54.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-O 120.724 0.297 . . . . 0.0 110.636 -179.71 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 7.4 mp -56.56 -36.38 69.23 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.508 -179.955 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -60.11 -53.48 57.26 Favored 'General case' 0 C--N 1.321 -0.633 0 O-C-N 123.607 0.567 . . . . 0.0 109.863 -179.876 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 156' ' ' ILE . . . . . 0.591 HD12 ' N ' ' A' ' 156' ' ' ILE . 1.8 mp -60.38 -44.47 96.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 N-CA-C 109.91 -0.404 . . . . 0.0 109.91 -179.635 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -51.09 -51.72 50.64 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.029 -178.775 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 63.0 mttp -60.13 -41.1 91.94 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.934 0.397 . . . . 0.0 110.11 179.747 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 38.6 mmtm -64.94 -30.56 71.56 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.908 0.385 . . . . 0.0 110.763 179.503 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 160' ' ' MET . . . . . 0.406 ' O ' ' CB ' ' A' ' 164' ' ' LEU . 2.2 mtm -74.23 -53.93 8.77 Favored 'General case' 0 C--O 1.219 -0.505 0 C-N-CA 120.46 -0.496 . . . . 0.0 111.562 -179.757 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 60.8 ttp180 -62.51 -41.3 98.74 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.074 -179.105 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 68.2 mm-40 -62.82 -57.64 10.16 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.694 -179.431 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 163' ' ' LYS . . . . . . . . . . . . . 63.0 tttp -66.66 -52.97 38.9 Favored 'General case' 0 C--N 1.324 -0.52 0 O-C-N 123.5 0.5 . . . . 0.0 111.046 -179.122 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 164' ' ' LEU . . . . . 0.711 ' O ' HG22 ' A' ' 167' ' ' VAL . 53.9 tp -47.81 -37.44 13.7 Favored 'General case' 0 C--O 1.212 -0.891 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.605 -178.772 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 59.2 tt0 -68.93 -27.62 65.92 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.497 -179.662 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 57.4 ttm-85 -55.02 -22.67 16.31 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.888 -179.516 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 167' ' ' VAL . . . . . 0.711 HG22 ' O ' ' A' ' 164' ' ' LEU . 18.2 m -60.47 -42.27 90.61 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.934 0 O-C-N 124.087 0.867 . . . . 0.0 109.923 -179.526 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 168' ' ' HIS . . . . . 0.52 ' N ' HG23 ' A' ' 167' ' ' VAL . 3.5 t60 -77.38 -22.26 51.94 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.554 -179.428 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 169' ' ' THR . . . . . . . . . . . . . 23.7 m -66.35 -47.24 74.08 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.143 -179.921 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 170' ' ' LYS . . . . . 0.476 ' O ' HG23 ' A' ' 174' ' ' THR . 68.9 mttm -63.99 -47.09 81.7 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.513 -179.588 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 171' ' ' ASN . . . . . . . . . . . . . 75.3 m-20 -64.29 -39.63 94.32 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.732 179.959 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 172' ' ' TYR . . . . . . . . . . . . . 85.1 t80 -69.76 -38.6 76.82 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.93 -179.417 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 48.2 t -78.06 -42.44 32.29 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.07 -0.513 . . . . 0.0 111.054 -178.952 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 174' ' ' THR . . . . . 0.476 HG23 ' O ' ' A' ' 170' ' ' LYS . 17.4 p -59.96 -45.88 91.23 Favored 'General case' 0 C--O 1.216 -0.688 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.005 -179.293 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 76.4 mt -63.11 -31.71 72.92 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.21 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 29.9 mttt -64.35 -5.67 5.61 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.933 -179.955 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 177' ' ' LYS . . . . . . . . . . . . . 20.8 ptmt -58.81 -31.2 68.23 Favored 'General case' 0 C--N 1.318 -0.791 0 O-C-N 123.423 0.452 . . . . 0.0 110.315 -179.252 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 178' ' ' LYS . . . . . . . . . . . . . 16.7 mmmt -63.54 -44.86 92.96 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.806 -179.795 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 97.3 mt-10 -70.12 -42.75 72.21 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.297 -179.919 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 180' ' ' ASN . . . . . . . . . . . . . 94.2 m-20 -65.78 -40.75 92.27 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.377 179.939 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 36.8 t 51.07 -97.08 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.724 -179.673 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 182' ' ' THR . . . . . 0.432 ' OG1' ' N ' ' A' ' 183' ' ' PHE . 59.7 p -72.04 -115.85 0.0 OUTLIER 'General case' 0 N--CA 1.453 -0.278 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.33 -179.926 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 183' ' ' PHE . . . . . 0.432 ' N ' ' OG1' ' A' ' 182' ' ' THR . 36.1 m-85 41.75 83.69 0.02 OUTLIER 'General case' 0 C--N 1.334 -0.102 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.079 -179.392 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 37.6 p -80.08 35.72 0.33 Allowed 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.317 -0.401 . . . . 0.0 109.924 179.938 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 185' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -157.32 79.89 0.89 Allowed 'General case' 0 CA--C 1.517 -0.319 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.535 179.831 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 186' ' ' GLU . . . . . . . . . . . . . 69.5 mm-40 -134.05 94.84 3.31 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-O 120.952 0.406 . . . . 0.0 110.425 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 86.4 tttt -64.59 -32.21 73.76 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.512 179.902 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 188' ' ' CYS . . . . . . . . . . . . . 13.4 t 60.38 69.53 0.68 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.625 -179.7 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 189' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -130.6 81.29 1.99 Allowed 'General case' 0 CA--C 1.517 -0.296 0 CA-C-O 120.963 0.411 . . . . 0.0 110.415 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 190' ' ' ASN . . . . . . . . . . . . . 52.8 p30 -92.92 9.01 37.31 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.297 179.52 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 191' ' ' ASN . . . . . . . . . . . . . 56.8 t-20 . . . . . 0 C--O 1.22 -0.5 0 CA-C-O 118.013 -0.994 . . . . 0.0 110.57 179.939 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 68.6 m . . . . . 0 N--CA 1.49 1.567 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . 54.33 50.24 16.73 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.585 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -152.98 43.51 0.63 Allowed Glycine 0 N--CA 1.464 0.543 0 N-CA-C 110.861 -0.896 . . . . 0.0 110.861 -179.888 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.554 ' N ' HD12 ' A' ' 27' ' ' LEU . 8.6 mp -88.67 38.79 0.89 Allowed 'General case' 0 CA--C 1.513 -0.456 0 O-C-N 122.719 -0.283 . . . . 0.0 110.37 -179.801 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.419 ' C ' ' O ' ' A' ' 27' ' ' LEU . 49.5 p -35.8 -32.83 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.419 0 CA-C-O 120.904 0.383 . . . . 0.0 110.848 -179.917 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' GLY . . . . . 0.447 ' N ' ' O ' ' A' ' 27' ' ' LEU . . . 118.79 -100.08 0.81 Allowed Glycine 0 N--CA 1.464 0.557 0 N-CA-C 111.133 -0.787 . . . . 0.0 111.133 178.373 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -47.52 -55.09 9.86 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 121.029 -0.269 . . . . 0.0 111.172 -179.001 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 11.8 m -58.26 -45.6 87.52 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.647 -179.363 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 13.2 tppt? -63.37 -54.19 40.66 Favored 'General case' 0 N--CA 1.442 -0.871 0 C-N-CA 120.406 -0.517 . . . . 0.0 110.942 179.766 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 97.0 mt -59.79 -42.48 89.02 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 N-CA-C 109.373 -0.603 . . . . 0.0 109.373 -178.479 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 72.1 ttt-85 -61.88 -37.6 85.15 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.872 0.368 . . . . 0.0 110.745 -179.431 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 36.1 mt -67.44 -39.81 85.43 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.548 -0.296 . . . . 0.0 111.431 178.961 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 82.3 tt0 -68.3 -44.96 74.31 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.32 -179.766 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 71.7 ttt-85 -65.95 -44.16 85.82 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.357 179.927 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 15.4 m -69.74 -34.03 73.27 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.681 -179.911 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -72.01 -41.54 67.46 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.869 179.993 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -59.53 -31.33 69.3 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.527 -179.79 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 81.1 m-20 -68.15 -22.78 64.84 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.085 0.469 . . . . 0.0 110.807 -178.924 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 68.6 mt -65.89 -53.94 32.67 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.417 -179.457 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 71.0 p -76.01 -35.62 59.47 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.086 0.47 . . . . 0.0 111.274 -179.014 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 67.0 t0 -65.61 -39.97 92.11 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.745 -177.948 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 59.1 mm-40 -68.2 -51.16 48.68 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.95 -179.326 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 8.0 pt -67.68 -27.26 37.54 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.728 0 O-C-N 123.645 0.591 . . . . 0.0 110.694 -179.335 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 12.2 m-20 -62.43 -42.02 99.14 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.133 -179.892 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -52.28 -29.68 24.4 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.136 -179.179 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 57.1 mt -66.01 -43.28 92.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.239 179.363 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -56.15 -44.42 79.25 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 -179.004 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 5.9 mtpm? -64.56 -39.25 93.41 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.722 179.569 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 83.1 m-20 -58.61 -32.34 68.91 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.209 -179.099 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -67.0 -32.19 73.26 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.835 0.35 . . . . 0.0 110.657 179.481 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -57.01 -37.39 71.63 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.673 -179.239 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.531 HD12 ' N ' ' A' ' 55' ' ' LEU . 10.1 mp -52.47 -18.45 1.68 Allowed 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.524 -179.691 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 27.7 mtmm -129.71 146.08 51.5 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-O 120.919 0.39 . . . . 0.0 110.356 -179.744 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -73.24 47.19 1.32 Allowed Glycine 0 C--N 1.33 0.228 0 N-CA-C 111.035 -0.826 . . . . 0.0 111.035 -179.747 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.426 ' O ' HG13 ' A' ' 58' ' ' VAL . 12.5 p -112.96 131.48 64.43 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.429 0 CA-C-O 121.17 0.509 . . . . 0.0 110.369 -179.99 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' ASN . . . . . 0.442 ' C ' ' H ' ' A' ' 61' ' ' ASP . 10.3 m120 -86.74 179.08 6.83 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.088 0.47 . . . . 0.0 110.407 179.622 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 60' ' ' PHE . . . . . 0.631 ' O ' ' N ' ' A' ' 62' ' ' ALA . 0.2 OUTLIER -72.91 10.87 0.78 Allowed 'General case' 0 C--O 1.22 -0.499 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.175 179.061 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 61' ' ' ASP . . . . . 0.442 ' H ' ' C ' ' A' ' 59' ' ' ASN . 4.8 m-20 60.99 -51.21 0.1 Allowed 'General case' 0 C--N 1.321 -0.662 0 O-C-N 123.897 0.748 . . . . 0.0 110.918 -179.483 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.631 ' N ' ' O ' ' A' ' 60' ' ' PHE . . . 60.99 81.88 0.18 Allowed 'General case' 0 N--CA 1.446 -0.634 0 CA-C-N 116.52 -0.309 . . . . 0.0 110.356 179.76 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 25.9 m-85 -46.67 146.93 1.38 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.701 -179.562 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.443 ' HG3' ' H ' ' A' ' 65' ' ' ASP . 6.4 pttm -149.84 -60.18 0.2 Allowed 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.23 -179.325 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.443 ' H ' ' HG3' ' A' ' 64' ' ' LYS . 51.3 t0 -159.73 -23.64 0.07 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.508 -179.35 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 5.5 tmtt? -60.11 -49.12 78.89 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-O 121.202 0.525 . . . . 0.0 110.279 -178.869 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 26.3 ttpp -64.4 129.36 39.59 Favored 'General case' 0 CA--C 1.515 -0.377 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.459 179.953 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' THR . . . . . 0.415 ' OG1' ' N ' ' A' ' 69' ' ' GLY . 75.5 p -105.19 -85.88 0.47 Allowed 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.181 179.888 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 69' ' ' GLY . . . . . 0.415 ' N ' ' OG1' ' A' ' 68' ' ' THR . . . -78.86 -113.27 0.21 Allowed Glycine 0 CA--C 1.525 0.674 0 N-CA-C 110.619 -0.992 . . . . 0.0 110.619 179.905 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 6.9 t -174.68 135.02 0.39 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.805 0.335 . . . . 0.0 110.538 179.879 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' GLY . . . . . 0.639 ' H ' ' CD2' ' A' ' 79' ' ' LEU . . . 76.7 3.2 78.66 Favored Glycine 0 N--CA 1.46 0.271 0 N-CA-C 110.716 -0.953 . . . . 0.0 110.716 179.497 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 41.2 t -116.77 -88.1 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.297 0 CA-C-O 120.806 0.336 . . . . 0.0 110.42 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 23.2 t -78.63 75.76 5.14 Favored 'General case' 0 CA--C 1.511 -0.55 0 N-CA-C 109.938 -0.393 . . . . 0.0 109.938 -179.403 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 168.0 -175.11 0.02 OUTLIER 'General case' 0 CA--C 1.517 -0.303 0 O-C-N 123.473 0.483 . . . . 0.0 110.453 -179.403 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 17.6 m120 -100.13 137.09 19.98 Favored Pre-proline 0 N--CA 1.448 -0.552 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.548 179.81 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 69.9 Cg_endo -75.66 -3.82 14.39 Favored 'Trans proline' 0 C--N 1.316 -1.138 0 C-N-CA 122.596 2.197 . . . . 0.0 111.916 179.757 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 69.6 t80 -68.88 -60.02 2.67 Favored 'General case' 0 C--N 1.319 -0.72 0 C-N-CA 120.784 -0.367 . . . . 0.0 111.383 -179.085 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' ILE . . . . . 0.509 ' CD1' ' O ' ' A' ' 60' ' ' PHE . 20.2 tt -76.06 -24.98 16.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.125 -179.001 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.639 ' CD2' ' H ' ' A' ' 71' ' ' GLY . 3.3 mp -72.53 -55.0 7.64 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.742 -179.435 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -63.32 -27.94 69.66 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.24 -179.424 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -61.55 -31.47 71.51 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.584 -179.749 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 33.8 ttmt -63.45 -22.68 67.03 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.72 -179.53 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 31.2 t -70.6 -44.74 76.5 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.998 -179.785 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 81.5 mmt-85 -61.71 -35.83 79.18 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.937 -178.993 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -62.47 -47.9 81.96 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.237 -179.827 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 73.6 p -67.25 -27.34 67.13 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.694 -179.716 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 31.2 m -61.35 -54.21 46.67 Favored 'General case' 0 C--N 1.326 -0.436 0 C-N-CA 120.573 -0.451 . . . . 0.0 111.424 -178.709 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 46.2 t -71.51 -45.72 66.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.248 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -56.32 -39.86 73.47 Favored 'General case' 0 C--O 1.218 -0.554 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.7 -178.662 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 79.7 tt0 -55.14 -47.8 74.57 Favored 'General case' 0 C--N 1.319 -0.761 0 C-N-CA 120.842 -0.343 . . . . 0.0 110.574 -179.938 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 53.3 mtpt -53.81 -36.77 62.85 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.587 -179.07 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 73.8 t80 -60.44 -42.21 95.64 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.592 179.663 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 58.7 t -59.1 -48.42 86.81 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.517 -177.924 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 70.4 mt -54.33 -42.06 55.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.393 179.906 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -53.85 -35.02 61.05 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.419 -179.777 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 37.4 mm -62.53 -43.32 98.27 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.781 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 83.4 tt0 -61.22 -44.86 96.59 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.962 -179.469 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 4.0 mp0 -59.55 -37.74 79.22 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.71 -179.728 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 73.1 mm-40 -67.87 -39.14 83.78 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.526 -179.543 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' ALA . . . . . 0.417 ' O ' ' N ' ' A' ' 104' ' ' LYS . . . -60.45 -33.96 73.3 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.343 -179.953 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 97.2 m -62.28 -44.05 97.42 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.395 -179.821 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 65.2 mttp -67.04 -11.13 56.21 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.401 -179.351 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.503 ' O ' ' C ' ' A' ' 104' ' ' LYS . 61.2 mt -115.23 -11.59 11.95 Favored 'General case' 0 CA--C 1.502 -0.879 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.625 -179.732 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.503 ' C ' ' O ' ' A' ' 103' ' ' LEU . 36.4 ttpt -23.31 -47.0 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.694 0 O-C-N 123.705 0.628 . . . . 0.0 111.107 179.881 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 105' ' ' GLU . . . . . 0.508 ' CD ' ' H ' ' A' ' 105' ' ' GLU . 1.9 mp0 -53.96 -154.27 0.0 OUTLIER 'General case' 0 C--O 1.225 -0.208 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.998 177.697 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 106' ' ' THR . . . . . 0.755 HG23 ' H ' ' A' ' 107' ' ' GLY . 5.1 t -46.25 -58.88 3.28 Favored 'General case' 0 C--N 1.322 -0.625 0 O-C-N 122.122 -0.361 . . . . 0.0 110.924 179.77 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 107' ' ' GLY . . . . . 0.755 ' H ' HG23 ' A' ' 106' ' ' THR . . . 72.62 148.61 0.88 Allowed Glycine 0 CA--C 1.522 0.506 0 N-CA-C 110.554 -1.018 . . . . 0.0 110.554 -179.632 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 11.4 t -97.04 136.37 37.7 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 120.913 0.387 . . . . 0.0 110.361 179.721 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 78.5 p -63.73 -35.47 80.69 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.756 -179.888 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -64.92 -36.27 92.89 Favored Glycine 0 CA--C 1.522 0.501 0 N-CA-C 111.079 -0.808 . . . . 0.0 111.079 -179.769 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 12.5 tm-20 -62.31 -47.52 83.91 Favored 'General case' 0 C--N 1.325 -0.458 0 C-N-CA 120.784 -0.367 . . . . 0.0 110.812 -179.443 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 69.3 m-85 -65.21 -38.53 90.72 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.329 -179.386 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 67.3 m -56.42 -40.93 75.53 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.417 -179.839 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -66.09 -28.31 68.73 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.376 179.405 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 42.1 tpp -74.12 -53.66 9.44 Favored 'General case' 0 C--N 1.333 -0.15 0 C-N-CA 120.66 -0.416 . . . . 0.0 110.713 -179.145 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 41.1 t80 -51.26 -37.83 49.33 Favored 'General case' 0 N--CA 1.461 0.086 0 N-CA-C 110.1 -0.333 . . . . 0.0 110.1 -179.576 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 26.2 m-20 -61.93 -41.65 98.2 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.001 179.552 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.549 ' O ' HD23 ' A' ' 118' ' ' LEU . 1.2 tt -60.1 -41.55 92.78 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-O 120.933 0.397 . . . . 0.0 110.064 -179.636 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 119' ' ' MET . . . . . 0.542 ' SD ' ' SD ' ' A' ' 160' ' ' MET . 14.7 tpt -57.53 -47.69 81.33 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.536 -0.756 . . . . 0.0 109.503 -179.86 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 74.2 t80 -59.63 -43.51 93.8 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.432 -179.514 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 97.6 mt-10 -59.08 -35.74 73.9 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.716 -179.766 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 122' ' ' VAL . . . . . 0.636 ' O ' HD23 ' A' ' 126' ' ' LEU . 87.7 t -82.61 -24.31 8.76 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.662 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.399 -179.855 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 15.6 m -75.53 -27.94 58.9 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-O 121.078 0.466 . . . . 0.0 111.048 -179.324 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 124' ' ' LYS . . . . . 0.538 ' N ' ' HD2' ' A' ' 125' ' ' PRO . 4.0 mmtm -63.02 -58.04 18.26 Favored Pre-proline 0 C--O 1.213 -0.852 0 C-N-CA 120.563 -0.455 . . . . 0.0 112.185 -179.513 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 125' ' ' PRO . . . . . 0.538 ' HD2' ' N ' ' A' ' 124' ' ' LYS . 28.5 Cg_endo -59.8 -30.23 91.47 Favored 'Trans proline' 0 C--N 1.302 -1.893 0 C-N-CA 122.647 2.231 . . . . 0.0 112.532 -178.927 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.636 HD23 ' O ' ' A' ' 122' ' ' VAL . 3.2 mm? -60.72 -35.35 76.1 Favored 'General case' 0 C--N 1.312 -1.045 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.783 -179.635 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 127' ' ' GLN . . . . . 0.404 ' CG ' ' N ' ' A' ' 128' ' ' LYS . 8.3 pt20 -51.5 -38.15 52.61 Favored 'General case' 0 C--N 1.311 -1.108 0 O-C-N 123.825 0.703 . . . . 0.0 110.504 -179.257 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 128' ' ' LYS . . . . . 0.404 ' N ' ' CG ' ' A' ' 127' ' ' GLN . 55.6 mtpt -63.53 -10.4 17.81 Favored 'General case' 0 CA--C 1.514 -0.412 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.922 -178.582 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 15.8 mt -117.61 21.86 12.72 Favored 'General case' 0 CA--C 1.509 -0.625 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.936 179.883 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 130' ' ' GLY . . . . . 0.517 ' O ' ' C ' ' A' ' 131' ' ' ILE . . . 101.15 -121.76 7.35 Favored Glycine 0 CA--C 1.506 -0.474 0 N-CA-C 110.735 -0.946 . . . . 0.0 110.735 179.589 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 131' ' ' ILE . . . . . 0.81 ' N ' HD12 ' A' ' 131' ' ' ILE . 2.0 mp 21.79 81.78 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 CA-C-N 116.591 0.195 . . . . 0.0 111.131 -179.439 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 69.5 tp60 -106.51 74.88 1.04 Allowed 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 -178.564 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 174.81 -6.81 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 O-C-N 123.452 0.47 . . . . 0.0 110.456 179.847 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 7.5 tpt -51.21 -40.33 58.5 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.493 -179.123 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 24.8 m -73.0 -59.76 2.56 Favored 'General case' 0 C--O 1.214 -0.777 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.048 179.444 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 136' ' ' LYS . . . . . 0.41 ' H ' ' HG2' ' A' ' 136' ' ' LYS . 44.9 mmtm -43.46 -50.8 6.9 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.982 -0.377 . . . . 0.0 109.982 -178.798 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 91.5 m -58.54 -52.11 67.06 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.629 -0.428 . . . . 0.0 110.925 179.621 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 48.7 t -64.03 -44.01 97.69 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.856 179.929 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 73.9 m -64.4 -42.19 96.24 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.495 -179.397 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 19.1 m-20 -67.07 -30.53 70.61 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.46 -179.58 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -71.43 -28.29 63.87 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.826 -179.433 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 142' ' ' ALA . . . . . 0.455 ' O ' ' O ' ' A' ' 143' ' ' GLU . . . -75.07 -29.97 60.84 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.695 -179.372 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 143' ' ' GLU . . . . . 0.533 ' O ' ' N ' ' A' ' 145' ' ' ASN . 69.3 tt0 -60.48 -119.47 0.0 OUTLIER 'General case' 0 C--O 1.211 -0.956 0 CA-C-O 119.082 -0.485 . . . . 0.0 109.811 -179.382 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 144' ' ' GLU . . . . . 0.501 ' C ' ' O ' ' A' ' 143' ' ' GLU . 84.0 tt0 18.54 -82.98 0.0 OUTLIER 'General case' 0 CA--C 1.518 -0.263 0 O-C-N 123.696 0.623 . . . . 0.0 111.678 -179.599 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 145' ' ' ASN . . . . . 0.533 ' N ' ' O ' ' A' ' 143' ' ' GLU . 57.7 t30 -127.19 95.58 36.07 Favored Pre-proline 0 CA--C 1.534 0.365 0 CA-C-N 115.467 -0.788 . . . . 0.0 111.24 178.332 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 146' ' ' PRO . . . . . . . . . . . . . 69.8 Cg_exo -50.07 125.16 14.15 Favored 'Trans proline' 0 C--N 1.321 -0.915 0 C-N-CA 122.653 2.235 . . . . 0.0 112.183 179.367 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 147' ' ' PRO . . . . . 0.442 ' C ' ' H ' ' A' ' 149' ' ' THR . 68.2 Cg_endo -75.37 70.52 5.52 Favored 'Trans proline' 0 C--N 1.312 -1.395 0 C-N-CA 122.527 2.151 . . . . 0.0 112.646 -179.402 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 40.2 p -77.88 22.05 0.29 Allowed 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.352 -179.914 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 149' ' ' THR . . . . . 0.478 HG22 ' N ' ' A' ' 150' ' ' ALA . 16.6 m -137.6 163.36 31.41 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.539 179.55 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 150' ' ' ALA . . . . . 0.478 ' N ' HG22 ' A' ' 149' ' ' THR . . . -62.99 -41.39 99.56 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.609 179.432 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 87.9 mt-30 -68.31 -33.68 74.76 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.139 179.804 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . -63.77 -51.42 53.88 Favored Glycine 0 CA--C 1.526 0.724 0 N-CA-C 110.834 -0.906 . . . . 0.0 110.834 -179.843 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 153' ' ' VAL . . . . . . . . . . . . . 69.1 t -60.77 -25.01 34.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 N-CA-C 110.157 -0.312 . . . . 0.0 110.157 -179.589 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 154' ' ' LEU . . . . . 0.535 ' O ' HD23 ' A' ' 154' ' ' LEU . 1.0 OUTLIER -59.03 -39.74 82.9 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 121.133 0.492 . . . . 0.0 109.776 -179.011 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -59.84 -50.92 71.93 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 179.86 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 20.1 mm -54.31 -56.06 11.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 C-N-CA 120.789 -0.364 . . . . 0.0 110.452 -179.417 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -50.32 -49.03 54.98 Favored 'General case' 0 C--N 1.33 -0.277 0 O-C-N 123.502 0.501 . . . . 0.0 110.339 179.9 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 158' ' ' LYS . . . . . 0.459 ' NZ ' ' OE2' ' A' ' 162' ' ' GLU . 63.6 tttm -64.91 -37.28 87.11 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.445 179.004 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 61.5 tttp -66.87 -31.96 72.91 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.308 -179.82 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 160' ' ' MET . . . . . 0.542 ' SD ' ' SD ' ' A' ' 119' ' ' MET . 3.8 mtm -67.3 -44.73 78.48 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.36 179.475 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 78.1 ttt180 -65.59 -33.23 75.43 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.411 -179.888 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 162' ' ' GLU . . . . . 0.459 ' OE2' ' NZ ' ' A' ' 158' ' ' LYS . 95.7 mt-10 -71.25 -29.68 65.4 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.152 -0.477 . . . . 0.0 111.0 -179.711 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 163' ' ' LYS . . . . . . . . . . . . . 2.0 tmtm? -83.11 -42.74 17.04 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-O 121.804 0.811 . . . . 0.0 110.94 -179.104 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 6.0 mt -67.82 -30.74 70.23 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.695 -0.684 . . . . 0.0 112.016 -178.607 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 165' ' ' GLN . . . . . 0.401 ' HG3' ' O ' ' A' ' 162' ' ' GLU . 0.0 OUTLIER -64.28 -31.82 73.17 Favored 'General case' 0 C--N 1.314 -0.963 0 O-C-N 123.776 0.673 . . . . 0.0 110.575 -179.08 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 58.4 ttt85 -65.88 -31.28 72.13 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.049 -179.346 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 167' ' ' VAL . . . . . . . . . . . . . 21.3 t -70.04 -45.22 77.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.066 -179.836 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 38.0 t-80 -77.91 -30.03 50.43 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.627 -178.981 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 169' ' ' THR . . . . . . . . . . . . . 97.0 m -71.39 -46.54 60.03 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.952 -179.697 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 36.2 ttpt -60.76 -44.0 97.3 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.91 -179.286 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 171' ' ' ASN . . . . . . . . . . . . . 10.7 m120 -62.35 -30.88 71.49 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.608 179.725 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 172' ' ' TYR . . . . . . . . . . . . . 43.7 t80 -73.33 -35.29 66.01 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.09 0.472 . . . . 0.0 110.732 -179.981 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 1.9 t -76.61 -31.52 57.48 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.803 -179.375 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 9.2 p -60.82 -48.89 79.73 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.193 -179.1 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 11.0 mp -69.38 -32.19 71.07 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.338 179.23 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 33.9 ttmt -58.84 -28.52 66.14 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.091 -179.693 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 177' ' ' LYS . . . . . . . . . . . . . 58.9 tttm -55.48 -28.84 56.94 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.426 179.659 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 178' ' ' LYS . . . . . . . . . . . . . 25.2 mmtp -60.73 -44.28 96.85 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.441 -179.119 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 77.3 mt-10 -63.06 -32.66 74.08 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.157 -0.474 . . . . 0.0 109.85 179.376 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 180' ' ' ASN . . . . . . . . . . . . . 6.0 p30 -138.24 94.6 2.89 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-O 121.15 0.5 . . . . 0.0 109.962 179.661 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 11.1 t -52.68 -43.36 65.53 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.513 -179.35 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 182' ' ' THR . . . . . . . . . . . . . 64.3 p -60.44 96.12 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.476 179.379 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 183' ' ' PHE . . . . . 0.602 ' CD1' ' N ' ' A' ' 184' ' ' THR . 13.8 p90 -61.14 -44.84 96.71 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.076 0.465 . . . . 0.0 110.488 -179.971 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 184' ' ' THR . . . . . 0.602 ' N ' ' CD1' ' A' ' 183' ' ' PHE . 23.0 m -51.66 148.78 5.09 Favored 'General case' 0 CA--C 1.519 -0.231 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.526 -177.74 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 185' ' ' ASP . . . . . . . . . . . . . 36.4 t70 58.65 55.31 4.82 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.315 179.354 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 186' ' ' GLU . . . . . . . . . . . . . 80.6 mm-40 -136.63 -49.18 0.64 Allowed 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.185 179.548 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 34.3 tptt 54.84 105.24 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.925 179.947 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 188' ' ' CYS . . . . . . . . . . . . . 84.9 m -70.99 -53.81 13.49 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.591 179.764 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 189' ' ' LYS . . . . . 0.406 ' HZ2' ' ND2' ' A' ' 190' ' ' ASN . 62.9 tttm 46.63 -104.16 0.09 Allowed 'General case' 0 C--N 1.333 -0.121 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.232 -179.524 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 190' ' ' ASN . . . . . 0.473 ' OD1' ' N ' ' A' ' 190' ' ' ASN . 10.8 p-10 -125.23 -69.41 0.79 Allowed 'General case' 0 N--CA 1.455 -0.193 0 N-CA-C 109.955 -0.387 . . . . 0.0 109.955 179.709 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 191' ' ' ASN . . . . . 0.453 ' H ' ' CG ' ' A' ' 190' ' ' ASN . 53.0 p30 . . . . . 0 C--O 1.219 -0.525 0 CA-C-O 117.978 -1.011 . . . . 0.0 110.579 -179.379 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 70.6 m . . . . . 0 N--CA 1.49 1.556 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -166.29 -176.07 3.52 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.454 179.972 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' GLY . . . . . 0.492 ' O ' ' C ' ' A' ' 27' ' ' LEU . . . -174.86 -42.35 0.05 OUTLIER Glycine 0 CA--C 1.499 -0.906 0 CA-C-O 118.503 -1.165 . . . . 0.0 110.919 -179.94 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.492 ' C ' ' O ' ' A' ' 26' ' ' GLY . 50.7 mt -17.95 136.09 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.816 0 O-C-N 124.695 0.879 . . . . 0.0 111.239 179.532 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.7 t -152.03 45.33 0.75 Allowed 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.073 0.463 . . . . 0.0 109.997 -178.784 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' GLY . . . . . 0.587 ' O ' ' HB3' ' A' ' 30' ' ' ALA . . . 112.35 24.08 5.2 Favored Glycine 0 N--CA 1.472 1.099 0 N-CA-C 110.601 -1.0 . . . . 0.0 110.601 -179.781 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.587 ' HB3' ' O ' ' A' ' 29' ' ' GLY . . . 77.93 -20.77 0.36 Allowed 'General case' 0 C--O 1.221 -0.426 0 CA-C-O 121.531 0.681 . . . . 0.0 110.822 179.766 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.408 ' H ' ' C ' ' A' ' 29' ' ' GLY . 88.9 m -46.2 -34.31 4.26 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.369 -178.551 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 18.6 mmtp -64.25 -24.01 67.51 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.468 179.811 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 44.2 mm -62.0 -42.53 95.2 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.887 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 -179.073 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 45.0 ttm180 -63.32 -42.77 99.03 Favored 'General case' 0 C--N 1.321 -0.668 0 O-C-N 123.488 0.493 . . . . 0.0 110.141 -179.845 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 41.5 mt -66.66 -37.11 84.13 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.441 -179.765 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 80.4 tt0 -62.58 -45.51 92.6 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.6 -179.381 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -66.59 -40.82 89.09 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.329 179.937 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 83.5 p -73.49 -22.76 60.05 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.449 179.824 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -70.09 -49.54 49.9 Favored 'General case' 0 C--O 1.224 -0.27 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.768 -179.807 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 65.3 tttp -54.78 -42.68 72.05 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.567 -179.86 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' ASP . . . . . 0.413 ' OD1' ' N ' ' A' ' 41' ' ' ASP . 2.0 m-20 -50.44 -23.51 2.48 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.642 -179.336 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 72.2 mt -63.71 -50.89 75.96 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.094 -179.703 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 76.0 p -76.03 -38.51 57.15 Favored 'General case' 0 C--O 1.223 -0.3 0 CA-C-O 121.406 0.622 . . . . 0.0 110.797 -178.686 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 48.2 t0 -61.86 -35.99 79.93 Favored 'General case' 0 CA--C 1.519 -0.239 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.66 -177.472 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 66.1 mm-40 -71.26 -53.32 14.74 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.24 -179.76 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 9.3 pt -69.34 -31.84 51.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.706 -178.879 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 35.5 t0 -63.76 -29.45 70.66 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.181 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -67.31 -36.03 80.65 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.411 -0.358 . . . . 0.0 110.709 -179.763 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 70.4 mt -59.21 -48.42 86.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.137 -179.07 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 9.4 mtmp? -64.76 -36.4 84.19 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.469 179.707 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -62.74 -44.33 96.5 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.998 -0.547 . . . . 0.0 110.536 -179.688 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 60.1 m-20 -77.14 -35.34 56.23 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 116.511 -0.313 . . . . 0.0 110.896 -179.95 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -70.26 -38.81 75.2 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.799 -179.895 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' ALA . . . . . 0.528 ' O ' ' N ' ' A' ' 56' ' ' LYS . . . -50.79 -52.67 38.72 Favored 'General case' 0 CA--C 1.501 -0.936 0 CA-C-O 118.832 -0.604 . . . . 0.0 111.093 -178.929 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.554 ' O ' ' C ' ' A' ' 56' ' ' LYS . 4.5 mm? -12.98 80.96 0.0 OUTLIER 'General case' 0 CA--C 1.497 -1.095 0 O-C-N 124.423 1.077 . . . . 0.0 111.469 -179.744 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.554 ' C ' ' O ' ' A' ' 55' ' ' LEU . 1.1 ptmm? 8.77 67.5 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.63 0 O-C-N 124.793 1.308 . . . . 0.0 110.91 -178.256 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' GLY . . . . . 0.424 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . -156.56 -88.33 0.07 OUTLIER Glycine 0 CA--C 1.519 0.337 0 N-CA-C 110.661 -0.976 . . . . 0.0 110.661 -178.06 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 48.1 t -52.53 132.06 14.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-O 120.954 0.406 . . . . 0.0 110.599 -179.344 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' ASN . . . . . 0.404 ' O ' ' O ' ' A' ' 60' ' ' PHE . 85.7 m-20 -64.65 -49.51 70.72 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.126 -179.188 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 60' ' ' PHE . . . . . 0.404 ' O ' ' O ' ' A' ' 59' ' ' ASN . 4.0 t80 50.96 176.54 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.768 -179.311 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 84.0 m-20 51.76 55.58 9.11 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.502 179.409 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -155.94 80.95 1.0 Allowed 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.45 -179.865 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 99.2 m-85 -116.23 7.95 14.19 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.345 179.672 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 65.2 mttp -53.7 -58.54 6.85 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.523 -179.785 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 90.9 m-20 -77.14 143.9 38.8 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.319 179.854 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 65.3 mttp -70.7 145.97 50.21 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.42 -179.851 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -75.9 149.94 37.66 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.29 179.914 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 3.5 t -149.23 156.8 42.7 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.496 -179.908 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 71.87 -108.6 2.54 Favored Glycine 0 CA--C 1.524 0.636 0 N-CA-C 110.981 -0.847 . . . . 0.0 110.981 179.924 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 24.2 t -169.51 -133.86 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.651 0.263 . . . . 0.0 110.683 -179.881 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -56.3 -52.8 47.39 Favored Glycine 0 C--N 1.333 0.361 0 N-CA-C 110.494 -1.042 . . . . 0.0 110.494 -179.69 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 27.5 m -39.03 157.77 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.209 0 CA-C-N 116.655 0.228 . . . . 0.0 110.598 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 40.3 t 56.01 -95.84 0.06 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.88 0.372 . . . . 0.0 110.272 -178.729 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' GLU . . . . . 0.493 ' O ' ' C ' ' A' ' 75' ' ' ASN . 43.8 tp10 -49.98 96.47 0.01 OUTLIER 'General case' 0 CA--C 1.51 -0.584 0 CA-C-O 119.299 -0.382 . . . . 0.0 110.491 -179.839 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 75' ' ' ASN . . . . . 0.639 HD22 ' N ' ' A' ' 75' ' ' ASN . 0.0 OUTLIER -22.32 111.03 0.15 Allowed Pre-proline 0 CA--C 1.544 0.717 0 O-C-N 124.556 1.16 . . . . 0.0 110.858 -179.969 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -51.14 -1.22 0.05 OUTLIER 'Trans proline' 0 C--N 1.31 -1.454 0 C-N-CA 122.564 2.176 . . . . 0.0 112.2 -179.038 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' PHE . . . . . 0.557 ' H ' ' C ' ' A' ' 75' ' ' ASN . 20.1 m-85 -66.79 -46.93 73.71 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-O 120.668 0.271 . . . . 0.0 110.662 -179.763 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 77.4 mt -72.17 -32.64 43.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-O 121.127 0.489 . . . . 0.0 110.358 -179.248 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.687 HD22 ' N ' ' A' ' 79' ' ' LEU . 3.2 mm? -66.88 -48.31 69.16 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.801 -178.723 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -69.31 -27.13 65.11 Favored 'General case' 0 C--N 1.317 -0.836 0 O-C-N 123.698 0.624 . . . . 0.0 109.969 179.664 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -79.24 -19.56 50.37 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.086 0.47 . . . . 0.0 110.837 179.988 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' LYS . . . . . 0.47 ' NZ ' ' CG2' ' A' ' 167' ' ' VAL . 53.1 tttm -70.5 -46.34 63.88 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.606 -179.499 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 16.4 m -71.59 -38.11 66.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.494 179.807 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -62.6 -38.64 90.95 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.662 -179.754 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -58.97 -42.26 89.5 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.698 -179.811 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 33.3 p -81.33 -20.0 41.65 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.706 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 85.9 m -62.09 -53.11 60.1 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 120.666 -0.413 . . . . 0.0 110.984 -178.471 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 48.9 t -69.37 -41.3 80.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 121.147 0.499 . . . . 0.0 110.639 -179.427 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -62.96 -36.81 84.71 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.769 -178.859 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 79.2 tt0 -54.94 -31.35 60.38 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.637 -179.906 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 63.8 mttp -66.51 -36.2 82.13 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.565 -179.969 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 87.6 t80 -62.35 -60.65 3.25 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.429 -178.624 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 16.5 m -51.65 -40.99 27.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-O 121.093 0.473 . . . . 0.0 110.602 -178.72 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 49.3 mt -57.04 -41.79 78.13 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 N-CA-C 109.783 -0.451 . . . . 0.0 109.783 -179.94 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.99 -36.56 79.76 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.081 -179.77 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 30.5 mm -63.87 -43.94 97.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.535 -179.857 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 75.7 tt0 -58.34 -46.78 85.59 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.358 -179.404 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -70.74 -35.44 72.68 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.97 0.414 . . . . 0.0 110.793 -179.48 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 47.8 tp10 -62.75 -46.67 86.99 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.686 -179.27 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -56.12 -38.62 71.05 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.877 0.37 . . . . 0.0 110.478 -179.17 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 19.5 m -61.64 -41.86 98.09 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.653 -179.652 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -64.38 -40.76 96.45 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.912 -178.826 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.534 ' O ' ' O ' ' A' ' 104' ' ' LYS . 33.9 mt -84.93 -10.3 57.22 Favored 'General case' 0 C--O 1.2 -1.542 0 CA-C-O 116.993 -1.479 . . . . 0.0 111.013 -178.702 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.534 ' O ' ' O ' ' A' ' 103' ' ' LEU . 0.0 OUTLIER 4.4 -124.71 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.062 0 O-C-N 125.243 1.59 . . . . 0.0 111.038 178.951 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 105' ' ' GLU . . . . . 0.55 ' O ' ' N ' ' A' ' 107' ' ' GLY . 69.7 mm-40 -56.98 -162.31 0.0 OUTLIER 'General case' 0 N--CA 1.437 -1.122 0 N-CA-C 109.986 -0.376 . . . . 0.0 109.986 178.653 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 106' ' ' THR . . . . . 0.444 ' CG2' ' HZ2' ' A' ' 104' ' ' LYS . 2.1 t 32.21 31.23 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 120.995 0.426 . . . . 0.0 110.87 -179.52 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 107' ' ' GLY . . . . . 0.55 ' N ' ' O ' ' A' ' 105' ' ' GLU . . . -89.28 158.66 27.97 Favored Glycine 0 C--N 1.335 0.506 0 N-CA-C 110.053 -1.219 . . . . 0.0 110.053 -179.103 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 55.9 m -114.75 124.43 51.76 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-O 120.919 0.39 . . . . 0.0 110.232 -179.744 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 77.9 p -59.99 -33.52 72.09 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.555 -179.985 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -63.61 -40.69 98.92 Favored Glycine 0 CA--C 1.524 0.62 0 N-CA-C 111.127 -0.789 . . . . 0.0 111.127 -179.548 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -67.58 -41.58 83.92 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.649 0.261 . . . . 0.0 110.586 -179.801 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 40.8 m-85 -63.06 -39.57 95.12 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.35 179.923 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 36.9 t -55.2 -38.21 68.09 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.144 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -69.88 -24.08 63.36 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.624 178.923 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 36.8 tpp -76.68 -45.79 28.29 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.063 -179.841 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 37.3 t80 -64.11 -36.24 83.37 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.877 0.37 . . . . 0.0 110.26 -179.374 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -65.6 -29.34 69.92 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.382 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.572 ' O ' HD23 ' A' ' 118' ' ' LEU . 3.1 tt -64.18 -49.3 72.57 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 122.134 0.969 . . . . 0.0 110.723 -179.564 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 15.8 tpt -50.54 -41.64 54.25 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.146 -179.29 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 51.9 t80 -60.29 -41.97 94.48 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.059 0.457 . . . . 0.0 111.326 -179.83 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -58.98 -51.95 67.87 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.913 -178.991 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 29.1 m -72.94 -24.0 20.77 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-O 121.096 0.474 . . . . 0.0 110.856 -179.431 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 40.5 t -61.55 -27.18 68.44 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.454 -179.906 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 124' ' ' LYS . . . . . 0.45 ' CB ' ' CD ' ' A' ' 125' ' ' PRO . 16.2 mmtt -64.47 -59.19 11.29 Favored Pre-proline 0 C--O 1.222 -0.391 0 C-N-CA 120.575 -0.45 . . . . 0.0 111.775 -179.19 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 125' ' ' PRO . . . . . 0.45 ' CD ' ' CB ' ' A' ' 124' ' ' LYS . 61.1 Cg_exo -41.22 -36.89 2.69 Favored 'Trans proline' 0 C--N 1.306 -1.695 0 C-N-CA 122.537 2.158 . . . . 0.0 112.199 178.039 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 31.7 mt -67.52 -22.86 65.42 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.068 -179.438 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 127' ' ' GLN . . . . . 0.477 ' C ' ' H ' ' A' ' 129' ' ' LEU . 84.3 mt-30 -66.13 -50.93 62.3 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.995 0.426 . . . . 0.0 110.922 -179.621 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 73.8 mmtt -55.01 -6.11 0.12 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.609 179.713 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.477 ' H ' ' C ' ' A' ' 127' ' ' GLN . 12.1 mt -118.08 19.25 13.66 Favored 'General case' 0 N--CA 1.465 0.299 0 O-C-N 123.451 0.47 . . . . 0.0 110.826 179.328 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 130' ' ' GLY . . . . . 0.544 ' O ' ' HB ' ' A' ' 131' ' ' ILE . . . 73.02 -177.13 42.73 Favored Glycine 0 CA--C 1.493 -1.333 0 N-CA-C 109.608 -1.397 . . . . 0.0 109.608 179.623 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 131' ' ' ILE . . . . . 0.919 ' O ' ' O ' ' A' ' 132' ' ' GLN . 60.9 mt 85.7 -20.91 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.476 -1.893 0 CA-C-O 116.996 -1.478 . . . . 0.0 110.78 178.576 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 132' ' ' GLN . . . . . 0.919 ' O ' ' O ' ' A' ' 131' ' ' ILE . 67.8 mt-30 -8.19 -145.58 0.0 OUTLIER 'General case' 0 N--CA 1.479 0.976 0 O-C-N 125.544 1.778 . . . . 0.0 112.097 -179.727 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 51.53 4.44 0.02 OUTLIER 'General case' 0 C--N 1.303 -1.417 0 O-C-N 120.032 -1.667 . . . . 0.0 111.409 179.385 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 134' ' ' MET . . . . . 0.58 ' N ' ' O ' ' A' ' 132' ' ' GLN . 0.0 OUTLIER -63.19 -43.35 98.44 Favored 'General case' 0 N--CA 1.444 -0.751 0 N-CA-C 109.926 -0.398 . . . . 0.0 109.926 -179.229 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 38.6 p -71.1 -22.4 62.09 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.737 -0.665 . . . . 0.0 109.97 179.655 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 16.3 ttmm -76.6 -57.05 4.08 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.323 -178.946 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 96.6 m -52.04 -53.17 45.21 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 120.686 -0.406 . . . . 0.0 110.628 -179.296 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 138' ' ' VAL . . . . . 0.472 HG13 ' N ' ' A' ' 139' ' ' SER . 13.8 p -62.4 -39.64 85.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.787 -179.26 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 139' ' ' SER . . . . . 0.472 ' N ' HG13 ' A' ' 138' ' ' VAL . 4.5 t -57.25 -33.29 67.44 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.382 -179.345 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -60.53 -39.85 89.34 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.47 -179.775 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -58.27 -51.28 70.42 Favored 'General case' 0 CA--C 1.515 -0.368 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.433 -179.752 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -41.29 -42.08 2.08 Favored 'General case' 0 CA--C 1.533 0.315 0 O-C-N 123.176 0.298 . . . . 0.0 110.482 -179.093 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 94.4 mt-10 -85.78 66.66 9.73 Favored 'General case' 0 C--N 1.322 -0.602 0 O-C-N 123.781 0.676 . . . . 0.0 109.727 177.993 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -179.45 -21.76 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 O-C-N 123.546 0.529 . . . . 0.0 110.606 179.813 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 145' ' ' ASN . . . . . . . . . . . . . 4.3 p30 -173.04 68.31 0.37 Allowed Pre-proline 0 C--N 1.327 -0.41 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.247 -179.512 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 146' ' ' PRO . . . . . 0.541 ' O ' ' N ' ' A' ' 148' ' ' THR . 94.1 Cg_exo -37.39 118.27 0.24 Allowed 'Trans proline' 0 C--N 1.317 -1.131 0 C-N-CA 123.139 2.559 . . . . 0.0 111.69 -179.845 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 147' ' ' PRO . . . . . 0.419 ' C ' ' H ' ' A' ' 149' ' ' THR . 31.2 Cg_exo -59.98 39.86 0.05 OUTLIER 'Trans proline' 0 N--CA 1.498 1.794 0 C-N-CA 122.826 2.35 . . . . 0.0 112.408 178.931 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 148' ' ' THR . . . . . 0.541 ' N ' ' O ' ' A' ' 146' ' ' PRO . 20.6 p -65.61 0.39 1.65 Allowed 'General case' 0 N--CA 1.448 -0.573 0 N-CA-C 110.031 -0.359 . . . . 0.0 110.031 179.69 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 149' ' ' THR . . . . . 0.419 ' H ' ' C ' ' A' ' 147' ' ' PRO . 24.3 p -141.54 166.33 25.03 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.392 179.693 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -68.42 -41.31 80.59 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.626 179.778 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 99.1 mm-40 -66.76 -25.71 66.62 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.209 -179.63 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . -68.77 -33.71 76.23 Favored Glycine 0 CA--C 1.521 0.444 0 N-CA-C 111.237 -0.745 . . . . 0.0 111.237 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 153' ' ' VAL . . . . . . . . . . . . . 57.5 t -60.5 -26.48 37.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-O 120.921 0.391 . . . . 0.0 110.756 -178.786 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 154' ' ' LEU . . . . . 0.561 HD22 ' N ' ' A' ' 154' ' ' LEU . 4.0 mm? -62.97 -37.75 88.37 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.315 -179.073 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 42.3 tp10 -64.39 -32.93 74.74 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.064 -179.708 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 156' ' ' ILE . . . . . 0.548 HD12 ' N ' ' A' ' 156' ' ' ILE . 1.6 mp -77.06 -45.1 30.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.659 179.334 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -55.6 -43.2 75.83 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.541 -177.953 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -55.67 -47.28 76.99 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.022 -179.714 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 32.5 mmtp -65.66 -32.6 74.26 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.475 -0.33 . . . . 0.0 110.692 179.812 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 160' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -70.98 -53.23 15.62 Favored 'General case' 0 CA--C 1.515 -0.369 0 C-N-CA 120.505 -0.478 . . . . 0.0 111.309 -179.52 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 60.2 ttp180 -65.77 -42.58 90.65 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.736 -179.524 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 52.6 tp10 -57.8 -53.96 52.29 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.94 -179.061 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 163' ' ' LYS . . . . . . . . . . . . . 52.9 tptt -57.03 -35.26 69.08 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.708 -178.813 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 23.1 mt -69.57 -38.86 77.55 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.244 0.545 . . . . 0.0 111.709 -179.449 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 84.8 mt-30 -72.71 -32.11 65.5 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.648 -178.776 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 75.0 ttt180 -66.66 -40.96 88.84 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-O 121.951 0.882 . . . . 0.0 111.298 -178.622 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 167' ' ' VAL . . . . . 0.47 ' CG2' ' NZ ' ' A' ' 82' ' ' LYS . 7.7 p -75.17 -34.27 30.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 115.723 -0.672 . . . . 0.0 110.965 -179.958 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 168' ' ' HIS . . . . . 0.429 ' C ' ' ND1' ' A' ' 168' ' ' HIS . 14.6 t-80 -76.92 -41.66 42.61 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.935 -179.076 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 169' ' ' THR . . . . . . . . . . . . . 35.3 m -66.88 -43.8 82.52 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.235 -179.928 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 64.6 tttm -59.84 -48.19 82.69 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.842 -178.542 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 171' ' ' ASN . . . . . . . . . . . . . 20.0 t-20 -67.27 -40.72 86.21 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.009 0.433 . . . . 0.0 110.836 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 172' ' ' TYR . . . . . . . . . . . . . 64.1 t80 -68.76 -25.41 64.71 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.549 -179.293 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 17.0 t -78.47 -30.15 47.19 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.822 -179.209 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 22.7 p -73.06 -34.7 66.42 Favored 'General case' 0 C--O 1.222 -0.394 0 CA-C-O 121.333 0.587 . . . . 0.0 110.615 -178.983 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 99.0 mt -64.72 -43.54 93.11 Favored 'General case' 0 C--N 1.317 -0.828 0 C-N-CA 120.667 -0.413 . . . . 0.0 111.793 -178.617 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 17.7 ptpt -73.76 -14.25 61.09 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.009 -179.1 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 177' ' ' LYS . . . . . . . . . . . . . 14.9 pttp -46.93 -30.15 2.4 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.477 -0.329 . . . . 0.0 110.54 -178.98 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 178' ' ' LYS . . . . . . . . . . . . . 9.1 mtmp? -55.31 -34.62 64.32 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.858 -178.111 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 81.2 tt0 -50.64 -37.11 38.84 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.555 179.793 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 180' ' ' ASN . . . . . . . . . . . . . 83.1 m-20 -108.48 64.39 0.62 Allowed 'General case' 0 N--CA 1.47 0.551 0 CA-C-N 116.409 -0.359 . . . . 0.0 110.218 179.817 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 89.3 p -73.28 -10.81 60.15 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.471 179.783 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 182' ' ' THR . . . . . . . . . . . . . 20.8 m -60.14 -47.88 84.05 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.585 -179.638 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 183' ' ' PHE . . . . . . . . . . . . . 18.5 t80 -97.8 119.25 36.06 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.879 0.371 . . . . 0.0 110.211 179.933 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 31.1 m -64.46 119.63 10.77 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.664 -179.818 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 185' ' ' ASP . . . . . . . . . . . . . 55.1 t0 57.82 108.6 0.01 OUTLIER 'General case' 0 CA--C 1.519 -0.229 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.461 179.821 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 186' ' ' GLU . . . . . 0.473 ' N ' ' OE1' ' A' ' 186' ' ' GLU . 13.6 mp0 -114.69 135.47 54.12 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-O 120.995 0.426 . . . . 0.0 110.363 -179.745 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 34.6 ttmt -64.71 132.26 49.14 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.444 179.887 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 188' ' ' CYS . . . . . . . . . . . . . 4.5 m -81.13 -29.81 34.68 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.372 179.308 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 189' ' ' LYS . . . . . . . . . . . . . 63.6 tttm 60.47 151.12 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 O-C-N 123.33 0.394 . . . . 0.0 110.637 -179.552 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 190' ' ' ASN . . . . . . . . . . . . . 58.6 t-20 -61.49 -40.17 93.58 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.5 -179.945 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 191' ' ' ASN . . . . . 0.404 ' HA ' HD21 ' A' ' 191' ' ' ASN . 8.3 m120 . . . . . 0 C--O 1.222 -0.349 0 CA-C-O 118.134 -0.936 . . . . 0.0 110.402 -179.835 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 33.9 t . . . . . 0 N--CA 1.491 1.58 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.501 ' O ' ' N ' ' A' ' 27' ' ' LEU . . . -66.02 151.24 47.27 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.464 179.904 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 56.76 -81.68 0.01 OUTLIER Glycine 0 C--N 1.333 0.399 0 N-CA-C 110.566 -1.014 . . . . 0.0 110.566 179.836 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.515 ' O ' ' OG1' ' A' ' 28' ' ' THR . 36.2 tp 55.71 106.79 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 110.017 -0.364 . . . . 0.0 110.017 -179.839 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.515 ' OG1' ' O ' ' A' ' 27' ' ' LEU . 6.8 m -171.84 -119.27 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.674 0 O-C-N 123.579 0.55 . . . . 0.0 109.707 179.163 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' GLY . . . . . 0.5 ' O ' ' HB3' ' A' ' 30' ' ' ALA . . . -134.51 93.84 0.25 Allowed Glycine 0 CA--C 1.526 0.744 0 N-CA-C 110.08 -1.208 . . . . 0.0 110.08 179.527 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.5 ' HB3' ' O ' ' A' ' 29' ' ' GLY . . . 73.16 -30.22 0.21 Allowed 'General case' 0 N--CA 1.466 0.371 0 CA-C-O 121.086 0.47 . . . . 0.0 111.062 -179.874 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.492 ' H ' ' C ' ' A' ' 29' ' ' GLY . 11.1 m -64.04 -32.74 74.39 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.351 -179.924 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.414 ' HG3' ' H ' ' A' ' 27' ' ' LEU . 1.9 tmtp? -61.95 -50.36 72.43 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.785 179.678 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 64.8 mt -64.75 -28.94 45.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.455 -179.558 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 59.9 ttm-85 -69.27 -42.63 75.27 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.628 -179.421 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 79.4 mt -65.72 -35.0 79.49 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.637 -179.589 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 80.2 mm-40 -67.19 -50.24 61.68 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.761 179.879 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 23.3 mmm180 -63.42 -43.75 96.58 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.923 0.392 . . . . 0.0 110.832 -179.234 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 78.7 p -66.86 -38.59 86.63 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.319 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -70.62 -37.08 73.77 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.872 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 33.8 tptt -62.31 -31.92 72.6 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.846 -179.252 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 82.3 m-20 -67.02 -23.6 65.93 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.86 -179.384 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 73.3 mt -62.45 -53.39 47.89 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.365 0 C-N-CA 120.731 -0.388 . . . . 0.0 110.995 -179.391 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 52.6 p -74.1 -39.99 63.03 Favored 'General case' 0 C--O 1.226 -0.183 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.475 -178.583 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -60.26 -39.54 87.16 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.119 -0.491 . . . . 0.0 112.03 -178.435 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 43.2 tp10 -70.33 -53.5 16.47 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.092 0.473 . . . . 0.0 111.385 -178.612 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 6.5 pt -67.27 -27.05 37.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.588 -179.056 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 31.7 t0 -61.82 -40.92 96.95 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 120.576 -0.449 . . . . 0.0 110.388 179.9 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -52.96 -24.85 10.24 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.383 -178.875 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 62.3 mt -64.55 -46.56 92.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.298 179.65 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 49.0 mtmt -56.53 -41.29 76.54 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.28 -178.5 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 71.4 mmtt -65.98 -41.68 90.83 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.192 179.613 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -61.87 -41.48 97.91 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.471 -179.834 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.482 ' O ' ' N ' ' A' ' 57' ' ' GLY . . . -61.34 -31.39 71.26 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.669 -179.953 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -61.89 -34.06 75.34 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.763 -179.759 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 52.3 mt -62.34 -41.97 99.01 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.948 -179.374 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -94.74 -56.26 2.84 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.599 -179.924 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' GLY . . . . . 0.482 ' N ' ' O ' ' A' ' 53' ' ' ALA . . . 98.07 47.9 1.98 Allowed Glycine 0 N--CA 1.467 0.732 0 N-CA-C 110.722 -0.951 . . . . 0.0 110.722 179.955 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.415 ' O ' ' O ' ' A' ' 59' ' ' ASN . 4.8 t -90.43 55.68 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.336 0 CA-C-O 120.822 0.344 . . . . 0.0 110.151 179.932 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 59' ' ' ASN . . . . . 0.415 ' O ' ' O ' ' A' ' 58' ' ' VAL . 72.7 m-80 47.38 -175.5 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.85 -179.927 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 28.2 t80 -172.2 -53.68 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.91 0.386 . . . . 0.0 110.64 179.686 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 85.4 m-20 -91.79 -10.79 38.64 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.532 -179.982 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -69.08 68.19 0.17 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.602 -179.855 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 65.6 m-85 -91.32 108.3 19.79 Favored 'General case' 0 N--CA 1.463 0.217 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 179.543 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.479 ' O ' ' N ' ' A' ' 66' ' ' LYS . 56.0 mtpt -96.03 18.25 13.82 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.432 -179.881 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 28.5 t70 61.98 -73.07 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.238 0 O-C-N 123.57 0.544 . . . . 0.0 110.717 179.959 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' LYS . . . . . 0.479 ' N ' ' O ' ' A' ' 64' ' ' LYS . 65.0 mttp -68.03 98.9 0.81 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.118 179.892 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -81.53 -8.77 59.76 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.485 -179.833 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 29.5 m 44.75 95.71 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.07 179.929 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 78.95 -116.8 4.41 Favored Glycine 0 CA--C 1.524 0.626 0 N-CA-C 110.661 -0.976 . . . . 0.0 110.661 -179.669 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 84.1 p -156.05 -136.3 0.05 Allowed 'General case' 0 N--CA 1.463 0.223 0 CA-C-O 120.697 0.284 . . . . 0.0 110.689 -179.772 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' GLY . . . . . 0.506 ' O ' ' N ' ' A' ' 73' ' ' SER . . . -52.0 -179.39 0.05 OUTLIER Glycine 0 CA--C 1.523 0.545 0 N-CA-C 110.41 -1.076 . . . . 0.0 110.41 179.529 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 14.8 t 61.56 -69.53 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-O 120.727 0.298 . . . . 0.0 110.827 -179.773 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' SER . . . . . 0.506 ' N ' ' O ' ' A' ' 71' ' ' GLY . 67.9 m -48.45 -63.86 0.96 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.704 179.922 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 41.8 tp10 -92.01 -65.86 0.97 Allowed 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 116.464 -0.335 . . . . 0.0 110.433 -179.817 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 6.2 m-20 -176.86 118.19 0.27 Allowed Pre-proline 0 CA--C 1.547 0.858 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.33 178.876 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -75.59 -14.14 20.0 Favored 'Trans proline' 0 N--CA 1.496 1.628 0 C-N-CA 121.709 1.606 . . . . 0.0 112.027 -179.932 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 59.3 t80 -74.31 -51.04 16.4 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-O 120.853 0.359 . . . . 0.0 111.555 -179.611 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 71.8 mt -67.47 -30.45 48.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.691 -179.482 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 8.5 mp -75.93 -48.85 19.61 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 121.097 0.475 . . . . 0.0 110.016 179.337 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -62.14 -28.06 69.38 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.937 -0.574 . . . . 0.0 109.963 179.742 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -66.37 -37.57 85.58 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.663 179.82 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 36.6 ttpt -62.82 -26.64 68.84 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.799 -179.794 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 54.0 t -70.43 -44.96 76.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.398 179.609 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 44.0 ttm180 -64.16 -35.69 81.62 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.089 -179.529 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -63.12 -41.74 99.4 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.949 0.404 . . . . 0.0 111.176 -179.333 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 41.3 p -72.76 -23.72 60.86 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.427 179.719 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 25.2 m -60.71 -51.18 70.47 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 120.787 -0.365 . . . . 0.0 111.0 -179.473 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 21.9 t -78.54 -48.24 22.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-O 121.209 0.528 . . . . 0.0 111.92 179.791 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -54.62 -45.59 73.73 Favored 'General case' 0 C--O 1.223 -0.331 0 CA-C-N 115.397 -0.819 . . . . 0.0 111.62 -177.387 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.423 ' CG ' ' N ' ' A' ' 91' ' ' LYS . 14.3 pt-20 -59.75 -42.57 93.52 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.989 0.424 . . . . 0.0 110.594 -179.569 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 91' ' ' LYS . . . . . 0.423 ' N ' ' CG ' ' A' ' 90' ' ' GLU . 67.6 mttm -59.09 -38.3 79.17 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.35 -179.221 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.412 ' CE2' HD11 ' A' ' 96' ' ' ILE . 88.2 t80 -60.81 -38.49 85.59 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.654 179.532 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 52.9 t -59.02 -44.65 91.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.247 -178.492 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 71.7 mt -54.69 -37.34 39.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.247 -179.787 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.33 -37.67 81.36 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.577 -179.867 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 0.412 HD11 ' CE2' ' A' ' 92' ' ' PHE . 38.4 mm -61.94 -43.95 98.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 120.91 0.386 . . . . 0.0 110.031 -179.751 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 81.6 tt0 -65.04 -41.83 94.87 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 120.683 -0.407 . . . . 0.0 110.707 179.489 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 40.9 tp10 -59.77 -46.46 89.11 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.924 0.392 . . . . 0.0 110.563 -178.908 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 80.2 mm-40 -60.96 -37.45 82.46 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.225 -179.743 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -64.82 -38.07 89.74 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.606 179.867 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 18.7 m -64.08 -47.7 79.05 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.062 -179.455 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -75.15 -18.94 60.11 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.3 -179.462 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 39.1 tp -90.48 -7.68 52.4 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-O 121.179 0.514 . . . . 0.0 110.218 -179.766 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 85.6 tttt -71.91 72.37 0.83 Allowed 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 120.527 -0.469 . . . . 0.0 110.825 179.762 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 79.2 tt0 -170.2 -61.02 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.581 179.652 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 59.5 p -69.76 -34.55 73.95 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.385 179.884 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 67.11 168.78 3.62 Favored Glycine 0 CA--C 1.523 0.579 0 N-CA-C 110.747 -0.941 . . . . 0.0 110.747 -179.942 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 24.4 t -172.16 -150.01 0.06 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.683 0.278 . . . . 0.0 110.436 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 39.9 p -163.43 -77.34 0.04 OUTLIER 'General case' 0 C--N 1.333 -0.12 0 CA-C-O 120.857 0.361 . . . . 0.0 110.318 179.844 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -65.59 -30.19 76.87 Favored Glycine 0 CA--C 1.524 0.617 0 N-CA-C 110.881 -0.888 . . . . 0.0 110.881 179.819 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 78.4 tt0 -60.31 -38.13 82.72 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.69 0.281 . . . . 0.0 110.498 -179.601 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 54.7 m-85 -60.6 -44.91 95.74 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.537 -0.301 . . . . 0.0 110.557 -179.829 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 70.0 m -50.78 -30.58 14.51 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.698 -179.52 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -62.13 -32.18 72.74 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.75 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 50.6 mmm -67.76 -40.64 84.06 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-O 121.058 0.456 . . . . 0.0 110.906 -179.744 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 55.8 m-85 -62.74 -30.85 71.74 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.183 -179.938 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -55.91 -37.99 69.65 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.994 0.426 . . . . 0.0 110.618 -179.612 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.512 HD22 ' N ' ' A' ' 118' ' ' LEU . 4.1 mm? -61.42 -40.36 94.14 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.819 -0.628 . . . . 0.0 109.682 -179.178 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 119' ' ' MET . . . . . 0.408 ' C ' ' SD ' ' A' ' 119' ' ' MET . 0.0 OUTLIER -60.46 -53.21 60.28 Favored 'General case' 0 C--N 1.319 -0.727 0 C-N-CA 119.745 -0.782 . . . . 0.0 109.906 -179.632 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 20.1 m-85 -61.52 -46.36 90.3 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.667 -179.717 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 9.7 tm-20 -58.0 -44.87 87.48 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.185 -179.062 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 86.9 t -75.95 -21.47 15.67 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.33 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.078 179.804 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 32.2 t -71.43 -26.85 62.92 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 120.467 -0.493 . . . . 0.0 111.288 179.775 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 124' ' ' LYS . . . . . 0.428 ' N ' ' HD2' ' A' ' 125' ' ' PRO . 2.4 mptm? -58.8 -59.29 14.19 Favored Pre-proline 0 CA--C 1.542 0.64 0 C-N-CA 120.911 -0.316 . . . . 0.0 110.738 -179.827 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 125' ' ' PRO . . . . . 0.428 ' HD2' ' N ' ' A' ' 124' ' ' LYS . 37.3 Cg_endo -61.86 -50.04 5.85 Favored 'Trans proline' 0 N--CA 1.494 1.511 0 C-N-CA 122.039 1.826 . . . . 0.0 111.493 179.183 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.583 ' HB3' HD12 ' A' ' 131' ' ' ILE . 8.1 mp -56.71 -43.13 80.28 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.113 -179.16 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 11.9 tm0? -64.15 -49.98 70.01 Favored 'General case' 0 C--N 1.316 -0.849 0 C-N-CA 119.975 -0.69 . . . . 0.0 109.819 179.571 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -56.29 -19.38 14.02 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.188 -179.869 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 1.7 tt -93.72 -65.65 0.98 Allowed 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.742 179.886 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -151.8 -136.85 2.51 Favored Glycine 0 N--CA 1.462 0.374 0 N-CA-C 110.944 -0.862 . . . . 0.0 110.944 -178.955 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 131' ' ' ILE . . . . . 0.65 HG22 ' N ' ' A' ' 132' ' ' GLN . 81.2 mt 52.01 -114.58 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.333 -0.126 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 -178.977 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 132' ' ' GLN . . . . . 0.65 ' N ' HG22 ' A' ' 131' ' ' ILE . 57.6 tp60 97.15 55.4 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.803 0 O-C-N 124.138 0.899 . . . . 0.0 110.705 179.137 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 25.1 tt0 -170.42 -21.38 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 120.339 -0.544 . . . . 0.0 111.038 179.786 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 134' ' ' MET . . . . . 0.585 ' HG3' HG21 ' A' ' 131' ' ' ILE . 0.3 OUTLIER -52.26 -53.21 46.75 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.191 0.52 . . . . 0.0 110.618 -178.766 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 24.5 m -61.47 -28.54 69.36 Favored 'General case' 0 C--N 1.314 -0.945 0 C-N-CA 120.655 -0.418 . . . . 0.0 110.526 -179.494 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 30.3 ttpt -79.76 -57.05 3.85 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 116.14 -0.482 . . . . 0.0 112.141 -178.505 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 137' ' ' THR . . . . . 0.503 HG23 ' N ' ' A' ' 138' ' ' VAL . 14.1 t -59.71 -43.35 94.15 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.291 -178.298 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 138' ' ' VAL . . . . . 0.503 ' N ' HG23 ' A' ' 137' ' ' THR . 70.3 t -63.78 -44.77 98.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.425 -179.753 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 77.9 p -62.53 -38.25 89.24 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.845 0.355 . . . . 0.0 110.69 -179.593 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 93.8 m-20 -70.78 -30.58 67.1 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.584 179.857 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -65.11 -26.3 68.15 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.991 -179.873 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 142' ' ' ALA . . . . . 0.473 ' O ' ' O ' ' A' ' 143' ' ' GLU . . . -65.64 -29.01 69.52 Favored 'General case' 0 CA--C 1.51 -0.592 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.646 -179.3 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 143' ' ' GLU . . . . . 0.577 ' O ' ' N ' ' A' ' 145' ' ' ASN . 14.2 mm-40 -59.39 -123.49 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 -179.878 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 144' ' ' GLU . . . . . 0.406 ' C ' ' O ' ' A' ' 143' ' ' GLU . 72.0 mm-40 26.05 -81.09 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 123.574 0.749 . . . . 0.0 111.844 -179.981 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 145' ' ' ASN . . . . . 0.577 ' N ' ' O ' ' A' ' 143' ' ' GLU . 24.7 t30 -129.67 91.66 39.94 Favored Pre-proline 0 CA--C 1.55 0.964 0 CA-C-N 115.584 -0.735 . . . . 0.0 110.38 178.27 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 146' ' ' PRO . . . . . 0.487 ' O ' ' N ' ' A' ' 148' ' ' THR . 96.1 Cg_exo -43.67 106.73 0.08 OUTLIER 'Trans proline' 0 N--CA 1.501 1.939 0 C-N-CA 122.738 2.292 . . . . 0.0 112.052 -179.796 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 147' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_exo -48.48 81.78 0.02 OUTLIER 'Trans proline' 0 N--CA 1.5 1.87 0 C-N-CA 122.299 1.999 . . . . 0.0 112.661 179.848 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 148' ' ' THR . . . . . 0.487 ' N ' ' O ' ' A' ' 146' ' ' PRO . 1.2 m -97.12 14.42 25.84 Favored 'General case' 0 N--CA 1.47 0.556 0 O-C-N 122.14 -0.35 . . . . 0.0 110.112 179.994 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 149' ' ' THR . . . . . . . . . . . . . 28.4 p -140.82 167.91 21.05 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.518 -179.811 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -62.26 -44.15 97.21 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.503 -179.851 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -66.28 -37.0 84.4 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.756 -179.763 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . -55.53 -46.9 79.79 Favored Glycine 0 CA--C 1.523 0.59 0 N-CA-C 110.985 -0.846 . . . . 0.0 110.985 -179.26 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 153' ' ' VAL . . . . . . . . . . . . . 55.0 t -64.14 -24.69 36.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-O 120.828 0.347 . . . . 0.0 110.334 -179.62 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 154' ' ' LEU . . . . . 0.492 ' O ' HD23 ' A' ' 154' ' ' LEU . 1.1 tt -60.46 -40.44 91.21 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 109.558 -0.534 . . . . 0.0 109.558 -178.887 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -57.54 -46.07 84.31 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.062 179.535 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 156' ' ' ILE . . . . . 0.489 HG22 ' SD ' ' A' ' 160' ' ' MET . 16.0 mm -61.36 -43.63 97.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 -178.521 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -54.51 -50.02 68.83 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.38 179.202 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 158' ' ' LYS . . . . . 0.492 ' NZ ' ' OE2' ' A' ' 162' ' ' GLU . 65.1 tttm -62.72 -40.96 98.81 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.05 179.862 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 65.1 mmtt -65.92 -31.97 73.2 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.217 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 160' ' ' MET . . . . . 0.489 ' SD ' HG22 ' A' ' 156' ' ' ILE . 2.0 mtp -67.71 -47.89 68.1 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.228 0.537 . . . . 0.0 110.334 -179.5 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 62.4 ttp180 -66.44 -34.04 77.05 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.604 -179.716 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 162' ' ' GLU . . . . . 0.492 ' OE2' ' NZ ' ' A' ' 158' ' ' LYS . 48.5 mt-10 -69.95 -40.0 75.72 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.995 179.927 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 163' ' ' LYS . . . . . . . . . . . . . 17.0 tptp -67.35 -40.85 85.85 Favored 'General case' 0 C--N 1.325 -0.458 0 C-N-CA 120.553 -0.459 . . . . 0.0 111.135 -179.299 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 7.9 mt -69.15 -26.33 64.82 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.269 -179.628 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 50.7 tt0 -59.98 -45.3 93.17 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.728 -179.146 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 84.8 mtp180 -61.8 -29.46 70.17 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.35 0.595 . . . . 0.0 110.889 -179.723 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 167' ' ' VAL . . . . . . . . . . . . . 22.3 t -67.93 -46.85 81.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.491 -179.827 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 168' ' ' HIS . . . . . 0.463 ' O ' ' ND1' ' A' ' 168' ' ' HIS . 29.4 t-80 -79.23 -28.99 42.53 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.28 179.943 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 169' ' ' THR . . . . . . . . . . . . . 27.8 m -72.72 -48.52 38.04 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.781 0.324 . . . . 0.0 111.351 -179.562 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 56.0 mtpt -64.08 -43.39 95.57 Favored 'General case' 0 C--N 1.326 -0.436 0 C-N-CA 120.756 -0.377 . . . . 0.0 110.692 -179.52 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 171' ' ' ASN . . . . . . . . . . . . . 42.8 t-20 -65.79 -35.04 79.59 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.597 -179.866 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 172' ' ' TYR . . . . . . . . . . . . . 89.4 t80 -74.65 -45.06 47.2 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.734 -0.667 . . . . 0.0 110.639 179.699 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 16.8 t -66.82 -44.04 82.19 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.177 -179.381 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 12.6 p -60.92 -46.34 91.06 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.186 -179.648 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 33.8 tp -63.85 -31.98 73.34 Favored 'General case' 0 C--N 1.319 -0.741 0 C-N-CA 120.581 -0.448 . . . . 0.0 110.719 -179.227 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 2.7 tptm -65.04 -2.85 3.0 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.648 -178.729 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 177' ' ' LYS . . . . . . . . . . . . . 20.7 ptmt -61.66 -16.04 45.2 Favored 'General case' 0 C--N 1.318 -0.769 0 C-N-CA 120.651 -0.419 . . . . 0.0 111.183 -178.962 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 178' ' ' LYS . . . . . . . . . . . . . 74.5 mmtt -68.98 -47.1 66.42 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.893 -179.324 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 56.0 mp0 -72.79 -42.64 63.71 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.048 0.451 . . . . 0.0 110.197 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 180' ' ' ASN . . . . . . . . . . . . . 91.7 m-20 -65.67 -31.31 72.26 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.26 179.991 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 2.7 p 74.55 -49.07 0.66 Allowed 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.209 -179.682 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 182' ' ' THR . . . . . . . . . . . . . 81.9 p -75.49 176.19 7.79 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.018 179.496 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 183' ' ' PHE . . . . . 0.503 ' CD2' ' N ' ' A' ' 184' ' ' THR . 32.9 p90 -135.72 -50.99 0.73 Allowed 'General case' 0 N--CA 1.469 0.511 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.57 -179.843 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 184' ' ' THR . . . . . 0.503 ' N ' ' CD2' ' A' ' 183' ' ' PHE . 7.4 t -88.12 160.34 17.82 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-N 116.387 -0.369 . . . . 0.0 110.23 179.68 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 185' ' ' ASP . . . . . . . . . . . . . 11.6 t70 64.22 33.78 11.42 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.844 179.929 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 186' ' ' GLU . . . . . . . . . . . . . 2.2 pp20? -168.48 141.6 3.02 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.402 -179.91 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 22.3 pttp -171.69 149.52 2.58 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.261 179.699 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 188' ' ' CYS . . . . . 0.401 ' O ' ' C ' ' A' ' 189' ' ' LYS . 23.8 m -75.94 -138.66 0.02 OUTLIER 'General case' 0 C--O 1.233 0.203 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 179.43 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 189' ' ' LYS . . . . . 0.401 ' C ' ' O ' ' A' ' 188' ' ' CYS . 20.7 pttm 30.39 55.63 0.18 Allowed 'General case' 0 N--CA 1.475 0.81 0 O-C-N 123.566 0.541 . . . . 0.0 111.224 179.323 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 190' ' ' ASN . . . . . . . . . . . . . 59.1 t30 -153.88 81.59 1.15 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.405 -178.723 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 191' ' ' ASN . . . . . . . . . . . . . 23.6 p30 . . . . . 0 C--O 1.219 -0.503 0 CA-C-O 117.978 -1.01 . . . . 0.0 111.552 179.769 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 16.6 m . . . . . 0 N--CA 1.49 1.526 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -170.91 -28.13 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.636 -179.964 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 43.09 74.05 0.21 Allowed Glycine 0 CA--C 1.524 0.642 0 N-CA-C 111.063 -0.815 . . . . 0.0 111.063 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 5.7 tp -78.34 -50.85 11.03 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.952 0.406 . . . . 0.0 110.829 -179.791 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.515 ' O ' ' C ' ' A' ' 29' ' ' GLY . 72.2 p 44.15 70.97 0.28 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.709 -179.698 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' GLY . . . . . 0.61 ' O ' ' HB3' ' A' ' 30' ' ' ALA . . . -29.36 146.21 0.01 OUTLIER Glycine 0 CA--C 1.525 0.677 0 N-CA-C 110.988 -0.845 . . . . 0.0 110.988 179.827 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.61 ' HB3' ' O ' ' A' ' 29' ' ' GLY . . . 76.42 -69.36 0.16 Allowed 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.953 0.406 . . . . 0.0 110.554 -179.526 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.419 HG23 HH21 ' A' ' 34' ' ' ARG . 86.0 m -50.47 -39.73 48.95 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.473 -179.953 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 6.2 tmtt? -49.77 -29.35 7.61 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.673 -179.766 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 96.4 mt -52.86 -52.96 23.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.697 -179.19 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.419 HH21 HG23 ' A' ' 31' ' ' THR . 87.9 mtm180 -62.19 -41.31 98.23 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.458 -179.472 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.55 ' N ' HD22 ' A' ' 35' ' ' LEU . 4.2 mm? -64.17 -52.01 61.04 Favored 'General case' 0 N--CA 1.455 -0.22 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.037 -179.705 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 83.7 tt0 -65.27 -46.17 81.55 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.598 -179.401 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 44.7 ttm180 -64.59 -45.43 87.03 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.794 -179.148 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 30.2 t -72.14 -37.11 69.51 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.916 -178.725 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -71.51 -49.69 38.6 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.231 -178.383 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 64.3 mmtt -57.77 -30.64 65.79 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.683 -178.667 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 86.1 m-20 -68.36 -24.43 64.79 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.87 -178.268 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 63.0 mt -63.03 -56.74 15.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.281 -178.278 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 55.8 p -75.78 -38.36 58.34 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.143 -178.455 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 96.3 m-20 -61.5 -38.53 87.69 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.978 -176.99 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 14.3 tm-20 -72.22 -58.5 3.36 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.114 -0.493 . . . . 0.0 111.248 -178.057 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 7.4 pt -61.22 -28.53 44.0 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.188 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.782 -178.539 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -66.51 -38.58 87.52 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.814 179.288 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' ALA . . . . . 0.414 ' O ' ' OD2' ' A' ' 52' ' ' ASP . . . -55.92 -25.1 41.55 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.485 -179.904 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 66.9 mt -58.39 -43.02 85.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.678 -179.631 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -60.6 -34.21 73.89 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.57 -179.8 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -61.72 -51.75 67.11 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.964 -179.036 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' ASP . . . . . 0.414 ' OD2' ' O ' ' A' ' 48' ' ' ALA . 0.4 OUTLIER -70.21 -19.8 63.14 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.753 -179.189 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -72.92 -32.92 65.65 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.734 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -58.06 -25.79 61.7 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.63 -179.786 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 79.3 mt -55.67 -43.76 76.63 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.366 -179.346 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 72.7 mmtt -107.11 144.09 34.32 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.935 0.398 . . . . 0.0 110.346 178.986 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -73.86 73.17 1.26 Allowed Glycine 0 CA--C 1.521 0.447 0 N-CA-C 110.946 -0.862 . . . . 0.0 110.946 -179.573 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 39.1 t -116.16 126.84 73.82 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-O 120.852 0.358 . . . . 0.0 110.498 -179.889 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 86.9 m-20 -65.16 103.16 0.73 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.482 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 40.3 t80 -59.92 -49.32 78.15 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.618 -179.362 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' ASP . . . . . 0.538 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 46.1 p-10 -57.74 -161.0 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.353 179.705 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.538 ' HB3' ' O ' ' A' ' 61' ' ' ASP . . . 70.93 -45.85 0.62 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.36 -179.588 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 63' ' ' PHE . . . . . 0.435 ' CG ' HG21 ' A' ' 78' ' ' ILE . 68.7 t80 -73.18 134.8 44.5 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.434 179.819 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.409 ' CE ' ' NE2' ' A' ' 132' ' ' GLN . 61.3 tttp -151.46 -70.71 0.17 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.648 -179.554 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 48.4 t0 -161.69 -67.72 0.06 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.62 -179.809 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -60.1 90.4 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.353 179.574 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 1.2 ttmp? -148.51 158.89 44.42 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.622 -179.495 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 22.4 m -57.3 -36.9 71.66 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.571 -179.994 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 74.64 -142.15 29.56 Favored Glycine 0 CA--C 1.525 0.682 0 N-CA-C 110.925 -0.87 . . . . 0.0 110.925 -179.971 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 50.6 m 55.35 165.3 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.826 0.346 . . . . 0.0 110.561 179.796 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -65.38 -30.45 77.65 Favored Glycine 0 CA--C 1.524 0.599 0 N-CA-C 110.954 -0.858 . . . . 0.0 110.954 179.969 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.486 HG22 ' N ' ' A' ' 73' ' ' SER . 7.6 p -73.08 157.96 6.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-O 120.729 0.3 . . . . 0.0 110.558 -179.968 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' SER . . . . . 0.61 ' O ' ' O ' ' A' ' 74' ' ' GLU . 10.4 p 58.96 148.85 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.364 -179.349 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 74' ' ' GLU . . . . . 0.61 ' O ' ' O ' ' A' ' 73' ' ' SER . 22.1 mp0 39.81 105.41 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.342 -179.118 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 75' ' ' ASN . . . . . 0.496 ' C ' ' O ' ' A' ' 74' ' ' GLU . 33.6 m120 -31.01 140.5 0.15 Allowed Pre-proline 0 C--N 1.328 -0.341 0 CA-C-N 116.506 -0.315 . . . . 0.0 110.91 -179.68 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -71.08 4.4 2.79 Favored 'Trans proline' 0 C--N 1.301 -1.925 0 C-N-CA 122.794 2.329 . . . . 0.0 112.353 -178.968 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 52.5 t80 -63.74 -51.63 64.06 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.774 -179.261 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' ILE . . . . . 0.435 HG21 ' CG ' ' A' ' 63' ' ' PHE . 76.6 mt -70.08 -48.08 64.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.9 -179.158 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.546 ' N ' HD12 ' A' ' 79' ' ' LEU . 10.0 mp -52.23 -51.42 58.4 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.499 -179.073 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.416 ' O ' ' NH1' ' A' ' 84' ' ' ARG . 96.1 mt-10 -65.52 -31.83 73.11 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.438 -179.982 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -65.25 -38.14 89.4 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.634 -179.684 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -54.58 -24.93 23.23 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.425 -179.618 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 44.2 t -72.5 -43.85 62.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.978 -179.446 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' ARG . . . . . 0.416 ' NH1' ' O ' ' A' ' 80' ' ' GLU . 12.0 mpt_? -61.8 -29.21 70.0 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.6 -179.101 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -64.08 -44.93 90.86 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.917 -178.725 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 54.9 p -71.18 -20.18 62.31 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.769 -179.216 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 26.0 m -64.33 -53.89 41.6 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.218 -178.642 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 41.3 t -69.27 -46.5 77.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.094 -178.311 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -57.35 -37.44 72.59 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.744 -178.094 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 17.3 mm-40 -55.22 -42.24 73.1 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.701 -179.391 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 14.6 mptt -64.75 -23.37 67.23 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.639 -178.406 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 53.8 t80 -74.1 -59.57 2.66 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.316 -177.924 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 4.5 m -49.92 -38.3 13.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.674 -177.64 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 81.1 mt -58.91 -39.42 77.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.136 179.475 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -51.55 -40.77 60.33 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.569 -179.521 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 0.563 ' N ' HD12 ' A' ' 96' ' ' ILE . 1.7 mp -61.99 -41.64 91.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.597 -179.809 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 75.6 mt-10 -60.54 -49.43 77.59 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.962 -178.718 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 39.7 tp10 -68.3 -42.51 79.35 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.852 -178.878 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 91.1 mt-10 -69.48 -32.27 71.05 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.762 -178.911 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -57.38 -30.95 65.31 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.566 -179.588 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 21.1 m -63.65 -52.84 59.01 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.738 -179.253 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -66.76 -28.75 68.65 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.351 179.754 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 1.195 ' O ' ' O ' ' A' ' 104' ' ' LYS . 0.1 OUTLIER -71.69 -30.8 66.07 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.836 179.994 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 1.195 ' O ' ' O ' ' A' ' 103' ' ' LEU . 22.2 pttp -5.58 -148.85 0.0 OUTLIER 'General case' 0 C--O 1.235 0.296 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.854 -179.258 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 70.2 mm-40 -71.77 82.35 0.88 Allowed 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 120.904 0.383 . . . . 0.0 110.682 -179.614 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 1.4 t -164.27 8.97 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.407 178.239 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 107' ' ' GLY . . . . . 0.597 ' O ' ' OG ' ' A' ' 108' ' ' SER . . . -120.62 -56.02 0.24 Allowed Glycine 0 CA--C 1.522 0.511 0 N-CA-C 110.853 -0.899 . . . . 0.0 110.853 179.754 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 108' ' ' SER . . . . . 0.597 ' OG ' ' O ' ' A' ' 107' ' ' GLY . 3.4 m 156.32 -103.9 0.0 OUTLIER 'General case' 0 N--CA 1.454 -0.263 0 CA-C-O 120.875 0.369 . . . . 0.0 110.442 -179.959 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 18.9 p -172.19 -56.4 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.386 -179.339 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -75.52 -28.67 61.05 Favored Glycine 0 CA--C 1.525 0.682 0 N-CA-C 111.008 -0.837 . . . . 0.0 111.008 178.896 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 111' ' ' GLU . . . . . 0.459 ' OE1' ' N ' ' A' ' 111' ' ' GLU . 13.1 mp0 -56.78 -27.53 59.84 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.76 0.314 . . . . 0.0 110.536 -179.354 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 30.6 m-85 -53.28 -26.03 16.9 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.456 179.618 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 66.5 m -50.9 -34.48 28.54 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.538 179.934 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -57.41 -31.52 65.93 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.394 179.175 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 115' ' ' MET . . . . . 0.434 ' SD ' HG23 ' A' ' 96' ' ' ILE . 45.7 ttm -77.99 -40.45 39.1 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.936 179.448 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 30.4 t80 -64.06 -31.69 72.97 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.431 179.606 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 94.2 m-20 -59.92 -35.75 75.56 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.606 -179.409 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 81.5 mt -56.62 -38.61 72.33 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.326 179.743 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 119' ' ' MET . . . . . 0.478 ' C ' ' SD ' ' A' ' 119' ' ' MET . 0.0 OUTLIER -56.4 -50.13 72.48 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.476 179.612 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 68.6 t80 -63.84 -44.3 93.58 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.959 0.409 . . . . 0.0 110.693 -179.735 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 121' ' ' GLU . . . . . 0.405 ' O ' ' CD ' ' A' ' 125' ' ' PRO . 78.0 tt0 -53.98 -40.11 66.63 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.566 -179.706 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 95.1 t -83.42 -18.97 10.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.746 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 51.4 p -71.31 -30.29 66.06 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.809 -178.874 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 124' ' ' LYS . . . . . 0.534 ' CB ' ' HD3' ' A' ' 125' ' ' PRO . 5.6 mmtp -69.58 -55.2 9.63 Favored Pre-proline 0 C--N 1.33 -0.241 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.279 -177.509 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 125' ' ' PRO . . . . . 0.534 ' HD3' ' CB ' ' A' ' 124' ' ' LYS . 68.3 Cg_exo -50.66 -44.45 40.44 Favored 'Trans proline' 0 C--N 1.306 -1.707 0 C-N-CA 122.61 2.207 . . . . 0.0 111.887 179.06 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 75.4 mt -64.01 -21.2 66.4 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.575 -179.479 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -62.91 -49.47 74.67 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.863 -179.627 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 70.7 mmtt -62.11 -6.75 3.23 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.443 -179.718 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.503 HD23 ' O ' ' A' ' 129' ' ' LEU . 1.1 tt -108.2 -50.71 3.0 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.562 179.792 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 130' ' ' GLY . . . . . 0.593 ' O ' ' C ' ' A' ' 131' ' ' ILE . . . 170.83 -120.97 0.88 Allowed Glycine 0 CA--C 1.52 0.36 0 N-CA-C 110.935 -0.866 . . . . 0.0 110.935 -179.688 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 131' ' ' ILE . . . . . 0.593 ' C ' ' O ' ' A' ' 130' ' ' GLY . 81.1 mt 21.83 94.23 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 120.65 0.262 . . . . 0.0 110.712 179.976 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 132' ' ' GLN . . . . . 0.474 ' O ' ' HG2' ' A' ' 133' ' ' GLU . 22.5 tt0 -117.59 158.66 24.23 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.542 -179.642 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 133' ' ' GLU . . . . . 0.474 ' HG2' ' O ' ' A' ' 132' ' ' GLN . 0.6 OUTLIER 79.57 -12.17 1.1 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.539 179.173 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 26.4 ttm -58.5 -22.41 55.05 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.508 -179.997 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 34.9 m -67.79 -65.85 0.64 Allowed 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.689 179.559 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 136' ' ' LYS . . . . . 0.477 ' O ' ' N ' ' A' ' 140' ' ' ASP . 19.4 ttmm -51.4 -33.57 30.79 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.676 -0.491 . . . . 0.0 109.676 179.135 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 99.8 m -54.19 -66.05 0.46 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.654 -179.448 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 7.2 p -62.39 -33.38 58.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.624 -179.127 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 1.2 p -71.31 -31.93 68.02 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.613 -179.881 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 140' ' ' ASP . . . . . 0.477 ' N ' ' O ' ' A' ' 136' ' ' LYS . 49.9 t0 -68.89 -27.6 65.93 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.497 -179.816 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -69.36 -25.97 64.44 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.953 -178.84 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -64.6 -29.12 70.13 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.815 -178.513 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 80.9 mm-40 -67.19 -37.62 83.97 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.678 -179.455 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -65.56 -33.24 75.46 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.599 -179.728 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 145' ' ' ASN . . . . . . . . . . . . . 48.4 t30 -159.75 83.92 2.24 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.529 -179.358 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 146' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_exo -47.13 106.36 0.1 Allowed 'Trans proline' 0 C--N 1.305 -1.739 0 C-N-CA 122.875 2.384 . . . . 0.0 112.098 179.898 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 147' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_exo -48.72 110.57 0.36 Allowed 'Trans proline' 0 C--N 1.304 -1.815 0 C-N-CA 122.774 2.316 . . . . 0.0 112.252 -179.534 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 10.0 t -124.17 1.51 8.51 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.377 179.314 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 149' ' ' THR . . . . . 0.421 HG23 ' H ' ' A' ' 152' ' ' GLY . 5.1 t -162.12 -178.99 6.74 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.636 -179.843 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 150' ' ' ALA . . . . . 0.4 ' N ' ' OG1' ' A' ' 149' ' ' THR . . . -62.79 -34.27 76.93 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.583 -179.59 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 12.6 tt0 -66.21 -45.14 81.79 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.741 -179.707 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 152' ' ' GLY . . . . . 0.421 ' H ' HG23 ' A' ' 149' ' ' THR . . . -61.43 -44.75 97.63 Favored Glycine 0 CA--C 1.524 0.655 0 N-CA-C 110.869 -0.892 . . . . 0.0 110.869 -179.884 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 153' ' ' VAL . . . . . . . . . . . . . 99.4 t -65.77 -42.78 93.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-O 120.836 0.35 . . . . 0.0 110.468 -179.86 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 7.8 mt -51.46 -31.96 25.19 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.36 179.68 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 34.4 tp10 -64.68 -47.3 78.9 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.327 179.056 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 156' ' ' ILE . . . . . 0.57 HD12 ' N ' ' A' ' 156' ' ' ILE . 1.7 mp -64.12 -43.53 97.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.479 179.472 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -49.46 -46.89 48.51 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.358 -179.407 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 63.9 tttp -61.91 -41.91 98.46 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.092 178.89 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -65.42 -31.1 72.02 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.394 179.713 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 160' ' ' MET . . . . . . . . . . . . . 1.6 mtm -67.89 -51.49 47.39 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.869 179.689 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 76.1 ttt180 -67.77 -35.36 78.55 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.455 -179.939 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 81.1 tt0 -62.61 -48.7 78.24 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.89 -178.853 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 163' ' ' LYS . . . . . . . . . . . . . 41.1 tptt -65.42 -33.91 77.06 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.548 -179.43 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 14.2 mt -67.17 -30.45 70.42 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.915 -178.884 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 90.1 mt-30 -66.11 -35.17 79.8 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.741 -179.146 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 92.3 mtt-85 -64.73 -34.08 77.49 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.451 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 167' ' ' VAL . . . . . . . . . . . . . 11.1 t -68.39 -43.31 84.25 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.426 0 CA-C-O 120.893 0.378 . . . . 0.0 110.762 179.992 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 168' ' ' HIS . . . . . 0.402 ' ND1' ' O ' ' A' ' 168' ' ' HIS . 24.9 t-80 -80.01 -33.48 39.21 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.767 -179.546 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 169' ' ' THR . . . . . . . . . . . . . 91.5 m -70.15 -45.29 67.08 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.991 -178.542 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 58.9 mmtt -60.13 -44.27 95.03 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.612 -179.278 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 171' ' ' ASN . . . . . . . . . . . . . 48.6 t-20 -68.76 -33.05 73.25 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.992 0.425 . . . . 0.0 110.597 -179.703 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 172' ' ' TYR . . . . . 0.567 ' CE2' ' NZ ' ' A' ' 176' ' ' LYS . 53.7 t80 -62.93 -47.39 83.45 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.639 -179.442 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 68.7 m -73.75 -37.63 64.98 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.708 -179.332 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 89.5 m -62.03 -48.37 80.56 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.588 -179.315 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 12.3 tp -66.42 -34.32 77.67 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.548 -179.933 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 176' ' ' LYS . . . . . 0.567 ' NZ ' ' CE2' ' A' ' 172' ' ' TYR . 23.5 mmtp -78.01 -8.0 57.61 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.972 -179.266 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 177' ' ' LYS . . . . . . . . . . . . . 13.7 ptmt -62.5 -22.8 66.55 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.411 -179.696 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 178' ' ' LYS . . . . . . . . . . . . . 31.7 ttmt -70.85 -51.61 25.49 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.836 -179.328 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 94.8 mt-10 -70.71 -41.66 71.63 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.364 179.768 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 180' ' ' ASN . . . . . . . . . . . . . 97.9 m-20 -71.22 -42.18 69.24 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.748 179.554 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 181' ' ' SER . . . . . 0.456 ' O ' ' OG1' ' A' ' 182' ' ' THR . 67.2 p 44.91 -152.19 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.578 -179.9 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 182' ' ' THR . . . . . 0.456 ' OG1' ' O ' ' A' ' 181' ' ' SER . 73.2 p 52.11 176.52 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.664 179.425 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 183' ' ' PHE . . . . . . . . . . . . . 32.2 p90 -120.51 153.99 35.91 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.577 -179.712 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 43.9 p 43.31 34.04 0.67 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.739 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 185' ' ' ASP . . . . . . . . . . . . . 74.5 m-20 -142.8 21.4 1.97 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.623 -179.779 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 186' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -57.92 139.46 54.24 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.409 179.879 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -64.93 -47.1 78.92 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.618 -179.755 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 188' ' ' CYS . . . . . . . . . . . . . 20.6 p -77.48 39.94 0.28 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.53 -179.7 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 189' ' ' LYS . . . . . . . . . . . . . 37.3 ttmt -60.39 -41.09 93.1 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.369 179.951 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 190' ' ' ASN . . . . . . . . . . . . . 84.4 m-20 -69.97 140.06 52.93 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.423 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 191' ' ' ASN . . . . . 0.449 ' N ' ' OD1' ' A' ' 191' ' ' ASN . 13.3 p-10 . . . . . 0 C--O 1.22 -0.491 0 CA-C-O 118.0 -1.0 . . . . 0.0 110.624 -179.859 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 51.2 p . . . . . 0 N--CA 1.491 1.59 0 N-CA-C 109.349 -0.611 . . . . 0.0 109.349 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -161.12 67.89 0.31 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.531 179.941 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' GLY . . . . . 0.468 ' O ' ' N ' ' A' ' 28' ' ' THR . . . -168.79 -99.5 0.13 Allowed Glycine 0 CA--C 1.517 0.168 0 N-CA-C 110.862 -0.895 . . . . 0.0 110.862 179.983 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.631 ' O ' ' O ' ' A' ' 28' ' ' THR . 9.3 mt 35.41 31.77 0.01 OUTLIER 'General case' 0 C--O 1.22 -0.493 0 CA-C-N 116.358 0.079 . . . . 0.0 111.175 -179.526 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.631 ' O ' ' O ' ' A' ' 27' ' ' LEU . 21.7 p -45.95 -119.93 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.415 0 O-C-N 123.995 0.809 . . . . 0.0 110.781 -179.094 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' GLY . . . . . 0.508 ' N ' ' OG1' ' A' ' 28' ' ' THR . . . -65.85 166.73 35.53 Favored Glycine 0 CA--C 1.523 0.56 0 N-CA-C 111.046 -0.822 . . . . 0.0 111.046 179.774 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -57.49 -4.69 0.27 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.802 0.334 . . . . 0.0 110.492 179.626 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.477 ' H ' ' C ' ' A' ' 29' ' ' GLY . 98.0 m -61.53 -23.53 66.0 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.465 179.725 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 17.2 tptp -68.45 -47.21 67.75 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.245 0.545 . . . . 0.0 110.817 179.606 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.585 ' N ' HD12 ' A' ' 33' ' ' ILE . 1.7 mp -57.17 -45.49 84.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 N-CA-C 109.152 -0.684 . . . . 0.0 109.152 -179.33 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 44.8 ttm180 -69.79 -27.79 65.2 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.047 0.451 . . . . 0.0 109.968 -179.703 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 44.5 tp -68.44 -47.9 65.97 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.066 -179.605 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 22.1 pt-20 -76.83 -39.8 50.04 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.612 -179.731 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 79.5 ttt180 -62.94 -42.71 99.89 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.028 -0.533 . . . . 0.0 109.997 -179.15 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 78.0 p -63.84 -26.45 68.62 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.097 0.475 . . . . 0.0 110.256 -179.755 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -83.16 -32.22 26.73 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.067 0.461 . . . . 0.0 111.105 179.366 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -63.81 -35.18 79.77 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.015 -0.538 . . . . 0.0 111.0 -179.003 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' ASP . . . . . 0.496 ' OD1' ' N ' ' A' ' 42' ' ' ILE . 15.2 p30 -61.92 -23.62 66.46 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.669 -179.261 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.496 ' N ' ' OD1' ' A' ' 41' ' ' ASP . 75.3 mt -59.84 -49.74 82.73 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.633 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.676 -179.097 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 40.3 p -72.6 -36.73 68.17 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.047 0.451 . . . . 0.0 111.305 -178.76 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 66.4 t0 -63.0 -39.94 96.26 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.96 -178.232 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 68.2 mm-40 -71.16 -55.92 7.16 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 112.233 0.456 . . . . 0.0 112.233 -179.285 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 7.0 pt -62.0 -26.33 39.73 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.107 -178.788 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -65.47 -39.09 91.57 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.91 -0.587 . . . . 0.0 110.687 -179.836 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.16 -24.33 67.12 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-O 121.059 0.457 . . . . 0.0 110.687 -178.89 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 65.2 mt -65.94 -52.82 44.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.007 -0.542 . . . . 0.0 112.365 -178.249 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 38.5 pttt -59.33 -30.19 68.18 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.857 -178.554 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 49.6 mtpt -63.89 -43.98 94.38 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.33 -179.678 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -65.42 -43.47 90.44 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.559 -179.895 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -58.34 -30.45 66.74 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.754 -179.578 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -66.47 -35.61 80.69 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.006 -179.858 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 53.7 mt -61.99 -46.66 88.26 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.31 -178.945 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.503 ' O ' ' N ' ' A' ' 58' ' ' VAL . 55.4 pttt -177.13 -17.93 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.377 0 O-C-N 123.483 0.489 . . . . 0.0 110.811 179.999 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' GLY . . . . . 0.407 ' O ' ' O ' ' A' ' 58' ' ' VAL . . . -64.26 65.31 0.06 OUTLIER Glycine 0 CA--C 1.526 0.724 0 N-CA-C 110.921 -0.872 . . . . 0.0 110.921 -179.378 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.503 ' N ' ' O ' ' A' ' 56' ' ' LYS . 15.0 t 57.4 155.72 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 120.925 0.393 . . . . 0.0 110.844 179.812 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 83.5 m-20 -71.17 143.89 50.37 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.042 0.448 . . . . 0.0 110.316 179.565 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' PHE . . . . . 0.408 ' CD2' ' N ' ' A' ' 61' ' ' ASP . 20.5 t80 -85.35 -179.45 6.96 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.419 -179.425 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 61' ' ' ASP . . . . . 0.408 ' N ' ' CD2' ' A' ' 60' ' ' PHE . 66.4 t0 61.36 -118.0 0.7 Allowed 'General case' 0 C--N 1.33 -0.254 0 O-C-N 123.708 0.63 . . . . 0.0 110.246 179.805 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . 61.2 -121.51 0.82 Allowed 'General case' 0 N--CA 1.452 -0.355 0 CA-C-O 120.77 0.319 . . . . 0.0 110.922 179.866 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 1.7 m-85 58.15 91.18 0.04 OUTLIER 'General case' 0 CA--C 1.516 -0.358 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.159 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.442 ' CG ' ' H ' ' A' ' 65' ' ' ASP . 10.8 tptm -113.03 -149.01 0.44 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.933 0.397 . . . . 0.0 110.787 179.365 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.442 ' H ' ' CG ' ' A' ' 64' ' ' LYS . 75.3 m-20 -74.55 -39.36 62.34 Favored 'General case' 0 N--CA 1.456 -0.142 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.454 179.977 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 66' ' ' LYS . . . . . 0.465 ' H ' ' HD2' ' A' ' 66' ' ' LYS . 6.3 mptt -62.87 -45.65 91.55 Favored 'General case' 0 CA--C 1.514 -0.437 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.928 -179.432 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -77.0 116.68 17.88 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.401 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 1.5 t -174.61 2.35 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.547 179.859 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -69.45 -20.12 75.12 Favored Glycine 0 CA--C 1.524 0.646 0 N-CA-C 110.919 -0.873 . . . . 0.0 110.919 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' SER . . . . . 0.522 ' OG ' ' ND2' ' A' ' 171' ' ' ASN . 5.6 t 62.23 141.0 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.656 0.265 . . . . 0.0 110.534 -179.759 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 73.2 -77.23 0.86 Allowed Glycine 0 N--CA 1.46 0.245 0 N-CA-C 110.351 -1.1 . . . . 0.0 110.351 179.809 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 1.9 m -122.62 105.02 15.42 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.473 0 CA-C-O 121.278 0.561 . . . . 0.0 110.144 179.723 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 2.5 t -155.06 95.78 1.77 Allowed 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.465 178.972 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 69.96 -67.78 0.22 Allowed 'General case' 0 CA--C 1.513 -0.47 0 O-C-N 123.426 0.454 . . . . 0.0 110.896 179.085 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 17.1 m120 -115.58 94.01 38.78 Favored Pre-proline 0 CA--C 1.532 0.284 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.265 -179.57 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -73.52 -8.23 21.38 Favored 'Trans proline' 0 N--CA 1.489 1.236 0 C-N-CA 122.79 2.327 . . . . 0.0 112.003 -179.343 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 53.4 t80 -76.96 -50.94 12.06 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.04 0.448 . . . . 0.0 110.275 -179.92 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 16.8 tt -75.48 -27.58 19.26 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.144 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.307 -179.883 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 3.1 mp -74.0 -37.96 64.25 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.6 179.776 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 10.5 mm-40 -63.14 -25.19 68.24 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.377 -179.858 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -65.98 -45.21 82.47 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.747 -179.35 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 6.5 ttpm? -55.97 -25.75 45.22 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.627 -179.735 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 26.9 t -74.49 -46.17 43.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.724 179.685 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 91.2 mtm180 -67.25 -28.03 67.71 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.167 0.508 . . . . 0.0 110.377 -179.705 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -58.41 -41.37 84.78 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.012 -179.204 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 68.7 p -76.86 -24.1 52.65 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.716 -179.906 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 86.2 m -60.23 -51.92 67.51 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.805 -178.947 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 56.1 t -67.92 -43.34 85.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.693 -179.396 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -64.13 -31.8 73.13 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.854 -179.065 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -55.43 -41.81 73.31 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.004 -179.579 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -58.09 -34.04 69.75 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.595 -179.325 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.602 ' O ' ' HB3' ' A' ' 95' ' ' ALA . 46.0 t80 -71.29 -45.48 63.0 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.902 -179.91 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 57.3 t -53.18 -56.87 6.14 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.793 -177.627 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.402 HG21 HD13 ' A' ' 94' ' ' ILE . 23.3 pt -54.14 -30.71 20.68 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.661 -179.959 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.602 ' HB3' ' O ' ' A' ' 92' ' ' PHE . . . -52.56 -41.89 63.97 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.351 -179.641 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 0.54 ' N ' HD12 ' A' ' 96' ' ' ILE . 1.6 mp -63.87 -41.81 93.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 116.073 -0.512 . . . . 0.0 109.945 179.255 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 79.4 tt0 -61.18 -49.89 75.38 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.073 -178.452 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 80.9 mm-40 -68.04 -41.41 82.13 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.42 -179.988 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 48.5 tp10 -62.1 -43.07 99.64 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.284 -179.88 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -62.36 -35.66 79.84 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.877 0.37 . . . . 0.0 110.572 -179.545 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 99.3 m -59.3 -43.4 92.62 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.164 -179.698 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 60.1 mttp -55.69 -36.43 67.13 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.237 -0.438 . . . . 0.0 109.849 -179.459 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.536 HD22 ' N ' ' A' ' 103' ' ' LEU . 4.2 mm? -81.29 -92.39 0.06 Allowed 'General case' 0 CA--C 1.511 -0.556 0 N-CA-C 109.916 -0.402 . . . . 0.0 109.916 179.112 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.419 ' CB ' ' O ' ' A' ' 103' ' ' LEU . 26.6 ttmt 78.92 -38.58 0.21 Allowed 'General case' 0 C--N 1.334 -0.075 0 O-C-N 123.759 0.662 . . . . 0.0 110.784 179.906 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 105' ' ' GLU . . . . . 0.434 ' O ' ' C ' ' A' ' 106' ' ' THR . 97.5 mt-10 -64.0 150.96 44.12 Favored 'General case' 0 CA--C 1.514 -0.415 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 -179.982 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 106' ' ' THR . . . . . 0.44 ' H ' HG23 ' A' ' 106' ' ' THR . 26.1 p -32.81 -42.26 0.08 Allowed 'General case' 0 N--CA 1.471 0.605 0 O-C-N 123.346 0.404 . . . . 0.0 110.763 -179.789 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 70.06 -179.28 28.23 Favored Glycine 0 CA--C 1.521 0.421 0 N-CA-C 110.733 -0.947 . . . . 0.0 110.733 179.101 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 52.3 m -80.32 -1.82 42.66 Favored 'General case' 0 C--N 1.331 -0.229 0 O-C-N 122.832 -0.217 . . . . 0.0 110.479 179.966 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER 70.88 -49.5 0.67 Allowed 'General case' 0 N--CA 1.462 0.166 0 CA-C-O 120.924 0.392 . . . . 0.0 110.449 -179.714 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -66.97 -28.03 73.64 Favored Glycine 0 CA--C 1.523 0.559 0 N-CA-C 110.686 -0.966 . . . . 0.0 110.686 -179.9 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 82.0 tt0 -61.23 -43.29 99.12 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.794 0.33 . . . . 0.0 110.544 -179.312 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 70.2 m-85 -65.43 -40.15 92.98 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.608 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 59.8 p -57.12 -31.91 65.8 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.33 -179.509 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -63.9 -29.58 70.75 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.445 179.592 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 37.3 mtp -74.95 -51.93 12.48 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.485 -179.221 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 41.6 t80 -50.15 -35.88 27.85 Favored 'General case' 0 N--CA 1.463 0.194 0 N-CA-C 110.042 -0.355 . . . . 0.0 110.042 -179.427 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 97.2 m-20 -61.8 -41.89 98.32 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.184 -0.462 . . . . 0.0 109.841 179.352 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.512 ' O ' HD23 ' A' ' 118' ' ' LEU . 1.4 tt -59.66 -40.56 88.16 Favored 'General case' 0 C--O 1.222 -0.343 0 CA-C-O 121.369 0.604 . . . . 0.0 109.685 -179.761 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 119' ' ' MET . . . . . 0.444 ' C ' ' SD ' ' A' ' 119' ' ' MET . 0.1 OUTLIER -53.15 -45.96 68.63 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.187 0.518 . . . . 0.0 109.858 -179.456 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 50.5 t80 -63.43 -41.21 98.69 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.176 0.512 . . . . 0.0 110.652 -179.013 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 14.5 mm-40 -55.48 -48.48 74.48 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.289 -178.903 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 31.1 m -71.27 -16.93 19.58 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.524 0 O-C-N 123.429 0.456 . . . . 0.0 110.819 -179.491 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 9.4 m -72.34 -24.98 61.37 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-O 121.191 0.519 . . . . 0.0 110.748 179.593 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 124' ' ' LYS . . . . . 0.541 ' N ' ' HD2' ' A' ' 125' ' ' PRO . 2.5 mptp? -65.05 -57.8 14.56 Favored Pre-proline 0 C--N 1.323 -0.578 0 CA-C-N 116.194 -0.457 . . . . 0.0 112.113 -179.376 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 125' ' ' PRO . . . . . 0.541 ' HD2' ' N ' ' A' ' 124' ' ' LYS . 30.2 Cg_endo -60.32 -30.63 91.48 Favored 'Trans proline' 0 C--N 1.307 -1.644 0 C-N-CA 122.441 2.094 . . . . 0.0 112.453 -179.01 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 92.6 mt -70.69 -24.82 62.74 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.71 179.854 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 55.2 tt0 -65.21 -39.43 92.77 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.148 -179.99 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 17.0 tptm -50.27 -44.37 53.7 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 120.576 -0.449 . . . . 0.0 110.546 -178.249 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 18.5 mt -57.52 -110.37 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.824 178.727 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 130' ' ' GLY . . . . . 0.42 ' C ' ' NE2' ' A' ' 132' ' ' GLN . . . -147.85 17.25 1.41 Allowed Glycine 0 C--N 1.332 0.356 0 N-CA-C 110.876 -0.889 . . . . 0.0 110.876 -179.489 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 76.3 mt -111.71 115.22 49.26 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.393 0 CA-C-O 120.904 0.383 . . . . 0.0 110.247 179.816 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 132' ' ' GLN . . . . . 0.478 ' O ' ' HB2' ' A' ' 133' ' ' GLU . 8.1 mp0 -139.93 -178.71 5.56 Favored 'General case' 0 CA--C 1.508 -0.645 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.077 -179.701 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 133' ' ' GLU . . . . . 0.478 ' HB2' ' O ' ' A' ' 132' ' ' GLN . 75.0 mt-10 75.48 -21.91 0.29 Allowed 'General case' 0 CA--C 1.52 -0.195 0 O-C-N 123.895 0.747 . . . . 0.0 110.622 179.497 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 134' ' ' MET . . . . . 0.462 ' H ' ' C ' ' A' ' 132' ' ' GLN . 48.5 mtp -51.27 -23.25 3.34 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.165 179.662 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 34.7 p -63.0 -63.82 1.09 Allowed 'General case' 0 C--O 1.221 -0.411 0 CA-C-O 121.486 0.66 . . . . 0.0 109.251 179.625 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 136' ' ' LYS . . . . . 0.432 ' HG2' ' H ' ' A' ' 136' ' ' LYS . 59.0 mmtt -51.38 -38.3 52.63 Favored 'General case' 0 C--N 1.318 -0.791 0 O-C-N 121.661 -0.649 . . . . 0.0 109.827 179.549 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 46.1 m -54.84 -66.01 0.48 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.548 -179.547 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 14.8 p -63.33 -34.65 68.4 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.146 -178.902 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 5.8 p -73.22 -33.55 65.41 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.758 -178.967 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 140' ' ' ASP . . . . . 0.403 ' N ' ' O ' ' A' ' 136' ' ' LYS . 8.9 t70 -65.1 -30.73 71.7 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.427 -179.614 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -62.91 -27.22 69.22 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.778 -179.176 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -59.85 -28.91 67.91 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.67 -179.169 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 70.0 mm-40 -81.53 66.16 6.97 Favored 'General case' 0 CA--C 1.517 -0.291 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.543 -179.777 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER 175.78 -37.93 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.783 -179.981 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 145' ' ' ASN . . . . . . . . . . . . . 21.1 t-20 -143.62 73.83 17.04 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.138 -179.318 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 146' ' ' PRO . . . . . 0.629 ' C ' ' H ' ' A' ' 148' ' ' THR . 86.8 Cg_exo -38.7 106.47 0.05 OUTLIER 'Trans proline' 0 C--N 1.32 -0.956 0 C-N-CA 122.945 2.43 . . . . 0.0 111.8 179.89 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 147' ' ' PRO . . . . . 0.538 ' C ' ' H ' ' A' ' 149' ' ' THR . 49.6 Cg_exo -55.17 10.27 0.03 OUTLIER 'Trans proline' 0 C--N 1.309 -1.551 0 C-N-CA 122.665 2.243 . . . . 0.0 112.4 179.224 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 148' ' ' THR . . . . . 0.629 ' H ' ' C ' ' A' ' 146' ' ' PRO . 61.8 m -55.38 -2.65 0.05 OUTLIER 'General case' 0 N--CA 1.445 -0.713 0 CA-C-O 120.744 0.307 . . . . 0.0 110.714 179.303 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 149' ' ' THR . . . . . 0.538 ' H ' ' C ' ' A' ' 147' ' ' PRO . 62.5 p -124.28 162.55 23.51 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-O 121.012 0.434 . . . . 0.0 110.223 179.458 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -68.05 -47.53 68.11 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.716 -179.814 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 87.1 mt-30 -66.14 -30.27 70.73 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.621 -179.812 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . -59.98 -34.29 82.67 Favored Glycine 0 CA--C 1.523 0.553 0 N-CA-C 111.085 -0.806 . . . . 0.0 111.085 -179.287 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 153' ' ' VAL . . . . . . . . . . . . . 62.4 t -65.61 -41.68 91.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 120.783 0.325 . . . . 0.0 110.688 -179.798 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 78.9 mt -45.31 -37.58 4.94 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.598 -179.108 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -62.3 -58.82 6.31 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.136 178.989 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 24.0 mm -53.68 -42.63 51.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.735 -179.439 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -56.71 -47.58 79.63 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 123.562 0.539 . . . . 0.0 110.548 178.948 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 34.8 tptt -61.66 -36.61 81.32 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.376 -179.797 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -72.32 -30.19 64.53 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.476 -179.658 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 160' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -66.11 -50.95 62.25 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.266 179.742 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 61.6 ttp180 -65.0 -31.24 72.38 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.099 179.522 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 40.9 tp10 -64.34 -61.31 2.31 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.124 -178.77 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 163' ' ' LYS . . . . . . . . . . . . . 23.9 tptp -60.36 -34.36 73.75 Favored 'General case' 0 N--CA 1.447 -0.605 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.533 -179.981 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 38.3 tp -66.21 -37.84 86.52 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.249 -179.881 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 65.9 mm-40 -70.14 -28.37 65.31 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.909 -179.64 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 166' ' ' ARG . . . . . 0.644 HH21 ' HZ1' ' A' ' 170' ' ' LYS . 76.0 ttt180 -63.76 -34.13 77.21 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.399 -179.91 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 167' ' ' VAL . . . . . 0.53 ' O ' ' ND2' ' A' ' 171' ' ' ASN . 70.1 t -67.04 -43.69 88.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.321 -179.667 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 12.6 t60 -78.59 -31.57 47.24 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.816 -179.277 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 169' ' ' THR . . . . . . . . . . . . . 92.6 m -68.5 -47.03 68.07 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.849 -179.49 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 170' ' ' LYS . . . . . 0.644 ' HZ1' HH21 ' A' ' 166' ' ' ARG . 28.1 mmtp -60.74 -45.39 94.48 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.694 -179.539 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 171' ' ' ASN . . . . . 0.53 ' ND2' ' O ' ' A' ' 167' ' ' VAL . 2.7 m-80 -66.61 -36.82 83.53 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.51 179.58 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 172' ' ' TYR . . . . . . . . . . . . . 84.4 t80 -66.53 -41.6 88.51 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.67 -179.434 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 41.0 t -67.75 -39.64 84.2 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.685 -179.444 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 174' ' ' THR . . . . . 0.405 HG23 ' O ' ' A' ' 170' ' ' LYS . 31.4 p -66.01 -34.94 79.23 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.794 -179.62 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 6.3 mt -64.17 -38.45 91.11 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.032 179.497 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 66.3 mmtt -62.4 -5.76 2.74 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.527 179.979 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 177' ' ' LYS . . . . . . . . . . . . . 62.9 tttp -63.76 -42.16 97.86 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.823 179.548 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 178' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -66.2 -42.36 88.91 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.649 -179.827 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 67.9 mm-40 -56.83 -47.85 79.35 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.0 -178.973 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 180' ' ' ASN . . . . . 0.552 ' O ' ' N ' ' A' ' 182' ' ' THR . 86.2 m-20 -47.64 -62.85 1.25 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.175 179.367 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 44.8 t 49.99 -82.74 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.105 179.037 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 182' ' ' THR . . . . . 0.552 ' N ' ' O ' ' A' ' 180' ' ' ASN . 80.5 p -48.01 -58.76 4.02 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.151 -179.817 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 183' ' ' PHE . . . . . . . . . . . . . 87.9 t80 -174.2 -81.62 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.967 0.413 . . . . 0.0 110.491 179.794 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 184' ' ' THR . . . . . 0.41 HG22 ' H ' ' A' ' 185' ' ' ASP . 0.2 OUTLIER 53.16 -173.69 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.767 -179.595 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 185' ' ' ASP . . . . . 0.41 ' H ' HG22 ' A' ' 184' ' ' THR . 67.5 t0 -84.73 111.92 20.02 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.645 179.659 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 186' ' ' GLU . . . . . . . . . . . . . 94.2 mt-10 -65.69 -45.59 82.24 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.533 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -70.42 132.09 45.08 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.373 -179.8 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 188' ' ' CYS . . . . . . . . . . . . . 5.0 m -79.58 -25.08 41.64 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.351 -179.939 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 189' ' ' LYS . . . . . 0.467 ' O ' ' N ' ' A' ' 191' ' ' ASN . 99.0 mttt 55.92 65.52 1.43 Allowed 'General case' 0 C--N 1.327 -0.38 0 O-C-N 123.457 0.473 . . . . 0.0 110.494 -179.719 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 190' ' ' ASN . . . . . . . . . . . . . 24.2 t-20 -44.77 92.54 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.749 -179.956 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 191' ' ' ASN . . . . . 0.467 ' N ' ' O ' ' A' ' 189' ' ' LYS . 89.3 m-20 . . . . . 0 C--O 1.219 -0.54 0 CA-C-O 118.053 -0.975 . . . . 0.0 110.695 -179.471 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 33.1 t . . . . . 0 N--CA 1.49 1.531 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -171.32 -58.38 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.446 -179.957 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -48.12 -79.63 0.07 OUTLIER Glycine 0 CA--C 1.527 0.812 0 N-CA-C 111.241 -0.744 . . . . 0.0 111.241 -179.955 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.528 ' N ' HD12 ' A' ' 27' ' ' LEU . 8.2 mp 47.86 -162.25 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.272 0 CA-C-O 120.72 0.295 . . . . 0.0 110.259 179.444 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.548 HG23 ' N ' ' A' ' 29' ' ' GLY . 6.8 t -169.53 -129.47 0.01 OUTLIER 'General case' 0 N--CA 1.445 -0.679 0 CA-C-N 116.287 -0.415 . . . . 0.0 109.976 -179.775 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' GLY . . . . . 0.548 ' N ' HG23 ' A' ' 28' ' ' THR . . . -108.92 -39.5 1.7 Allowed Glycine 0 N--CA 1.467 0.715 0 N-CA-C 111.08 -0.808 . . . . 0.0 111.08 179.71 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -169.23 -13.24 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.892 0.377 . . . . 0.0 110.648 -179.732 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.535 ' HB ' HG21 ' A' ' 28' ' ' THR . 24.8 m -64.14 -31.18 72.27 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.1 179.568 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.517 ' H ' ' CG2' ' A' ' 28' ' ' THR . 55.7 tptt -63.36 -50.19 70.91 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 120.315 -0.554 . . . . 0.0 110.646 -179.478 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 71.4 mt -63.16 -27.95 44.12 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.003 -178.921 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 41.4 ttm180 -71.41 -39.46 71.11 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.889 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 64.9 mt -68.93 -37.71 79.07 Favored 'General case' 0 CA--C 1.514 -0.415 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.73 -179.583 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 47.0 tp10 -73.21 -43.37 61.41 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.496 -179.741 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 43.7 ttm180 -63.4 -43.75 96.64 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.588 -179.324 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 37.9 m -69.0 -29.68 67.92 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.273 -179.961 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -75.05 -36.27 61.84 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.902 179.855 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -65.42 -31.42 72.51 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.832 -179.556 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 10.9 m-20 -66.93 -24.67 66.11 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.967 -179.635 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 98.3 mt -64.37 -48.42 85.37 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.311 0 C-N-CA 120.678 -0.409 . . . . 0.0 111.088 -179.19 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 77.2 p -73.23 -38.66 65.97 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.102 -178.712 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 65.6 t0 -64.0 -37.89 89.09 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.663 -179.364 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 9.9 tm-20 -67.36 -49.53 63.59 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.922 0.391 . . . . 0.0 111.434 -179.352 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 8.4 pt -72.18 -26.71 25.3 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.732 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.46 -179.614 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -62.33 -42.31 99.28 Favored 'General case' 0 C--N 1.322 -0.609 0 C-N-CA 120.729 -0.389 . . . . 0.0 110.525 179.337 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -53.22 -27.68 23.15 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.215 -178.918 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 66.2 mt -63.11 -45.76 97.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.077 179.62 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 23.3 mmtp -54.57 -41.31 69.7 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.153 -179.17 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 28.3 mmtp -65.51 -43.73 89.18 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.588 179.624 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 47.3 t0 -62.06 -43.86 97.92 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.386 -179.731 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.424 ' O ' ' O ' ' A' ' 56' ' ' LYS . . . -58.99 -30.73 68.19 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.909 -179.809 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -56.09 -37.45 69.38 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.054 -179.392 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.513 HD12 ' N ' ' A' ' 55' ' ' LEU . 10.0 mp -58.75 -42.93 90.01 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.131 -178.487 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.424 ' O ' ' O ' ' A' ' 53' ' ' ALA . 51.5 mtpt -99.84 139.91 34.81 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.906 0.384 . . . . 0.0 110.42 -179.902 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -77.98 68.93 2.76 Favored Glycine 0 CA--C 1.52 0.378 0 N-CA-C 110.695 -0.962 . . . . 0.0 110.695 -179.857 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 40.7 t -104.3 132.77 50.1 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.476 0 CA-C-O 120.805 0.336 . . . . 0.0 110.192 -179.935 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 91.5 m-20 -69.29 78.19 0.37 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.293 -179.645 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 36.9 t80 -63.18 -41.99 99.29 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.026 -0.533 . . . . 0.0 110.589 -179.666 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 40.0 p-10 -60.11 -6.43 1.4 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.295 -179.364 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.495 ' O ' ' CG ' ' A' ' 63' ' ' PHE . . . -64.23 128.4 35.64 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.233 179.882 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 63' ' ' PHE . . . . . 0.495 ' CG ' ' O ' ' A' ' 62' ' ' ALA . 44.8 m-85 -163.91 102.8 0.89 Allowed 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.515 -179.956 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.413 ' O ' ' N ' ' A' ' 66' ' ' LYS . 68.9 mttm -84.06 138.63 32.97 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 109.727 -0.471 . . . . 0.0 109.727 179.14 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 55.8 t0 -45.67 -19.54 0.06 Allowed 'General case' 0 N--CA 1.465 0.316 0 CA-C-O 121.086 0.47 . . . . 0.0 110.867 -179.859 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' LYS . . . . . 0.413 ' N ' ' O ' ' A' ' 64' ' ' LYS . 58.7 pttt -140.61 140.7 35.13 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.196 -179.921 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 70.7 mmtt -114.91 105.96 13.6 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.372 -179.773 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 27.4 p -140.54 147.13 39.02 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.09 179.545 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 148.38 -109.38 0.45 Allowed Glycine 0 N--CA 1.464 0.52 0 N-CA-C 110.666 -0.974 . . . . 0.0 110.666 179.946 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 40.0 p -164.82 -149.67 0.13 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.674 0.273 . . . . 0.0 110.608 -179.877 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -56.7 -42.77 91.45 Favored Glycine 0 C--N 1.332 0.33 0 N-CA-C 110.494 -1.042 . . . . 0.0 110.494 -179.819 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.915 HG13 ' H ' ' A' ' 73' ' ' SER . 2.7 p -79.03 -101.18 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.223 -0.33 0 N-CA-C 110.093 -0.336 . . . . 0.0 110.093 179.627 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 73' ' ' SER . . . . . 0.915 ' H ' HG13 ' A' ' 72' ' ' VAL . 9.7 p 63.48 -65.97 0.11 Allowed 'General case' 0 N--CA 1.448 -0.556 0 O-C-N 123.893 0.745 . . . . 0.0 109.717 -179.172 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 74' ' ' GLU . . . . . 0.511 ' N ' ' OG ' ' A' ' 73' ' ' SER . 80.9 mm-40 -126.84 15.36 7.46 Favored 'General case' 0 CA--C 1.499 -1.013 0 CA-C-N 116.053 -0.522 . . . . 0.0 111.004 179.863 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 75' ' ' ASN . . . . . 0.452 ' OD1' ' N ' ' A' ' 75' ' ' ASN . 1.4 m-20 89.52 137.54 0.04 OUTLIER Pre-proline 0 CA--C 1.535 0.388 0 O-C-N 124.39 1.056 . . . . 0.0 110.664 179.583 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -70.19 6.07 1.6 Allowed 'Trans proline' 0 N--CA 1.494 1.53 0 C-N-CA 122.156 1.904 . . . . 0.0 112.156 -179.26 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 68.0 t80 -77.52 -58.99 2.97 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.948 0.404 . . . . 0.0 111.515 -179.946 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 19.6 tt -75.64 -27.98 19.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.768 -179.643 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 82.9 mt -73.54 -49.95 23.84 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.463 -178.855 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 99.2 mt-10 -64.45 -22.79 67.07 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.298 179.859 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -59.69 -28.44 67.3 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.867 0.365 . . . . 0.0 110.912 -179.862 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -69.44 -20.48 63.77 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.536 -179.921 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 50.3 t -73.66 -45.08 51.75 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-O 120.998 0.428 . . . . 0.0 110.805 179.621 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 84.3 mtp180 -66.95 -35.39 79.87 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.553 -179.799 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -66.15 -39.36 89.77 Favored 'General case' 0 CA--C 1.517 -0.324 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.58 -179.701 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 34.0 p -78.91 -14.5 59.19 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.716 -179.944 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 33.4 m -62.07 -54.5 40.46 Favored 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 120.417 -0.513 . . . . 0.0 111.456 -179.224 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.517 HG13 ' N ' ' A' ' 89' ' ' ALA . 13.2 p -79.76 -44.55 23.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-O 121.35 0.595 . . . . 0.0 111.491 179.008 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 89' ' ' ALA . . . . . 0.517 ' N ' HG13 ' A' ' 88' ' ' VAL . . . -53.58 -49.36 67.9 Favored 'General case' 0 CA--C 1.52 -0.208 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.324 -176.672 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.451 ' CG ' ' N ' ' A' ' 91' ' ' LYS . 16.0 pt-20 -58.74 -45.67 89.14 Favored 'General case' 0 C--N 1.315 -0.911 0 C-N-CA 120.793 -0.363 . . . . 0.0 110.807 -179.91 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 91' ' ' LYS . . . . . 0.451 ' N ' ' CG ' ' A' ' 90' ' ' GLU . 98.3 mttt -58.23 -36.51 73.28 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.064 -0.517 . . . . 0.0 109.856 -179.194 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 56.4 t80 -62.43 -41.6 98.84 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.834 179.612 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 81.0 t -58.27 -45.08 89.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.203 -179.142 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 65.4 mt -53.93 -42.12 52.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-O 120.802 0.334 . . . . 0.0 110.331 -179.818 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -52.47 -36.99 56.06 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.22 -179.679 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 34.9 mm -65.45 -43.54 94.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.301 -179.773 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -64.87 -49.24 71.3 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.752 -179.674 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 80.8 tt0 -63.54 -38.98 93.19 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.011 0.434 . . . . 0.0 110.413 -179.364 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -71.19 -28.98 64.62 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.296 -179.954 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -65.84 -52.38 50.93 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.657 -179.181 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 101' ' ' THR . . . . . 0.405 ' H ' HG22 ' A' ' 101' ' ' THR . 1.7 t -58.27 -35.41 71.74 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.812 -179.535 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 47.3 mttp -63.77 -29.06 70.31 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.666 179.806 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 67.1 mt -92.37 2.04 56.88 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.732 0.301 . . . . 0.0 110.691 -179.476 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.4 ' HE3' HE21 ' A' ' 151' ' ' GLN . 86.6 tttt -68.15 73.83 0.21 Allowed 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.045 179.713 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 67.5 tt0 -172.31 48.16 0.02 OUTLIER 'General case' 0 CA--C 1.532 0.253 0 CA-C-O 121.29 0.567 . . . . 0.0 109.697 179.526 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 16.6 p 50.54 20.6 0.73 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.927 0.394 . . . . 0.0 110.973 -179.445 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -49.81 -36.74 26.81 Favored Glycine 0 CA--C 1.525 0.69 0 N-CA-C 110.973 -0.851 . . . . 0.0 110.973 -179.64 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 30.9 p -172.51 -166.82 0.41 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.799 0.333 . . . . 0.0 110.208 179.819 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 69.0 p -147.07 -57.88 0.27 Allowed 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.432 179.878 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -72.25 -28.31 68.35 Favored Glycine 0 CA--C 1.525 0.657 0 N-CA-C 111.341 -0.704 . . . . 0.0 111.341 179.666 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 79.9 tt0 -54.38 -34.29 60.92 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.71 0.291 . . . . 0.0 110.753 -179.129 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 61.4 m-85 -61.25 -39.04 88.84 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.607 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 40.0 t -58.84 -39.9 82.63 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.34 -179.793 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -63.7 -35.71 81.47 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.79 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 96.1 mtp -68.1 -40.35 82.62 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.131 -179.901 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 29.7 t80 -58.67 -28.13 65.45 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.313 179.87 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 66.3 t0 -57.54 -35.26 70.08 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.91 0.386 . . . . 0.0 110.48 -179.112 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 21.3 mt -58.5 -40.48 82.92 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.052 0.453 . . . . 0.0 110.034 -179.62 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.26 -53.6 52.75 Favored 'General case' 0 C--N 1.313 -0.996 0 C-N-CA 120.083 -0.647 . . . . 0.0 110.058 -179.335 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 52.8 t80 -59.36 -47.05 86.91 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.112 -179.316 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 51.3 tp10 -60.16 -35.38 75.19 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.089 -179.496 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 42.8 t -83.45 -19.85 9.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 N-CA-C 110.001 -0.37 . . . . 0.0 110.001 179.841 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 60.0 p -74.88 -27.2 60.15 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.931 0.396 . . . . 0.0 111.213 -179.612 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 124' ' ' LYS . . . . . 0.501 ' N ' ' HD2' ' A' ' 125' ' ' PRO . 8.0 mmtp -66.29 -57.25 13.28 Favored Pre-proline 0 C--N 1.323 -0.585 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.53 -179.541 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 125' ' ' PRO . . . . . 0.501 ' HD2' ' N ' ' A' ' 124' ' ' LYS . 23.8 Cg_endo -58.44 -31.66 94.63 Favored 'Trans proline' 0 C--N 1.314 -1.242 0 C-N-CA 122.24 1.96 . . . . 0.0 111.837 -179.358 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 81.2 mt -68.34 -32.53 72.71 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.676 -179.942 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -59.24 -47.05 86.78 Favored 'General case' 0 C--N 1.317 -0.82 0 C-N-CA 120.406 -0.517 . . . . 0.0 110.421 -179.29 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -69.67 -11.74 61.08 Favored 'General case' 0 CA--C 1.509 -0.619 0 CA-C-N 116.041 -0.527 . . . . 0.0 109.799 -179.614 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.422 HD22 ' HA ' ' A' ' 129' ' ' LEU . 0.2 OUTLIER -87.45 -55.93 3.58 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.168 0.509 . . . . 0.0 110.5 -179.741 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -175.67 -137.68 2.62 Favored Glycine 0 N--CA 1.451 -0.353 0 N-CA-C 110.675 -0.97 . . . . 0.0 110.675 -179.084 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 131' ' ' ILE . . . . . 0.687 HG22 ' H ' ' A' ' 132' ' ' GLN . 1.7 mt 54.26 -150.38 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 N-CA-C 109.944 -0.391 . . . . 0.0 109.944 179.309 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 132' ' ' GLN . . . . . 0.687 ' H ' HG22 ' A' ' 131' ' ' ILE . 4.6 tt0 179.99 138.15 0.12 Allowed 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.424 179.785 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 51.06 24.74 2.0 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.882 0.372 . . . . 0.0 110.848 178.479 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 10.4 tpt -58.95 -40.19 83.94 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.895 -0.593 . . . . 0.0 109.985 -179.605 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 21.7 m -74.19 -61.34 1.89 Allowed 'General case' 0 N--CA 1.467 0.413 0 CA-C-O 121.606 0.717 . . . . 0.0 110.284 -179.996 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 2.2 tppp? -49.31 -42.17 40.58 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-O 121.518 0.675 . . . . 0.0 110.451 -178.354 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 23.0 m -56.11 -68.49 0.2 Allowed 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.298 -0.864 . . . . 0.0 111.194 -179.241 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 14.6 p -55.92 -34.74 38.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 C-N-CA 120.723 -0.391 . . . . 0.0 110.681 -178.629 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 25.0 p -63.91 -36.89 85.44 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.622 -179.863 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 57.0 t0 -66.19 -28.06 68.48 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.594 179.811 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -67.23 -42.34 84.18 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-O 120.837 0.351 . . . . 0.0 111.1 -179.655 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -62.94 -30.13 71.33 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.396 -179.513 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 77.5 tt0 -68.31 -39.98 81.85 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.768 0.318 . . . . 0.0 110.71 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 78.7 tt0 -70.27 -41.32 73.58 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.904 -179.591 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 145' ' ' ASN . . . . . . . . . . . . . 30.0 m120 -135.27 76.57 56.54 Favored Pre-proline 0 N--CA 1.468 0.45 0 CA-C-N 116.607 -0.269 . . . . 0.0 110.556 -179.459 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 146' ' ' PRO . . . . . . . . . . . . . 78.5 Cg_exo -48.72 109.59 0.27 Allowed 'Trans proline' 0 N--CA 1.492 1.4 0 C-N-CA 122.601 2.201 . . . . 0.0 111.45 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 147' ' ' PRO . . . . . . . . . . . . . 85.1 Cg_exo -46.86 116.93 1.87 Allowed 'Trans proline' 0 N--CA 1.494 1.505 0 C-N-CA 121.813 1.675 . . . . 0.0 112.472 -179.759 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 9.1 m -130.7 -7.64 4.06 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.637 179.247 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 149' ' ' THR . . . . . 0.585 HG22 ' N ' ' A' ' 150' ' ' ALA . 85.3 m -159.51 167.34 28.84 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.849 0.357 . . . . 0.0 110.266 179.506 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 150' ' ' ALA . . . . . 0.585 ' N ' HG22 ' A' ' 149' ' ' THR . . . -51.91 -28.91 17.92 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.131 179.769 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 151' ' ' GLN . . . . . 0.4 HE21 ' HE3' ' A' ' 104' ' ' LYS . 84.7 mt-30 -73.07 -40.48 65.0 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.476 179.501 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . -59.53 -46.09 94.53 Favored Glycine 0 C--O 1.223 -0.555 0 N-CA-C 111.015 -0.834 . . . . 0.0 111.015 -179.593 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 153' ' ' VAL . . . . . . . . . . . . . 58.3 t -63.4 -42.25 95.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-O 120.831 0.348 . . . . 0.0 110.459 -179.807 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 154' ' ' LEU . . . . . 0.406 ' O ' HD23 ' A' ' 154' ' ' LEU . 0.8 OUTLIER -51.28 -36.17 40.92 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.254 -178.881 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 97.3 mt-10 -67.51 -33.79 75.8 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.082 -179.952 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 11.6 mm -77.82 -39.08 25.81 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.275 0 CA-C-O 121.028 0.442 . . . . 0.0 111.024 179.496 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -62.4 -40.69 97.31 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.641 -179.127 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -60.11 -45.87 91.51 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.045 0.45 . . . . 0.0 110.041 -179.802 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 61.8 tttm -66.65 -27.56 67.77 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.92 -179.716 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 160' ' ' MET . . . . . . . . . . . . . 22.6 mtp -74.17 -51.63 14.95 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.883 0.373 . . . . 0.0 110.451 -179.492 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 28.7 ttm180 -64.56 -37.47 87.67 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.671 -179.196 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 51.4 mm-40 -62.21 -42.73 99.56 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.854 -179.214 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 163' ' ' LYS . . . . . . . . . . . . . 86.5 tttt -65.44 -55.22 19.17 Favored 'General case' 0 C--N 1.323 -0.547 0 C-N-CA 120.316 -0.553 . . . . 0.0 110.653 -179.191 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 9.1 mp -53.34 -32.45 49.17 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.948 0.404 . . . . 0.0 110.152 -179.333 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 61.2 tp60 -62.09 -45.92 91.39 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.439 -179.412 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 69.2 ttp85 -64.3 -30.76 71.79 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.24 0.543 . . . . 0.0 111.041 -179.845 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 167' ' ' VAL . . . . . . . . . . . . . 56.0 t -69.56 -44.84 79.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 115.41 -0.814 . . . . 0.0 110.511 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 168' ' ' HIS . . . . . 0.423 ' O ' ' ND1' ' A' ' 168' ' ' HIS . 31.0 t-80 -77.7 -30.3 51.76 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.081 179.995 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 169' ' ' THR . . . . . 0.442 ' O ' ' SG ' ' A' ' 173' ' ' CYS . 91.3 m -69.26 -49.84 52.5 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.841 -179.913 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 28.5 mmtp -63.73 -45.05 91.65 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.828 0.346 . . . . 0.0 111.068 -179.263 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 171' ' ' ASN . . . . . . . . . . . . . 97.9 m-20 -65.21 -39.71 93.14 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.121 -179.753 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 172' ' ' TYR . . . . . . . . . . . . . 66.2 t80 -75.04 -34.42 61.86 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.799 179.83 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 173' ' ' CYS . . . . . 0.442 ' SG ' ' O ' ' A' ' 169' ' ' THR . 66.9 m -71.62 -23.05 61.64 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.482 179.95 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 19.3 m -62.25 -42.77 99.62 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.689 -179.815 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 175' ' ' LEU . . . . . 0.498 ' N ' HD12 ' A' ' 175' ' ' LEU . 10.1 mp -65.83 -34.61 78.55 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.575 -179.238 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -55.49 -30.79 61.27 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.322 -179.553 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 177' ' ' LYS . . . . . . . . . . . . . 85.8 tttt -61.08 -33.75 73.83 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.57 179.543 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 178' ' ' LYS . . . . . . . . . . . . . 55.7 mtpt -74.19 -47.96 32.17 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.085 -179.912 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 81.0 mm-40 -66.2 -45.11 81.91 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.301 -179.399 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 180' ' ' ASN . . . . . . . . . . . . . 88.2 m-20 -90.47 51.28 1.98 Allowed 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.345 -0.389 . . . . 0.0 109.998 179.634 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 90.9 p -61.09 -18.54 58.51 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.308 -179.613 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 182' ' ' THR . . . . . . . . . . . . . 36.2 m -61.6 -47.42 85.52 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.684 -179.829 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 183' ' ' PHE . . . . . . . . . . . . . 9.8 m-85 -98.66 123.7 43.02 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-O 121.049 0.452 . . . . 0.0 110.401 179.734 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 15.6 m -62.75 -42.01 99.47 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.461 -0.79 . . . . 0.0 109.966 179.578 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 185' ' ' ASP . . . . . . . . . . . . . 65.8 m-20 -96.62 -123.05 0.12 Allowed 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.477 -179.986 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 186' ' ' GLU . . . . . . . . . . . . . 81.1 mm-40 46.86 64.36 1.57 Allowed 'General case' 0 N--CA 1.456 -0.159 0 CA-C-O 120.891 0.377 . . . . 0.0 110.814 179.823 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 64.9 mttp -66.27 -76.15 0.08 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.271 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 188' ' ' CYS . . . . . . . . . . . . . 2.9 p -177.1 -62.24 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.209 179.881 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 189' ' ' LYS . . . . . . . . . . . . . 64.0 tttm -164.57 116.39 1.26 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.488 -179.732 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 190' ' ' ASN . . . . . . . . . . . . . 30.0 m120 -82.31 103.31 11.79 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.41 179.749 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 191' ' ' ASN . . . . . . . . . . . . . 98.2 m-20 . . . . . 0 C--O 1.22 -0.488 0 CA-C-O 118.026 -0.988 . . . . 0.0 110.312 -179.991 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 59.8 p . . . . . 0 N--CA 1.49 1.542 0 N-CA-C 109.315 -0.624 . . . . 0.0 109.315 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . 51.64 -177.4 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.523 -179.894 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 87.05 -10.05 70.02 Favored Glycine 0 CA--C 1.525 0.665 0 N-CA-C 110.921 -0.872 . . . . 0.0 110.921 -179.916 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.422 ' N ' HD12 ' A' ' 27' ' ' LEU . 9.9 mp -92.76 178.62 5.73 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 120.967 0.413 . . . . 0.0 110.135 179.935 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -176.26 -31.6 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.533 -179.77 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 142.19 -135.14 6.48 Favored Glycine 0 N--CA 1.466 0.673 0 N-CA-C 110.463 -1.055 . . . . 0.0 110.463 -179.284 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.06 -13.03 62.21 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.957 0.408 . . . . 0.0 110.315 -179.828 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 19.6 m -65.4 -35.38 80.76 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.585 179.653 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 64.0 tttp -62.72 -53.14 58.95 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.046 0.45 . . . . 0.0 110.685 -179.57 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 71.1 mt -63.1 -30.23 49.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.093 -179.842 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 40.5 ttm180 -67.23 -41.97 84.82 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.754 -179.85 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 46.8 mt -73.47 -36.37 65.82 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.504 -0.316 . . . . 0.0 111.132 -179.61 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 78.6 tt0 -63.18 -50.77 69.03 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.537 -179.112 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -69.93 -44.61 69.23 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.841 0.353 . . . . 0.0 110.628 -179.671 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 70.3 m -62.68 -35.81 80.87 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.614 -179.974 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -73.69 -39.65 64.23 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.351 -179.913 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 37.4 ttmt -61.44 -31.94 71.9 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.66 -179.051 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -68.18 -23.52 64.86 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.73 -179.437 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 63.5 mt -64.91 -50.38 75.36 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 C-N-CA 120.627 -0.429 . . . . 0.0 111.333 -179.143 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 71.9 p -75.24 -42.28 55.64 Favored 'General case' 0 C--O 1.223 -0.321 0 CA-C-O 121.043 0.449 . . . . 0.0 111.762 -178.662 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 82.2 m-20 -62.11 -34.34 76.15 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.773 -178.322 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 55.5 mm-40 -72.76 -56.1 5.76 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.874 0.369 . . . . 0.0 111.571 -179.529 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.562 ' O ' HG22 ' A' ' 49' ' ' ILE . 9.7 pt -63.81 -27.75 43.52 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.069 -178.838 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 88.4 m-20 -70.72 -35.08 72.54 Favored 'General case' 0 N--CA 1.465 0.275 0 O-C-N 123.342 0.401 . . . . 0.0 110.907 179.841 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -52.66 -21.18 3.69 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.45 -179.501 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.562 HG22 ' O ' ' A' ' 46' ' ' ILE . 16.9 tt -60.61 -40.55 84.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.837 -179.501 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.441 ' N ' HG23 ' A' ' 49' ' ' ILE . 56.0 mtpt -51.6 -34.92 39.43 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.505 -178.744 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 34.4 mmtp -66.87 -39.5 87.55 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.61 179.865 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 50.5 t0 -70.35 -51.82 27.15 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.776 0.322 . . . . 0.0 110.844 -179.756 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.467 ' O ' ' O ' ' A' ' 56' ' ' LYS . . . -55.07 -34.34 63.51 Favored 'General case' 0 C--O 1.222 -0.351 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.445 -179.5 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -58.66 -31.69 68.41 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.887 0.375 . . . . 0.0 110.819 179.956 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 61.0 mt -60.94 -43.91 98.0 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.937 -179.268 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.467 ' O ' ' O ' ' A' ' 53' ' ' ALA . 52.2 mtpt -110.7 141.7 43.63 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-O 121.141 0.496 . . . . 0.0 110.638 -179.852 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -76.8 90.68 0.97 Allowed Glycine 0 CA--C 1.522 0.519 0 N-CA-C 110.674 -0.97 . . . . 0.0 110.674 -179.926 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 27.7 m -136.77 161.15 36.67 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.508 0 CA-C-O 120.914 0.388 . . . . 0.0 110.525 -179.79 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 71.5 m-80 -70.67 165.31 23.2 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.944 -0.571 . . . . 0.0 109.943 -179.915 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 67.7 t80 -142.44 -59.11 0.45 Allowed 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.785 -179.877 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 54.1 t0 -112.1 100.89 9.21 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.595 179.805 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -132.77 -95.14 0.33 Allowed 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.295 179.954 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 93.4 m-85 52.35 99.09 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.773 0.321 . . . . 0.0 110.653 -179.721 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 25.2 pttm -153.3 145.78 24.09 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.359 -179.896 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 84.9 m-20 53.4 36.1 22.15 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.668 179.668 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 66.0 tttm 57.27 114.28 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.119 0.485 . . . . 0.0 110.502 -179.872 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 6.7 tppt? -57.02 123.77 16.36 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.48 -179.655 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 44.6 m -90.39 126.08 35.76 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-O 120.991 0.424 . . . . 0.0 110.56 179.619 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 68.1 178.63 15.01 Favored Glycine 0 CA--C 1.522 0.476 0 N-CA-C 110.637 -0.985 . . . . 0.0 110.637 179.769 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 95.9 p -160.05 156.24 26.62 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-O 120.82 0.343 . . . . 0.0 110.414 179.75 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' GLY . . . . . 0.619 ' H ' ' CD1' ' A' ' 79' ' ' LEU . . . 64.09 -92.65 0.12 Allowed Glycine 0 CA--C 1.528 0.899 0 N-CA-C 110.985 -0.846 . . . . 0.0 110.985 179.895 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.441 ' O ' ' O ' ' A' ' 73' ' ' SER . 27.9 m -56.08 130.0 18.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 C-N-CA 121.129 -0.229 . . . . 0.0 110.854 -179.867 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 73' ' ' SER . . . . . 0.463 ' O ' ' CB ' ' A' ' 74' ' ' GLU . 65.1 m 50.9 101.9 0.01 OUTLIER 'General case' 0 CA--C 1.507 -0.695 0 CA-C-O 118.7 -0.667 . . . . 0.0 109.782 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 74' ' ' GLU . . . . . 0.463 ' CB ' ' O ' ' A' ' 73' ' ' SER . 59.5 tt0 152.34 -22.28 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.714 0 O-C-N 124.696 1.247 . . . . 0.0 110.761 179.553 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 75' ' ' ASN . . . . . 0.577 ' C ' ' H ' ' A' ' 77' ' ' PHE . 8.0 m120 88.03 85.39 0.04 OUTLIER Pre-proline 0 N--CA 1.472 0.653 0 O-C-N 124.112 0.882 . . . . 0.0 109.465 -177.96 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_exo -59.3 18.62 0.03 OUTLIER 'Trans proline' 0 N--CA 1.498 1.789 0 C-N-CA 122.642 2.228 . . . . 0.0 112.401 179.656 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' PHE . . . . . 0.577 ' H ' ' C ' ' A' ' 75' ' ' ASN . 75.3 t80 -75.06 -52.75 10.28 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.017 0.437 . . . . 0.0 110.925 179.803 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 15.1 tt -76.33 -27.57 17.66 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.244 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.319 -179.879 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.619 ' CD1' ' H ' ' A' ' 71' ' ' GLY . 56.6 mt -72.99 -43.69 61.92 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.032 0.444 . . . . 0.0 111.377 -179.684 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 92.0 mt-10 -67.6 -24.17 65.45 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.54 179.477 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -64.92 -34.33 78.16 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.878 0.37 . . . . 0.0 111.004 -179.9 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 48.7 mtmt -72.89 -20.64 61.05 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.698 -179.663 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 48.3 t -72.81 -44.89 57.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 121.016 0.436 . . . . 0.0 110.61 179.865 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 91.4 mtt-85 -71.14 -30.03 65.98 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.361 -179.874 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -65.07 -46.4 81.31 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.047 0.451 . . . . 0.0 111.568 -179.146 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 5.7 t -75.43 -20.87 58.6 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.288 179.966 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 96.3 m -62.05 -53.54 54.13 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.528 -0.469 . . . . 0.0 111.244 -179.218 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 35.4 t -70.41 -44.32 77.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-O 121.092 0.473 . . . . 0.0 110.829 -179.591 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -59.17 -36.7 75.78 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.971 -0.558 . . . . 0.0 110.601 -179.052 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 84.3 tt0 -56.68 -44.93 81.93 Favored 'General case' 0 C--N 1.323 -0.577 0 C-N-CA 120.565 -0.454 . . . . 0.0 110.515 -179.933 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 9.7 mtpm? -56.66 -39.18 73.29 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.371 -179.3 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 76.9 t80 -59.3 -45.97 89.84 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.806 -179.855 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 65.2 t -56.03 -44.86 79.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-O 120.83 0.348 . . . . 0.0 110.401 -178.817 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 96.7 mt -58.94 -41.17 82.26 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 -179.335 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -56.1 -44.7 79.32 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.464 -0.334 . . . . 0.0 110.751 -179.452 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 44.4 mm -61.42 -41.78 91.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.177 -179.682 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 83.7 tt0 -60.61 -48.57 81.2 Favored 'General case' 0 C--N 1.323 -0.58 0 C-N-CA 120.651 -0.42 . . . . 0.0 110.586 -179.825 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 14.8 mm-40 -66.22 -32.22 73.52 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.561 -179.55 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -59.7 -39.65 85.32 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.417 -179.152 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -59.28 -27.59 65.96 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.037 -0.528 . . . . 0.0 110.302 -179.416 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 8.5 m -60.65 -43.33 97.71 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.504 -179.48 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -71.22 -16.57 62.51 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.472 -179.603 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.491 ' O ' ' N ' ' A' ' 105' ' ' GLU . 77.8 mt -101.77 -6.63 23.41 Favored 'General case' 0 CA--C 1.5 -0.966 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.406 -179.341 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.485 ' O ' ' O ' ' A' ' 105' ' ' GLU . 0.1 OUTLIER -24.33 -44.13 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.772 0 O-C-N 124.528 1.142 . . . . 0.0 110.798 -179.169 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 105' ' ' GLU . . . . . 0.491 ' N ' ' O ' ' A' ' 103' ' ' LEU . 77.5 mm-40 -56.75 -148.11 0.0 OUTLIER 'General case' 0 N--CA 1.448 -0.575 0 CA-C-N 115.187 -0.915 . . . . 0.0 109.343 178.514 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 106' ' ' THR . . . . . 0.715 HG23 ' H ' ' A' ' 107' ' ' GLY . 4.7 t -48.57 -59.17 3.73 Favored 'General case' 0 C--N 1.318 -0.772 0 O-C-N 121.992 -0.443 . . . . 0.0 111.114 178.997 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 107' ' ' GLY . . . . . 0.715 ' H ' HG23 ' A' ' 106' ' ' THR . . . 70.94 -43.84 0.64 Allowed Glycine 0 CA--C 1.526 0.762 0 N-CA-C 111.044 -0.822 . . . . 0.0 111.044 -179.445 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 1.4 t 72.89 129.83 0.04 OUTLIER 'General case' 0 CA--C 1.53 0.184 0 CA-C-O 120.767 0.317 . . . . 0.0 110.482 -179.792 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 15.0 m -64.01 -36.73 84.94 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.449 179.912 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -59.04 -33.36 73.99 Favored Glycine 0 CA--C 1.522 0.487 0 N-CA-C 110.792 -0.923 . . . . 0.0 110.792 -179.658 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 42.7 tp10 -66.73 -43.34 84.5 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 120.77 -0.372 . . . . 0.0 110.3 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 112' ' ' PHE . . . . . 0.436 ' O ' ' N ' ' A' ' 115' ' ' MET . 48.3 m-85 -67.62 -37.57 82.68 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.625 -179.956 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 59.9 p -47.31 -34.71 7.08 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.967 0.413 . . . . 0.0 110.67 -179.039 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -76.44 -28.85 56.74 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.778 178.854 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 115' ' ' MET . . . . . 0.436 ' N ' ' O ' ' A' ' 112' ' ' PHE . 60.9 mmm -73.38 -44.71 58.0 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.234 -179.844 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 7.4 m-85 -60.24 -49.43 77.64 Favored 'General case' 0 CA--C 1.513 -0.445 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 -179.388 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 66.8 t0 -47.75 -32.15 5.58 Favored 'General case' 0 N--CA 1.453 -0.28 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 -179.084 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.515 ' O ' HD13 ' A' ' 118' ' ' LEU . 0.2 OUTLIER -62.23 -44.81 95.72 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.73 -179.992 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 119' ' ' MET . . . . . 0.415 ' C ' ' SD ' ' A' ' 119' ' ' MET . 0.0 OUTLIER -52.16 -42.91 63.79 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.238 -0.892 . . . . 0.0 109.724 -178.988 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 85.4 m-85 -68.06 -39.61 82.97 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.06 -179.828 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 87.7 mt-10 -59.61 -45.76 90.96 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.779 -179.344 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 122' ' ' VAL . . . . . 0.552 ' O ' HD23 ' A' ' 126' ' ' LEU . 7.7 p -75.08 -24.66 17.88 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.822 0 O-C-N 123.314 0.384 . . . . 0.0 110.042 179.344 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 23.0 t -75.5 -25.75 57.55 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.832 0.348 . . . . 0.0 111.037 179.862 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 124' ' ' LYS . . . . . 0.481 ' N ' ' HD2' ' A' ' 125' ' ' PRO . 43.6 tptt -59.55 -57.25 28.32 Favored Pre-proline 0 CA--C 1.549 0.92 0 C-N-CA 120.557 -0.457 . . . . 0.0 110.777 179.797 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 125' ' ' PRO . . . . . 0.481 ' HD2' ' N ' ' A' ' 124' ' ' LYS . 31.8 Cg_endo -60.28 -25.78 81.02 Favored 'Trans proline' 0 N--CA 1.489 1.208 0 C-N-CA 122.597 2.198 . . . . 0.0 111.783 -178.387 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.552 HD23 ' O ' ' A' ' 122' ' ' VAL . 2.5 mm? -64.65 -32.77 74.57 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.69 -179.211 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 78.6 mt-30 -57.28 -38.22 73.58 Favored 'General case' 0 C--N 1.31 -1.129 0 C-N-CA 120.403 -0.519 . . . . 0.0 110.306 -179.859 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 32.4 mmtp -61.61 -10.98 9.45 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.752 -179.614 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 15.4 mt -114.47 -2.52 13.18 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.973 179.743 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 130' ' ' GLY . . . . . 0.525 ' O ' ' C ' ' A' ' 131' ' ' ILE . . . 114.43 -94.78 0.7 Allowed Glycine 0 CA--C 1.503 -0.687 0 N-CA-C 109.82 -1.312 . . . . 0.0 109.82 179.942 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 131' ' ' ILE . . . . . 0.525 ' C ' ' O ' ' A' ' 130' ' ' GLY . 4.8 mp -3.46 88.46 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.084 0 O-C-N 124.902 1.001 . . . . 0.0 110.703 179.837 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 132' ' ' GLN . . . . . 0.489 ' O ' ' HB2' ' A' ' 133' ' ' GLU . 19.4 tt0 -123.51 162.62 22.54 Favored 'General case' 0 CA--C 1.486 -1.514 0 N-CA-C 107.294 -1.372 . . . . 0.0 107.294 -178.583 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 133' ' ' GLU . . . . . 0.489 ' HB2' ' O ' ' A' ' 132' ' ' GLN . 92.4 mt-10 106.22 -19.4 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.972 0 O-C-N 125.785 1.928 . . . . 0.0 109.757 179.536 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 5.0 mtp -52.85 -48.2 67.22 Favored 'General case' 0 C--N 1.319 -0.735 0 C-N-CA 120.36 -0.536 . . . . 0.0 110.899 -179.277 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 65.7 p -52.58 -21.62 4.07 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.57 178.796 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 70.3 mmtt -83.31 -48.09 10.8 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 115.626 -0.715 . . . . 0.0 111.304 -179.651 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 46.5 p -54.05 -50.22 67.2 Favored 'General case' 0 C--N 1.324 -0.505 0 C-N-CA 120.827 -0.349 . . . . 0.0 110.745 -178.983 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 58.3 t -68.72 -44.35 82.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.088 -179.881 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 47.6 t -65.34 -41.29 94.07 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.954 0.407 . . . . 0.0 111.14 -179.846 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -64.21 -42.1 96.76 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.665 -179.539 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -63.54 -47.59 80.96 Favored 'General case' 0 CA--C 1.519 -0.248 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.998 -179.626 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -46.54 -35.46 5.8 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.944 -179.292 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -90.61 77.15 6.43 Favored 'General case' 0 CA--C 1.517 -0.301 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 179.509 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 79.2 tt0 -177.64 -61.23 0.01 OUTLIER 'General case' 0 C--N 1.334 -0.077 0 O-C-N 123.593 0.558 . . . . 0.0 110.434 179.644 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 145' ' ' ASN . . . . . . . . . . . . . 7.2 p-10 -143.01 64.63 14.71 Favored Pre-proline 0 N--CA 1.467 0.402 0 CA-C-N 116.196 -0.457 . . . . 0.0 109.897 -179.575 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 146' ' ' PRO . . . . . 0.547 ' O ' ' N ' ' A' ' 148' ' ' THR . 80.7 Cg_exo -34.24 98.78 0.02 OUTLIER 'Trans proline' 0 N--CA 1.491 1.329 0 C-N-CA 123.304 2.669 . . . . 0.0 111.722 -179.503 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 147' ' ' PRO . . . . . 0.526 ' C ' ' H ' ' A' ' 149' ' ' THR . 59.6 Cg_exo -51.48 74.2 0.02 OUTLIER 'Trans proline' 0 N--CA 1.496 1.671 0 C-N-CA 122.354 2.036 . . . . 0.0 113.14 -179.294 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 148' ' ' THR . . . . . 0.547 ' N ' ' O ' ' A' ' 146' ' ' PRO . 8.1 p -73.17 21.43 0.08 Allowed 'General case' 0 C--N 1.329 -0.309 0 O-C-N 121.997 -0.439 . . . . 0.0 109.981 179.883 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 149' ' ' THR . . . . . 0.656 HG23 ' H ' ' A' ' 152' ' ' GLY . 1.2 t -148.52 156.36 42.34 Favored 'General case' 0 CA--C 1.52 -0.176 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.161 -179.881 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -64.75 -33.78 76.78 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.958 -179.784 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 56.7 tt0 -68.74 -44.41 73.85 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.881 0.372 . . . . 0.0 110.753 -179.784 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 152' ' ' GLY . . . . . 0.656 ' H ' HG23 ' A' ' 149' ' ' THR . . . -56.53 -38.3 79.97 Favored Glycine 0 CA--C 1.52 0.366 0 N-CA-C 110.871 -0.892 . . . . 0.0 110.871 -179.198 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 153' ' ' VAL . . . . . . . . . . . . . 75.9 t -53.51 -32.53 20.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 C-N-CA 120.923 -0.311 . . . . 0.0 110.503 -179.392 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 72.5 mt -56.85 -27.47 60.37 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.94 0.4 . . . . 0.0 110.112 -179.505 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 67.3 mm-40 -66.92 -32.82 74.33 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.258 179.583 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 156' ' ' ILE . . . . . 0.428 HG22 ' SD ' ' A' ' 160' ' ' MET . 14.7 mm -75.23 -41.53 44.07 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.182 0 CA-C-O 120.931 0.396 . . . . 0.0 110.88 179.605 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -50.8 -39.22 52.3 Favored 'General case' 0 CA--C 1.516 -0.341 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.379 -179.646 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 158' ' ' LYS . . . . . 0.436 ' O ' ' CB ' ' A' ' 162' ' ' GLU . 99.6 mttt -56.38 -56.63 18.76 Favored 'General case' 0 C--O 1.216 -0.664 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.447 179.787 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 42.7 mmtm -57.96 -36.49 72.66 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.757 0.313 . . . . 0.0 111.007 -179.375 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 160' ' ' MET . . . . . 0.428 ' SD ' HG22 ' A' ' 156' ' ' ILE . 6.2 mtp -67.44 -57.4 6.61 Favored 'General case' 0 C--N 1.322 -0.588 0 C-N-CA 120.398 -0.521 . . . . 0.0 110.826 -179.526 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 61.4 ttp180 -68.71 -35.86 77.71 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.881 -179.483 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 162' ' ' GLU . . . . . 0.436 ' CB ' ' O ' ' A' ' 158' ' ' LYS . 81.2 tt0 -65.14 -35.54 81.42 Favored 'General case' 0 CA--C 1.512 -0.495 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.536 -179.275 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 163' ' ' LYS . . . . . . . . . . . . . 23.3 tptm -70.58 -56.5 6.37 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 119.992 -0.683 . . . . 0.0 110.845 -179.131 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 4.8 mt -55.17 -28.96 56.67 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.187 0.518 . . . . 0.0 110.081 -178.519 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 54.3 tt0 -61.71 -47.82 83.56 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.718 -0.673 . . . . 0.0 110.388 -179.71 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -62.09 -30.52 71.06 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.4 0.619 . . . . 0.0 110.731 -179.595 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 167' ' ' VAL . . . . . . . . . . . . . 51.8 t -67.2 -46.57 83.89 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-N 115.038 -0.983 . . . . 0.0 110.693 -179.694 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 168' ' ' HIS . . . . . 0.469 ' O ' ' ND1' ' A' ' 168' ' ' HIS . 23.6 t-80 -79.68 -30.52 41.15 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.193 -179.791 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 169' ' ' THR . . . . . . . . . . . . . 27.5 m -72.99 -45.35 58.41 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.409 -179.904 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 64.7 tttm -61.9 -42.26 98.87 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.663 -179.047 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 171' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 -69.84 -31.47 69.35 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.609 179.829 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 172' ' ' TYR . . . . . . . . . . . . . 74.2 t80 -70.05 -32.26 70.29 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.887 -179.833 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 86.5 m -76.24 -32.93 59.15 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.734 -179.822 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 21.4 p -63.62 -37.17 86.33 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.842 0.353 . . . . 0.0 110.477 -179.856 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 94.9 mt -65.49 -34.78 79.07 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.39 -179.928 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 72.6 mmtt -63.44 -8.63 9.64 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.477 -179.818 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 177' ' ' LYS . . . . . . . . . . . . . 62.7 tttm -63.42 -35.86 81.84 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.658 179.124 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 178' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -67.75 -38.87 84.06 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.863 179.897 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 52.3 tp10 -51.04 -46.12 61.53 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.301 -178.936 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 180' ' ' ASN . . . . . 0.404 ' O ' ' CB ' ' A' ' 181' ' ' SER . 91.3 m-20 -96.09 -90.1 0.25 Allowed 'General case' 0 N--CA 1.464 0.244 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 179.481 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 181' ' ' SER . . . . . 0.404 ' CB ' ' O ' ' A' ' 180' ' ' ASN . 1.0 OUTLIER 166.16 -67.05 0.0 OUTLIER 'General case' 0 N--CA 1.462 0.169 0 CA-C-O 120.874 0.369 . . . . 0.0 110.167 179.727 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 182' ' ' THR . . . . . . . . . . . . . 28.8 m -159.15 111.72 2.21 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.521 -179.655 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 183' ' ' PHE . . . . . . . . . . . . . 30.5 m-85 -141.54 153.4 44.84 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.356 179.983 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 2.9 m -145.4 45.49 1.31 Allowed 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.418 179.758 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 185' ' ' ASP . . . . . . . . . . . . . 49.6 p-10 -163.46 42.05 0.1 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.704 179.876 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 186' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -155.13 152.3 29.3 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.151 0.5 . . . . 0.0 109.957 -179.081 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 58.4 mtpt -88.73 148.17 24.11 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.309 179.598 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 188' ' ' CYS . . . . . . . . . . . . . 45.1 t -54.11 -34.25 59.8 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.523 179.713 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 189' ' ' LYS . . . . . . . . . . . . . 34.9 mmtp -69.47 -59.62 2.86 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.528 -179.849 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 190' ' ' ASN . . . . . . . . . . . . . 20.6 t-20 -71.88 102.55 2.92 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.01 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 191' ' ' ASN . . . . . . . . . . . . . 86.9 m-20 . . . . . 0 C--O 1.219 -0.538 0 CA-C-O 118.137 -0.935 . . . . 0.0 110.544 -179.82 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 35.3 m . . . . . 0 N--CA 1.491 1.596 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . 52.27 -104.31 0.18 Allowed 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.489 -179.944 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -157.52 -36.5 0.02 OUTLIER Glycine 0 CA--C 1.523 0.577 0 N-CA-C 110.824 -0.91 . . . . 0.0 110.824 -179.882 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 52.1 mt -78.16 149.14 33.82 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.028 0.442 . . . . 0.0 110.082 -179.895 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.669 ' O ' HG23 ' A' ' 28' ' ' THR . 7.1 t -59.88 98.64 0.06 Allowed 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.786 -0.643 . . . . 0.0 109.852 179.719 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' GLY . . . . . 0.555 ' O ' ' HB2' ' A' ' 30' ' ' ALA . . . -20.89 84.72 0.0 OUTLIER Glycine 0 N--CA 1.48 1.619 0 O-C-N 123.7 0.625 . . . . 0.0 112.322 -179.347 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.555 ' HB2' ' O ' ' A' ' 29' ' ' GLY . . . 164.5 -69.65 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 120.988 0.423 . . . . 0.0 109.963 -178.363 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 25.4 m -49.18 -29.32 5.36 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.55 -178.86 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 21.0 pttp -61.94 -26.3 68.11 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.5 179.596 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 96.6 mt -59.07 -45.12 92.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 -178.549 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 10.1 tpt180 -65.61 -53.07 46.73 Favored 'General case' 0 C--N 1.324 -0.506 0 C-N-CA 120.158 -0.617 . . . . 0.0 110.365 -179.69 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.441 HD12 ' N ' ' A' ' 35' ' ' LEU . 11.0 mp -59.87 -44.9 93.92 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.054 -0.521 . . . . 0.0 109.696 -178.635 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 80.9 tt0 -58.94 -51.01 71.89 Favored 'General case' 0 C--N 1.32 -0.717 0 C-N-CA 120.479 -0.488 . . . . 0.0 110.234 -179.505 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 16.5 mmm180 -68.69 -42.43 77.8 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.962 0.411 . . . . 0.0 110.968 -179.766 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 52.0 m -67.52 -40.08 85.08 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.609 -179.89 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -61.01 -49.49 77.23 Favored 'General case' 0 C--O 1.219 -0.51 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.491 -179.536 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -54.4 -42.75 70.79 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 120.683 -0.407 . . . . 0.0 110.25 -179.09 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 23.9 m-20 -52.93 -22.87 6.11 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.713 179.594 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 81.1 mt -65.81 -59.01 4.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 C-N-CA 120.184 -0.606 . . . . 0.0 110.98 -179.819 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 82.8 p -76.71 -37.22 56.47 Favored 'General case' 0 C--O 1.225 -0.188 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.657 -179.009 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 52.6 t0 -61.94 -41.04 97.5 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.836 -0.62 . . . . 0.0 112.427 -178.088 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 64.8 mm-40 -69.1 -51.76 35.28 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.873 0.368 . . . . 0.0 111.419 -179.194 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 10.2 pt -66.91 -28.59 43.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.531 -179.333 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -61.43 -40.47 94.56 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 110.036 -0.357 . . . . 0.0 110.036 -179.785 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -53.41 -30.07 38.29 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.331 -179.15 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 62.8 mt -67.6 -43.42 86.96 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.333 179.454 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 69.0 mttm -58.21 -46.28 86.12 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.159 -179.087 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 52.1 mtmt -65.62 -41.07 93.11 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.662 179.401 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 96.6 m-20 -61.59 -39.37 90.93 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.029 -179.377 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.441 ' O ' ' O ' ' A' ' 56' ' ' LYS . . . -60.86 -31.97 71.4 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.596 -179.992 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -59.35 -30.82 68.67 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.892 0.377 . . . . 0.0 110.921 -179.701 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 57.3 mt -59.1 -34.3 71.84 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.609 -179.349 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.441 ' O ' ' O ' ' A' ' 53' ' ' ALA . 68.9 mttm -119.19 147.45 44.21 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-O 121.249 0.547 . . . . 0.0 110.551 -179.851 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -77.27 95.51 1.19 Allowed Glycine 0 CA--C 1.521 0.441 0 N-CA-C 110.496 -1.041 . . . . 0.0 110.496 -179.895 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 27.4 m -133.55 152.21 34.71 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.512 0 CA-C-O 120.853 0.358 . . . . 0.0 110.098 179.99 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 49.2 p-10 -84.33 63.58 7.85 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.277 -179.948 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 81.3 t80 -62.08 -53.57 53.67 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.687 -179.744 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 36.1 p-10 -91.41 78.15 5.72 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.573 -179.746 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -143.42 -82.19 0.18 Allowed 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.269 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' PHE . . . . . 0.502 ' C ' ' H ' ' A' ' 65' ' ' ASP . 64.4 m-85 56.58 39.43 29.84 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.451 -179.596 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 72.7 tttt -72.02 19.9 0.07 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.48 -179.838 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.502 ' H ' ' C ' ' A' ' 63' ' ' PHE . 37.4 t70 -167.06 160.3 13.9 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.81 0.338 . . . . 0.0 110.166 -179.998 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 22.5 pttp -65.29 140.43 58.7 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.251 179.84 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.569 ' C ' ' H ' ' A' ' 69' ' ' GLY . 46.9 mmtm -119.85 -84.44 0.66 Allowed 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.338 -179.952 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 3.5 m 66.39 -15.42 0.13 Allowed 'General case' 0 C--N 1.326 -0.452 0 O-C-N 123.24 0.338 . . . . 0.0 110.633 -179.499 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' GLY . . . . . 0.569 ' H ' ' C ' ' A' ' 67' ' ' LYS . . . 160.19 -136.09 4.38 Favored Glycine 0 C--N 1.333 0.416 0 N-CA-C 110.397 -1.081 . . . . 0.0 110.397 -179.665 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 5.2 t 64.25 88.06 0.11 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.757 0.313 . . . . 0.0 110.16 -179.742 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -79.1 23.35 3.24 Favored Glycine 0 CA--C 1.524 0.596 0 N-CA-C 111.055 -0.818 . . . . 0.0 111.055 -179.792 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 10.9 p -130.82 -31.94 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.708 0 CA-C-O 120.791 0.329 . . . . 0.0 110.765 -179.908 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 67.5 m -58.33 -40.91 83.37 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.389 -179.447 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 11.4 tp10 -135.29 -145.05 0.22 Allowed 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.468 -179.708 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 69.8 m-20 -90.19 140.24 27.24 Favored Pre-proline 0 CA--C 1.534 0.347 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.321 -179.5 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -74.53 -5.67 17.21 Favored 'Trans proline' 0 N--CA 1.495 1.58 0 C-N-CA 122.443 2.095 . . . . 0.0 111.971 179.903 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 53.5 t80 -72.36 -50.95 22.92 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.907 0.384 . . . . 0.0 111.513 -179.413 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 64.7 mt -69.74 -29.0 39.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.935 -179.296 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.421 ' N ' HD12 ' A' ' 79' ' ' LEU . 8.1 mp -77.01 -48.71 17.18 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 120.862 0.363 . . . . 0.0 110.174 179.778 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -65.44 -29.33 69.99 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.095 -0.502 . . . . 0.0 109.922 179.937 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -66.78 -37.28 84.27 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.706 179.662 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 37.0 ttpt -63.78 -24.2 67.67 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.744 -179.596 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 32.3 t -70.69 -46.6 68.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.668 179.859 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 57.8 ttt85 -62.28 -33.18 74.14 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.32 -179.642 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -59.28 -37.6 78.08 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.121 0.486 . . . . 0.0 110.895 -179.427 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 61.3 p -72.11 -27.7 62.8 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.36 179.638 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 25.0 m -57.61 -53.77 54.4 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 120.443 -0.503 . . . . 0.0 111.252 -178.778 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.565 HG23 ' N ' ' A' ' 89' ' ' ALA . 26.8 m -72.46 -50.8 32.57 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-O 120.92 0.39 . . . . 0.0 111.338 179.668 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 89' ' ' ALA . . . . . 0.565 ' N ' HG23 ' A' ' 88' ' ' VAL . . . -55.57 -44.25 76.71 Favored 'General case' 0 C--O 1.222 -0.376 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.341 -178.323 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 77.8 tt0 -58.2 -45.45 87.57 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.193 0.52 . . . . 0.0 110.584 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 57.3 mtpt -60.87 -29.65 69.67 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.63 -179.206 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.455 ' CZ ' HD12 ' A' ' 118' ' ' LEU . 82.7 t80 -71.05 -59.38 2.81 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.987 -178.859 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 8.4 m -49.4 -40.29 14.23 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.448 0 N-CA-C 109.921 -0.4 . . . . 0.0 109.921 -178.801 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 88.9 mt -61.94 -43.06 96.97 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 N-CA-C 109.888 -0.412 . . . . 0.0 109.888 179.52 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -57.52 -30.98 65.6 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 120.876 -0.33 . . . . 0.0 110.801 -179.112 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 40.7 mm -59.87 -36.51 67.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.44 -179.512 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -65.78 -34.41 78.12 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.938 179.907 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -65.05 -39.53 93.43 Favored 'General case' 0 C--N 1.326 -0.45 0 C-N-CA 120.851 -0.34 . . . . 0.0 110.358 -179.469 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 80.7 mm-40 -67.38 -39.0 85.59 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.908 0.385 . . . . 0.0 110.744 -179.832 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -53.27 -48.34 68.39 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.956 0.408 . . . . 0.0 110.81 -179.634 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 11.9 m -60.1 -48.24 82.57 Favored 'General case' 0 C--N 1.321 -0.652 0 C-N-CA 120.472 -0.491 . . . . 0.0 110.847 -179.392 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 5.8 mptp? -67.21 -31.57 72.03 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.802 0.334 . . . . 0.0 111.009 179.935 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 27.1 mt -67.11 -7.1 20.62 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 120.869 0.366 . . . . 0.0 110.679 -178.803 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.405 ' O ' HG22 ' A' ' 106' ' ' THR . 22.4 pttp -57.83 142.51 45.53 Favored 'General case' 0 C--N 1.316 -0.863 0 C-N-CA 120.508 -0.477 . . . . 0.0 109.788 179.547 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 70.3 mm-40 66.96 20.87 10.44 Favored 'General case' 0 C--N 1.33 -0.253 0 O-C-N 123.609 0.568 . . . . 0.0 111.133 178.753 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 106' ' ' THR . . . . . 0.409 ' O ' ' OG1' ' A' ' 106' ' ' THR . 0.9 OUTLIER 178.0 31.32 0.0 OUTLIER 'General case' 0 CA--C 1.53 0.188 0 CA-C-O 121.126 0.488 . . . . 0.0 110.081 179.694 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -82.83 -63.79 1.72 Allowed Glycine 0 N--CA 1.464 0.508 0 N-CA-C 110.871 -0.892 . . . . 0.0 110.871 -179.719 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 108' ' ' SER . . . . . 0.464 ' O ' ' CE1' ' A' ' 112' ' ' PHE . 1.0 OUTLIER 70.5 -171.48 0.17 Allowed 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 109.735 -0.468 . . . . 0.0 109.735 -179.74 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 91.4 p -113.99 -10.79 12.85 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.366 179.638 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -71.76 -52.79 10.97 Favored Glycine 0 CA--C 1.526 0.754 0 N-CA-C 111.355 -0.698 . . . . 0.0 111.355 179.89 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 111' ' ' GLU . . . . . 0.505 ' CD ' ' H ' ' A' ' 111' ' ' GLU . 2.5 mp0 -68.31 -22.62 64.7 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.916 0.389 . . . . 0.0 110.876 -179.491 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 112' ' ' PHE . . . . . 0.464 ' CE1' ' O ' ' A' ' 108' ' ' SER . 3.3 m-85 -59.42 -43.79 92.98 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.24 -178.987 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 43.8 t -60.1 -43.44 95.56 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.212 -179.891 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -65.11 -28.89 69.75 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.733 179.642 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 50.1 tpp -76.11 -52.54 9.92 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.245 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 36.9 t80 -62.08 -50.18 72.97 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 109.777 -0.453 . . . . 0.0 109.777 -179.685 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 52.2 t0 -48.58 -27.73 2.97 Favored 'General case' 0 CA--C 1.517 -0.29 0 N-CA-C 109.652 -0.499 . . . . 0.0 109.652 -179.073 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.49 ' O ' HD13 ' A' ' 118' ' ' LEU . 0.2 OUTLIER -64.68 -46.14 83.7 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.498 0.666 . . . . 0.0 109.893 -179.926 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 14.4 tpt -57.96 -34.26 69.74 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 114.987 -1.006 . . . . 0.0 109.638 -179.305 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 68.1 t80 -71.0 -41.1 71.38 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.317 -0.401 . . . . 0.0 112.046 -179.41 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 65.5 mm-40 -63.45 -44.87 93.24 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.87 -178.937 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 28.9 m -75.22 -23.97 17.37 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.405 0 O-C-N 123.326 0.391 . . . . 0.0 110.749 -179.898 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 21.2 t -68.0 -33.16 74.08 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.631 179.69 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 17.1 mttp -60.24 -56.68 33.06 Favored Pre-proline 0 CA--C 1.541 0.626 0 C-N-CA 121.05 -0.26 . . . . 0.0 110.833 -179.421 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 75.8 Cg_exo -43.58 -36.5 7.18 Favored 'Trans proline' 0 C--N 1.317 -1.113 0 C-N-CA 122.14 1.893 . . . . 0.0 112.442 178.402 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.51 ' HB3' HD13 ' A' ' 131' ' ' ILE . 10.1 mp -70.29 -35.13 73.51 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.981 -179.862 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 17.2 mm100 -61.51 -52.41 64.6 Favored 'General case' 0 C--N 1.32 -0.683 0 C-N-CA 120.248 -0.581 . . . . 0.0 110.728 -179.427 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 50.1 mtmt -63.78 -10.98 22.82 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.18 -179.57 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.412 ' C ' HD23 ' A' ' 129' ' ' LEU . 2.5 tt -97.86 -67.62 0.84 Allowed 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.278 -179.778 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 130' ' ' GLY . . . . . 0.66 ' C ' HD12 ' A' ' 131' ' ' ILE . . . -155.51 -138.51 2.58 Favored Glycine 0 CA--C 1.518 0.259 0 N-CA-C 110.688 -0.965 . . . . 0.0 110.688 -179.231 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 131' ' ' ILE . . . . . 1.042 HG22 ' H ' ' A' ' 132' ' ' GLN . 3.3 mp 53.28 -158.41 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.517 -0.298 0 N-CA-C 109.654 -0.499 . . . . 0.0 109.654 -179.771 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 132' ' ' GLN . . . . . 1.042 ' H ' HG22 ' A' ' 131' ' ' ILE . 6.0 tp60 177.43 139.52 0.08 Allowed 'General case' 0 N--CA 1.446 -0.654 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 179.866 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 94.1 mt-10 59.28 26.12 14.88 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-O 120.966 0.412 . . . . 0.0 111.455 178.135 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 9.3 tpt -57.79 -39.93 78.69 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.087 -179.798 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 56.8 p -75.22 -61.72 1.8 Allowed 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 121.363 0.602 . . . . 0.0 110.696 -179.699 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 17.7 ttmm -49.24 -44.27 43.41 Favored 'General case' 0 C--N 1.32 -0.679 0 C-N-CA 120.455 -0.498 . . . . 0.0 110.524 -178.327 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 76.8 m -55.52 -68.44 0.2 Allowed 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.323 -179.299 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 138' ' ' VAL . . . . . 0.41 HG13 ' N ' ' A' ' 139' ' ' SER . 11.7 p -59.86 -38.89 78.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.993 0.425 . . . . 0.0 110.469 -178.891 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 139' ' ' SER . . . . . 0.41 ' N ' HG13 ' A' ' 138' ' ' VAL . 15.9 m -63.23 -38.5 91.4 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.753 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -63.09 -31.42 72.56 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.009 -0.542 . . . . 0.0 110.522 -179.859 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -64.43 -46.03 84.93 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.86 0.362 . . . . 0.0 111.119 -179.598 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -57.75 -31.18 66.24 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.713 -179.207 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 14.3 mm-40 -75.13 -44.59 46.18 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.861 0.362 . . . . 0.0 111.117 -179.99 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 46.3 tp10 -72.12 -45.79 59.17 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.022 -179.106 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 145' ' ' ASN . . . . . . . . . . . . . 4.4 p30 -128.54 68.98 78.81 Favored Pre-proline 0 N--CA 1.469 0.513 0 CA-C-N 116.376 -0.374 . . . . 0.0 110.09 -179.045 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 146' ' ' PRO . . . . . . . . . . . . . 23.2 Cg_endo -60.28 112.69 1.39 Allowed 'Trans proline' 0 N--CA 1.492 1.418 0 C-N-CA 122.38 2.053 . . . . 0.0 111.303 -179.7 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 147' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -79.3 136.36 12.62 Favored 'Trans proline' 0 N--CA 1.491 1.378 0 C-N-CA 122.115 1.876 . . . . 0.0 111.768 -179.902 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 36.5 p -129.53 18.96 5.76 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.236 179.327 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 149' ' ' THR . . . . . . . . . . . . . 8.5 m -151.96 152.46 32.52 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 120.661 0.267 . . . . 0.0 110.354 179.578 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -49.47 -36.11 21.71 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.795 0.331 . . . . 0.0 110.559 -179.077 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 14.9 pt20 -77.74 -40.64 40.41 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.649 179.216 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . -56.4 -36.97 71.92 Favored Glycine 0 CA--C 1.519 0.302 0 N-CA-C 110.887 -0.885 . . . . 0.0 110.887 -178.839 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 153' ' ' VAL . . . . . 0.44 ' O ' ' N ' ' A' ' 156' ' ' ILE . 86.1 t -60.88 -42.07 91.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 C-N-CA 121.21 -0.196 . . . . 0.0 110.508 -179.839 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 79.3 mt -43.56 -23.42 0.07 Allowed 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 120.912 0.387 . . . . 0.0 110.86 -179.295 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 155' ' ' GLU . . . . . 0.411 ' N ' ' C ' ' A' ' 153' ' ' VAL . 95.2 mt-10 -64.86 -40.4 95.08 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.004 179.268 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 156' ' ' ILE . . . . . 0.651 HG22 ' SD ' ' A' ' 160' ' ' MET . 10.2 mm -71.48 -35.74 57.94 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.154 -179.709 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -60.13 -41.75 93.34 Favored 'General case' 0 N--CA 1.453 -0.278 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.864 -179.686 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 17.3 ttmm -60.74 -44.68 96.37 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.496 -179.405 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 53.6 tttm -73.77 -30.09 62.57 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.83 -179.371 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 160' ' ' MET . . . . . 0.651 ' SD ' HG22 ' A' ' 156' ' ' ILE . 12.0 mtp -67.49 -54.05 23.48 Favored 'General case' 0 C--O 1.221 -0.436 0 C-N-CA 120.508 -0.477 . . . . 0.0 110.174 -178.976 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 80.8 mtp180 -61.99 -31.75 72.15 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.394 179.922 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -58.4 -46.34 86.59 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.222 -179.269 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 163' ' ' LYS . . . . . . . . . . . . . 54.0 tttp -65.08 -52.28 56.52 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 120.357 -0.537 . . . . 0.0 110.78 -179.064 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -51.98 -36.08 48.54 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.998 0.427 . . . . 0.0 110.285 -179.071 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 57.6 tt0 -62.09 -40.04 94.48 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.325 179.896 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 20.3 mmt85 -65.89 -34.66 78.65 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.453 0.644 . . . . 0.0 111.434 -179.585 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 167' ' ' VAL . . . . . . . . . . . . . 38.6 t -66.76 -47.44 82.93 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.769 0 CA-C-N 115.139 -0.937 . . . . 0.0 110.284 -179.53 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 42.8 t-80 -79.44 -31.11 42.5 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.519 -179.471 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 169' ' ' THR . . . . . . . . . . . . . 90.2 m -71.64 -44.43 64.35 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.126 -179.828 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 59.8 mmtt -62.01 -41.76 98.43 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.99 0.424 . . . . 0.0 110.733 -179.021 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 171' ' ' ASN . . . . . . . . . . . . . 10.3 m120 -68.63 -34.92 76.57 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.628 179.473 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 172' ' ' TYR . . . . . 0.414 ' CZ ' ' NZ ' ' A' ' 176' ' ' LYS . 86.8 t80 -63.85 -40.46 96.64 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.115 -179.524 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 7.2 t -76.11 -46.85 26.83 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.783 -178.679 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 24.5 p -58.2 -47.83 82.23 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.078 -178.808 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -64.1 -35.14 79.78 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-O 120.808 0.337 . . . . 0.0 110.721 -179.911 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 176' ' ' LYS . . . . . 0.414 ' NZ ' ' CZ ' ' A' ' 172' ' ' TYR . 14.2 tptt -54.71 -19.3 5.93 Favored 'General case' 0 C--N 1.313 -1.003 0 C-N-CA 120.274 -0.57 . . . . 0.0 110.461 -179.158 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 177' ' ' LYS . . . . . . . . . . . . . 61.0 tttm -68.98 -39.77 79.21 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 121.712 0.768 . . . . 0.0 111.368 179.846 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 178' ' ' LYS . . . . . . . . . . . . . 20.0 mtpp -80.7 -23.34 39.61 Favored 'General case' 0 C--N 1.31 -1.138 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.024 -178.721 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 80.7 mm-40 -59.7 -50.97 71.77 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 120.181 -0.608 . . . . 0.0 110.502 -178.753 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 180' ' ' ASN . . . . . 0.504 ' C ' ' H ' ' A' ' 182' ' ' THR . 54.1 p30 -147.16 -13.13 0.41 Allowed 'General case' 0 CA--C 1.516 -0.362 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.281 -179.872 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 3.6 p 70.35 -16.39 0.31 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.839 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 182' ' ' THR . . . . . 0.504 ' H ' ' C ' ' A' ' 180' ' ' ASN . 71.5 p -83.01 86.46 6.99 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-O 120.877 0.37 . . . . 0.0 110.27 -179.856 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 183' ' ' PHE . . . . . 0.411 ' CZ ' ' OE1' ' A' ' 186' ' ' GLU . 72.0 t80 -167.41 -16.57 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.52 -179.874 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 1.5 t -49.91 -16.63 0.29 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.989 0.423 . . . . 0.0 110.686 -179.933 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 185' ' ' ASP . . . . . . . . . . . . . 89.5 m-20 -60.8 -43.74 97.75 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.314 -179.915 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 186' ' ' GLU . . . . . 0.411 ' OE1' ' CZ ' ' A' ' 183' ' ' PHE . 70.7 mt-10 -79.08 147.8 32.65 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.32 -179.739 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 16.9 mmmt -66.68 116.91 8.12 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.575 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 188' ' ' CYS . . . . . 0.41 ' H ' ' H ' ' A' ' 189' ' ' LYS . 12.9 t -171.13 -5.34 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.573 179.868 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 189' ' ' LYS . . . . . 0.41 ' H ' ' H ' ' A' ' 188' ' ' CYS . 88.4 tttt -66.96 -34.41 77.7 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.627 -179.956 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 190' ' ' ASN . . . . . . . . . . . . . 36.1 m120 53.86 -108.31 0.42 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.495 -179.471 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 191' ' ' ASN . . . . . . . . . . . . . 21.2 m120 . . . . . 0 C--O 1.221 -0.43 0 CA-C-O 117.932 -1.032 . . . . 0.0 110.772 179.971 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 33.5 t . . . . . 0 N--CA 1.49 1.531 0 N-CA-C 109.368 -0.604 . . . . 0.0 109.368 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -65.98 -36.15 82.52 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.689 179.872 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -65.16 174.69 15.76 Favored Glycine 0 CA--C 1.525 0.661 0 N-CA-C 110.906 -0.878 . . . . 0.0 110.906 -179.767 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.423 ' H ' HD12 ' A' ' 27' ' ' LEU . 2.2 mp -70.71 165.21 23.48 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.82 0.343 . . . . 0.0 110.855 -179.711 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.523 ' OG1' ' N ' ' A' ' 29' ' ' GLY . 1.4 t -174.34 -173.33 0.76 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.432 -179.589 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' GLY . . . . . 0.583 ' C ' ' H ' ' A' ' 31' ' ' THR . . . 74.22 40.69 40.92 Favored Glycine 0 CA--C 1.519 0.319 0 N-CA-C 110.833 -0.907 . . . . 0.0 110.833 179.715 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.448 ' HB3' ' O ' ' A' ' 29' ' ' GLY . . . 68.48 -20.3 0.15 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.796 0.331 . . . . 0.0 110.583 -179.495 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.583 ' H ' ' C ' ' A' ' 29' ' ' GLY . 24.7 m -64.63 -30.29 71.3 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.351 -179.969 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 63.9 tttp -68.48 -50.7 50.44 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.807 179.973 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 65.0 mt -60.38 -42.48 91.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.361 -179.196 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 -56.35 -42.64 78.08 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.75 -179.517 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 26.8 mt -68.97 -34.18 74.9 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.55 0.214 . . . . 0.0 111.319 -179.147 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -64.93 -52.76 54.61 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.868 -179.43 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 50.3 ptt85 -71.81 -39.71 69.65 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.882 0.372 . . . . 0.0 110.799 -179.625 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 39.4 t -64.85 -39.25 93.27 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.965 -179.595 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -76.53 -34.0 58.56 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.1 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 64.8 tttm -66.36 -33.01 74.77 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.905 -179.623 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 39.7 m-20 -67.35 -27.04 66.8 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.821 -179.307 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 52.8 mt -61.47 -50.19 81.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 C-N-CA 120.885 -0.326 . . . . 0.0 110.846 -179.08 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 68.4 p -73.73 -36.5 65.2 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.801 0.334 . . . . 0.0 111.46 -178.294 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 85.7 m-20 -66.2 -35.09 79.54 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.561 -178.306 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 68.8 mm-40 -74.4 -57.77 3.73 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.933 0.397 . . . . 0.0 111.513 -178.935 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 6.7 pt -58.56 -23.14 22.12 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.637 -178.92 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -62.94 -39.24 94.01 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.072 0.463 . . . . 0.0 110.502 179.459 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -55.24 -22.5 18.33 Favored 'General case' 0 C--N 1.319 -0.728 0 C-N-CA 120.669 -0.412 . . . . 0.0 110.676 -179.924 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 81.4 mt -60.25 -52.72 58.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.462 -178.549 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 5.1 ptmm? -65.85 -30.92 71.61 Favored 'General case' 0 C--N 1.324 -0.542 0 C-N-CA 120.693 -0.403 . . . . 0.0 110.366 -179.167 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 37.7 ttmt -63.83 -47.72 79.69 Favored 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 120.756 -0.378 . . . . 0.0 110.227 179.859 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 95.1 m-20 -65.47 -33.3 75.6 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.17 179.816 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.427 ' O ' ' O ' ' A' ' 56' ' ' LYS . . . -64.01 -28.39 69.77 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.835 179.957 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -60.05 -32.51 70.99 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.891 -179.673 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 55.0 mt -56.84 -44.5 82.18 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.438 -179.216 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.427 ' O ' ' O ' ' A' ' 53' ' ' ALA . 74.2 mmtt -109.42 143.16 39.38 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-O 121.041 0.448 . . . . 0.0 110.501 -179.83 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -74.91 90.73 0.78 Allowed Glycine 0 CA--C 1.519 0.338 0 N-CA-C 110.447 -1.061 . . . . 0.0 110.447 -179.637 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 51.1 t -133.58 135.68 55.43 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.448 0 CA-C-O 120.823 0.344 . . . . 0.0 110.551 -179.861 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 19.9 p-10 -71.2 84.36 0.75 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.134 179.741 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 76.8 t80 -60.88 -47.92 84.17 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.741 -179.561 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 66.5 t0 -100.48 99.21 9.79 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.625 -179.839 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.5 ' O ' ' C ' ' A' ' 63' ' ' PHE . . . -150.37 -15.07 0.24 Allowed 'General case' 0 CA--C 1.512 -0.515 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.665 179.986 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' PHE . . . . . 0.5 ' C ' ' O ' ' A' ' 62' ' ' ALA . 89.3 m-85 -18.99 95.05 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.827 0 O-C-N 124.169 0.918 . . . . 0.0 111.158 -179.792 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 53.2 tptt -65.55 -81.84 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.739 -178.161 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 65.0 m-20 -156.05 -99.38 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.465 -179.583 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 13.9 mptt -68.36 135.95 52.61 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.899 0.381 . . . . 0.0 110.07 -179.447 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.452 ' O ' ' C ' ' A' ' 68' ' ' THR . 19.2 mmtp -91.79 -18.05 24.43 Favored 'General case' 0 CA--C 1.507 -0.695 0 CA-C-N 115.833 -0.622 . . . . 0.0 110.836 -179.85 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' THR . . . . . 0.452 ' C ' ' O ' ' A' ' 67' ' ' LYS . 0.8 OUTLIER 28.11 58.86 0.11 Allowed 'General case' 0 N--CA 1.469 0.488 0 O-C-N 123.943 0.777 . . . . 0.0 110.91 179.819 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 108.71 176.65 21.73 Favored Glycine 0 N--CA 1.467 0.728 0 N-CA-C 110.342 -1.103 . . . . 0.0 110.342 -178.557 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 91.9 p -160.05 90.01 0.89 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.726 0.298 . . . . 0.0 110.509 -179.941 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -172.34 -55.51 0.04 OUTLIER Glycine 0 CA--C 1.522 0.496 0 N-CA-C 110.655 -0.978 . . . . 0.0 110.655 179.466 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.414 ' O ' ' OG ' ' A' ' 73' ' ' SER . 6.4 m -145.6 109.74 0.96 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.44 0 CA-C-O 121.029 0.442 . . . . 0.0 110.625 -179.533 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 73' ' ' SER . . . . . 0.414 ' OG ' ' O ' ' A' ' 72' ' ' VAL . 1.9 m 172.88 -57.32 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.151 0.5 . . . . 0.0 110.085 179.553 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 99.6 mt-10 -88.37 -51.18 5.88 Favored 'General case' 0 CA--C 1.508 -0.651 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.244 -179.197 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' ASN . . . . . 0.469 ' ND2' HD12 ' A' ' 78' ' ' ILE . 2.0 p30 163.54 98.38 0.01 OUTLIER Pre-proline 0 CA--C 1.541 0.623 0 N-CA-C 109.41 -0.589 . . . . 0.0 109.41 -179.506 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 77.0 Cg_exo -43.79 -19.94 0.23 Allowed 'Trans proline' 0 N--CA 1.496 1.659 0 C-N-CA 122.505 2.137 . . . . 0.0 112.226 -179.46 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' PHE . . . . . 0.428 ' N ' ' O ' ' A' ' 75' ' ' ASN . 58.0 t80 -62.26 -52.78 62.36 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.632 -0.427 . . . . 0.0 110.711 -179.872 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 78' ' ' ILE . . . . . 0.469 HD12 ' ND2' ' A' ' 75' ' ' ASN . 94.4 mt -69.35 -46.16 77.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.427 179.819 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.479 ' O ' ' ND2' ' A' ' 171' ' ' ASN . 39.9 mt -55.57 -51.63 66.45 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.095 -178.442 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 95.6 mt-10 -63.49 -36.0 82.32 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.191 179.475 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -64.46 -40.43 95.7 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.499 179.967 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 33.9 ttmt -54.88 -19.37 6.45 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.088 0.471 . . . . 0.0 110.528 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 5.6 t -79.43 -44.65 23.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.818 179.943 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 84.7 mtp180 -62.96 -31.4 72.49 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.413 -179.672 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -67.32 -42.77 83.07 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.91 0.386 . . . . 0.0 111.274 -179.341 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 38.3 p -67.77 -21.51 65.25 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.245 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 24.5 m -59.0 -54.03 51.75 Favored 'General case' 0 C--N 1.323 -0.571 0 C-N-CA 120.506 -0.478 . . . . 0.0 111.027 -179.051 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 45.2 t -73.13 -49.18 40.12 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-O 121.057 0.456 . . . . 0.0 111.3 -179.445 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -57.18 -43.15 82.37 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.672 -178.896 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 7.1 tm-20 -56.28 -47.83 77.83 Favored 'General case' 0 C--N 1.317 -0.84 0 C-N-CA 120.404 -0.518 . . . . 0.0 110.718 -179.613 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 70.0 mmtt -59.0 -36.75 75.43 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.895 -178.97 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 87.7 t80 -56.99 -38.88 73.67 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.506 -179.926 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 49.0 t -58.03 -41.93 81.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-O 120.926 0.393 . . . . 0.0 110.173 -179.02 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 64.3 mt -54.51 -39.91 47.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.327 179.944 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -53.3 -45.32 68.93 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.631 -179.762 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 0.52 ' N ' HD12 ' A' ' 96' ' ' ILE . 1.6 mp -60.63 -44.37 96.76 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 116.311 -0.404 . . . . 0.0 109.986 -179.586 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 14.1 tm-20 -64.43 -49.36 71.81 Favored 'General case' 0 C--N 1.32 -0.71 0 C-N-CA 120.576 -0.45 . . . . 0.0 110.649 -178.995 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 83.0 tt0 -63.15 -46.48 86.99 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.58 -179.166 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 79.3 mm-40 -65.86 -35.13 79.81 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.743 -179.794 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -60.68 -41.63 95.49 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.57 -179.853 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 33.0 m -63.32 -49.07 75.43 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.643 -179.996 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 35.3 ttmt -69.32 -19.67 63.88 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.508 -179.924 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.481 ' O ' ' N ' ' A' ' 105' ' ' GLU . 41.1 tp -81.91 -16.72 49.62 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.433 -179.402 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 15.3 ttmm -66.25 62.7 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.815 0.34 . . . . 0.0 110.912 -179.088 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 105' ' ' GLU . . . . . 0.481 ' N ' ' O ' ' A' ' 103' ' ' LEU . 80.0 tt0 -113.12 -70.12 0.82 Allowed 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.676 -0.49 . . . . 0.0 109.676 179.926 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -89.88 -33.84 16.3 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.126 179.594 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 59.66 50.2 70.31 Favored Glycine 0 CA--C 1.526 0.764 0 N-CA-C 111.12 -0.792 . . . . 0.0 111.12 179.918 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 108' ' ' SER . . . . . 0.432 ' OG ' ' N ' ' A' ' 109' ' ' SER . 95.5 p -56.63 -109.07 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.818 0.342 . . . . 0.0 110.516 -179.912 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 109' ' ' SER . . . . . 0.432 ' N ' ' OG ' ' A' ' 108' ' ' SER . 54.4 p -171.39 -60.06 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.816 0.341 . . . . 0.0 110.507 179.839 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -62.55 -31.38 79.58 Favored Glycine 0 CA--C 1.521 0.425 0 N-CA-C 110.876 -0.89 . . . . 0.0 110.876 -179.961 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 44.9 tp10 -53.72 -45.61 70.52 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.864 0.364 . . . . 0.0 110.368 -179.544 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 65.1 m-85 -65.23 -41.17 94.65 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.575 -179.869 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 6.1 t -57.17 -33.28 67.27 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.499 -179.725 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -61.9 -35.89 79.69 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.452 -179.92 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 28.9 tpp -66.4 -47.65 72.61 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.958 0.409 . . . . 0.0 110.91 -179.871 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 37.1 t80 -51.12 -32.17 21.82 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.548 -179.542 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 63.6 t0 -60.05 -44.71 94.5 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.756 -179.889 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.472 ' N ' HD12 ' A' ' 118' ' ' LEU . 10.8 mp -58.33 -39.21 78.84 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.289 -0.414 . . . . 0.0 109.922 -179.222 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 13.4 tpt -61.84 -32.29 72.61 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.365 179.941 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 120' ' ' PHE . . . . . 0.566 ' CZ ' ' NZ ' ' A' ' 124' ' ' LYS . 14.6 t80 -77.42 -46.01 24.01 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.353 0.597 . . . . 0.0 111.035 -179.851 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -59.91 -42.46 93.92 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.699 -178.424 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 122' ' ' VAL . . . . . 0.432 ' O ' HD13 ' A' ' 126' ' ' LEU . 11.1 p -74.53 -25.86 19.62 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.385 0 CA-C-O 120.942 0.401 . . . . 0.0 110.687 -179.785 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 11.5 t -65.47 -21.08 66.6 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 116.611 -0.268 . . . . 0.0 111.193 179.912 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 124' ' ' LYS . . . . . 0.566 ' NZ ' ' CZ ' ' A' ' 120' ' ' PHE . 5.1 mptt -71.3 -59.31 3.33 Favored Pre-proline 0 C--N 1.324 -0.511 0 N-CA-C 112.139 0.422 . . . . 0.0 112.139 -178.906 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 125' ' ' PRO . . . . . 0.481 ' HD2' ' N ' ' A' ' 124' ' ' LYS . 18.6 Cg_endo -56.6 -32.01 88.84 Favored 'Trans proline' 0 C--N 1.309 -1.506 0 C-N-CA 122.204 1.936 . . . . 0.0 112.106 -178.036 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.432 HD13 ' O ' ' A' ' 122' ' ' VAL . 7.4 mp -60.98 -39.61 90.28 Favored 'General case' 0 CA--C 1.51 -0.57 0 CA-C-N 116.431 -0.349 . . . . 0.0 110.552 -179.839 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -44.69 -28.71 0.65 Allowed 'General case' 0 C--N 1.318 -0.791 0 CA-C-O 120.922 0.391 . . . . 0.0 110.923 179.858 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 128' ' ' LYS . . . . . 0.484 ' C ' HD22 ' A' ' 129' ' ' LEU . 97.9 mttt -64.99 -8.55 16.35 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.83 -179.399 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.49 HD22 ' N ' ' A' ' 129' ' ' LEU . 4.2 mm? -102.75 -10.35 19.24 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.604 -179.663 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 83.65 17.61 65.64 Favored Glycine 0 CA--C 1.52 0.381 0 N-CA-C 110.438 -1.065 . . . . 0.0 110.438 179.684 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 131' ' ' ILE . . . . . 0.72 HG22 ' O ' ' A' ' 131' ' ' ILE . 81.4 mt -77.82 15.36 0.25 Allowed 'Isoleucine or valine' 0 CA--C 1.518 -0.27 0 N-CA-C 110.038 -0.356 . . . . 0.0 110.038 -179.835 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 132' ' ' GLN . . . . . 0.531 ' C ' ' O ' ' A' ' 131' ' ' ILE . 59.1 tt0 -25.84 122.9 0.07 Allowed 'General case' 0 CA--C 1.507 -0.694 0 CA-C-O 118.941 -0.552 . . . . 0.0 109.666 179.968 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 133' ' ' GLU . . . . . 0.503 ' CB ' ' O ' ' A' ' 132' ' ' GLN . 8.6 mm-40 148.22 -21.95 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.201 0 O-C-N 124.677 1.236 . . . . 0.0 110.343 -178.858 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 134' ' ' MET . . . . . 0.502 ' O ' HG12 ' A' ' 138' ' ' VAL . 24.6 mmt -62.01 -61.92 2.15 Favored 'General case' 0 C--N 1.319 -0.724 0 C-N-CA 120.849 -0.341 . . . . 0.0 111.138 -178.378 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 71.4 p -56.96 -30.38 64.02 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.834 -178.799 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 50.8 mtmt -82.69 -52.81 6.44 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.347 -179.745 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 137' ' ' THR . . . . . 0.42 ' CG2' ' NZ ' ' A' ' 159' ' ' LYS . 30.2 m -60.57 -46.12 91.41 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.857 -179.023 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 138' ' ' VAL . . . . . 0.502 HG12 ' O ' ' A' ' 134' ' ' MET . 9.0 p -61.4 -40.61 86.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-O 121.051 0.453 . . . . 0.0 110.68 -178.92 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 139' ' ' SER . . . . . 0.45 ' N ' HG13 ' A' ' 138' ' ' VAL . 23.7 t -72.5 -36.37 68.36 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.648 -179.841 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 84.7 m-20 -64.74 -30.18 71.18 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.64 -179.589 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -74.97 -28.23 60.49 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.81 -179.924 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -64.57 -34.09 77.44 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.114 -179.283 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 94.9 mt-10 -70.8 -36.91 73.22 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.743 0.306 . . . . 0.0 110.834 -179.422 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 47.6 tp10 -74.05 -43.49 57.64 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.012 -179.475 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 145' ' ' ASN . . . . . . . . . . . . . 33.5 m120 -144.28 82.68 10.53 Favored Pre-proline 0 N--CA 1.466 0.349 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.197 -179.53 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 146' ' ' PRO . . . . . 0.456 ' O ' ' N ' ' A' ' 148' ' ' THR . 24.4 Cg_endo -61.02 113.05 1.56 Allowed 'Trans proline' 0 N--CA 1.493 1.446 0 C-N-CA 122.394 2.063 . . . . 0.0 111.694 -178.846 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 147' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_exo -45.79 87.61 0.02 OUTLIER 'Trans proline' 0 N--CA 1.493 1.489 0 C-N-CA 122.397 2.065 . . . . 0.0 112.786 -179.364 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 148' ' ' THR . . . . . 0.456 ' N ' ' O ' ' A' ' 146' ' ' PRO . 31.2 m -111.56 -15.43 13.5 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.335 179.284 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 149' ' ' THR . . . . . 0.634 HG22 ' N ' ' A' ' 150' ' ' ALA . 30.8 m -138.8 172.27 13.11 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.639 179.845 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 150' ' ' ALA . . . . . 0.634 ' N ' HG22 ' A' ' 149' ' ' THR . . . -58.88 -47.72 83.95 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.304 179.986 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 76.4 mt-30 -62.76 -29.61 70.82 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.021 0.439 . . . . 0.0 110.394 -179.851 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . -58.38 -42.28 95.59 Favored Glycine 0 CA--C 1.524 0.6 0 N-CA-C 110.691 -0.964 . . . . 0.0 110.691 179.792 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 153' ' ' VAL . . . . . . . . . . . . . 47.3 t -67.67 -41.48 85.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-O 120.834 0.349 . . . . 0.0 110.505 -179.986 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 8.4 mp -50.95 -38.51 51.02 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.256 -179.374 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -60.96 -47.57 85.83 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 179.12 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 156' ' ' ILE . . . . . 0.809 HG22 ' SD ' ' A' ' 160' ' ' MET . 15.3 mm -65.36 -43.57 94.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.034 -179.777 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -53.03 -51.46 61.66 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.247 179.923 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -62.58 -43.99 97.42 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.164 179.495 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 159' ' ' LYS . . . . . 0.42 ' NZ ' ' CG2' ' A' ' 137' ' ' THR . 63.2 tttm -65.11 -29.77 70.66 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.371 179.945 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 160' ' ' MET . . . . . 0.809 ' SD ' HG22 ' A' ' 156' ' ' ILE . 5.4 mtp -71.01 -53.27 15.36 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.48 -179.49 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 73.5 ttt-85 -67.8 -35.65 79.03 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.473 179.847 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 80.1 tt0 -66.97 -47.87 70.25 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.817 -179.08 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 163' ' ' LYS . . . . . 0.42 ' HZ1' ' HB3' ' A' ' 133' ' ' GLU . 1.2 tmtp? -65.97 -33.97 77.02 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.18 -179.394 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 5.8 mt -70.28 -26.61 63.89 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.657 179.942 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 46.5 tp60 -67.21 -35.73 80.22 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.472 -179.155 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 10.7 tpt180 -62.49 -28.49 69.86 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.37 0.605 . . . . 0.0 110.575 -179.187 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 167' ' ' VAL . . . . . . . . . . . . . 48.3 t -68.18 -44.01 84.52 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 CA-C-N 115.242 -0.89 . . . . 0.0 110.39 -179.708 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 168' ' ' HIS . . . . . 0.503 ' O ' ' ND1' ' A' ' 168' ' ' HIS . 20.6 t-80 -78.15 -28.83 48.44 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.636 -179.967 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 169' ' ' THR . . . . . . . . . . . . . 23.7 m -73.2 -46.68 49.06 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.301 -0.408 . . . . 0.0 111.156 -179.697 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -58.83 -43.86 90.79 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.555 -179.077 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 171' ' ' ASN . . . . . 0.479 ' ND2' ' O ' ' A' ' 79' ' ' LEU . 20.1 t-20 -72.03 -33.11 67.76 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.62 179.916 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 172' ' ' TYR . . . . . . . . . . . . . 80.7 t80 -75.18 -29.33 60.36 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.786 -179.629 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 11.5 t -74.35 -34.55 63.42 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.046 -179.511 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 26.2 p -73.04 -35.68 66.77 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.967 -179.268 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 87.0 mt -77.72 -53.1 7.93 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.521 -178.843 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 16.2 ptmt -56.24 -21.72 25.28 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 121.183 0.516 . . . . 0.0 110.37 -179.265 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 177' ' ' LYS . . . . . . . . . . . . . 56.2 tttp -66.38 -13.67 60.98 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.236 -179.966 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 178' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -81.23 -15.31 56.0 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.857 -179.922 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -55.37 -44.36 75.95 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.505 -179.89 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 180' ' ' ASN . . . . . . . . . . . . . 82.2 m-20 -99.18 -84.64 0.4 Allowed 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.095 179.373 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 181' ' ' SER . . . . . 0.524 ' OG ' ' N ' ' A' ' 182' ' ' THR . 2.4 t 171.9 -101.55 0.0 OUTLIER 'General case' 0 C--N 1.333 -0.132 0 N-CA-C 109.974 -0.38 . . . . 0.0 109.974 179.846 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 182' ' ' THR . . . . . 0.524 ' N ' ' OG ' ' A' ' 181' ' ' SER . 68.2 p -150.03 39.43 0.77 Allowed 'General case' 0 N--CA 1.462 0.159 0 CA-C-O 120.868 0.366 . . . . 0.0 110.399 -179.486 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 183' ' ' PHE . . . . . 0.485 ' CD1' ' N ' ' A' ' 184' ' ' THR . 23.0 t80 -55.32 152.99 7.66 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.285 -179.746 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 184' ' ' THR . . . . . 0.485 ' N ' ' CD1' ' A' ' 183' ' ' PHE . 5.6 m -70.46 60.48 0.21 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.713 -179.8 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 185' ' ' ASP . . . . . . . . . . . . . 59.2 m-20 -159.21 -66.21 0.08 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.943 0.401 . . . . 0.0 110.394 179.985 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 186' ' ' GLU . . . . . 0.402 ' HG2' ' H ' ' A' ' 186' ' ' GLU . 5.3 pt-20 -65.14 122.48 17.18 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.59 -179.716 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 7.0 mtpm? -144.91 11.62 1.4 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.497 179.877 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 188' ' ' CYS . . . . . . . . . . . . . 12.0 t 56.05 37.3 28.7 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.567 179.793 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 189' ' ' LYS . . . . . . . . . . . . . 63.5 tttm -69.08 136.31 52.11 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.405 -179.843 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 190' ' ' ASN . . . . . . . . . . . . . 29.6 t30 -68.07 140.88 56.27 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.553 179.899 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 191' ' ' ASN . . . . . . . . . . . . . 90.5 m-20 . . . . . 0 C--O 1.22 -0.471 0 CA-C-O 117.979 -1.01 . . . . 0.0 110.512 -179.973 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.226 -0.166 0 CA-C-O 120.667 0.27 . . . . 0.0 110.441 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 9.9 m -61.84 -36.3 80.78 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.844 -179.683 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 23.4 tptm -65.11 -57.27 9.04 Favored 'General case' 0 N--CA 1.447 -0.578 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.079 -179.709 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 22.1 pt -62.39 -28.64 45.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.331 -179.578 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 78.8 ttt180 -65.35 -42.27 93.0 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.161 0.505 . . . . 0.0 110.497 179.798 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 17.0 mt -71.89 -32.86 67.85 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.065 -179.9 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 37.7 tp10 -62.48 -51.07 68.91 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.88 -179.551 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 89.3 mtm180 -67.37 -40.62 85.74 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.508 -179.507 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 26.8 t -67.83 -25.21 65.45 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.714 -179.751 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -75.66 -40.3 56.24 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.728 179.681 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -58.41 -39.66 80.34 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.817 -179.595 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 20.1 m-20 -58.14 -22.05 49.47 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 121.059 0.457 . . . . 0.0 110.766 -179.389 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 8.9 mm -64.79 -56.15 17.41 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.953 0 N-CA-C 112.244 0.461 . . . . 0.0 112.244 -178.865 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 52.5 p -76.34 -36.03 58.45 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.559 -179.878 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 95.8 m-20 -64.56 -35.14 80.02 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.688 -177.623 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 56.4 mm-40 -73.25 -57.82 3.75 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.745 -179.588 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.57 HG22 ' HA ' ' A' ' 85' ' ' ALA . 16.0 pt -60.03 -26.94 37.56 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.755 0 O-C-N 123.428 0.455 . . . . 0.0 110.879 -179.37 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 65.3 m-20 -66.54 -38.53 87.35 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.365 -179.567 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -53.9 -27.47 30.7 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.209 -179.288 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 66.3 mt -62.49 -47.47 92.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.118 179.689 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 63.8 mttp -58.76 -39.54 81.28 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.101 -179.465 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 71.6 mmtt -64.85 -44.22 90.48 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.558 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -67.12 -35.49 79.87 Favored 'General case' 0 C--O 1.224 -0.268 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.48 179.822 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -63.69 -29.02 70.3 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.673 -179.844 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -58.66 -35.28 72.31 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.792 -179.526 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.504 ' N ' HD12 ' A' ' 55' ' ' LEU . 10.0 mp . . . . . 0 C--N 1.325 -0.464 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.511 -178.521 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . 0.592 ' N ' HD22 ' A' ' 75' ' ' ASN . 0.0 OUTLIER . . . . . 0 C--O 1.236 0.386 0 N-CA-C 111.103 0.038 . . . . 0.0 111.103 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_exo -51.05 0.03 0.04 OUTLIER 'Trans proline' 0 C--N 1.312 -1.374 0 C-N-CA 122.611 2.207 . . . . 0.0 111.856 -178.572 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . 0.578 ' H ' ' C ' ' A' ' 75' ' ' ASN . 67.8 t80 -61.03 -49.46 77.33 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 116.561 -0.29 . . . . 0.0 110.709 -179.542 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 66.3 mt -64.17 -51.95 62.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.368 -179.854 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.523 ' N ' HD12 ' A' ' 79' ' ' LEU . 10.5 mp -56.52 -53.23 59.93 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.171 -178.616 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 94.9 mt-10 -62.68 -38.92 92.28 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 123.334 0.396 . . . . 0.0 110.221 179.911 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -63.39 -41.47 98.76 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.364 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 35.9 ttmt -52.53 -18.58 1.77 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 121.19 0.519 . . . . 0.0 110.776 -179.597 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 25.4 t -85.51 -48.38 16.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.485 179.722 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 84.4 mtt85 -64.97 -30.27 71.25 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.46 -179.585 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . 0.57 ' HA ' HG22 ' A' ' 46' ' ' ILE . . . -70.39 -45.75 65.38 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.748 -179.497 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' THR . . . . . 0.415 ' CB ' HG21 ' A' ' 167' ' ' VAL . 74.2 p -77.6 -11.97 59.92 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.458 -179.163 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 85.6 m -60.34 -52.1 66.68 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.129 -178.736 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.449 HG13 ' N ' ' A' ' 89' ' ' ALA . 11.7 p -69.8 -39.55 77.98 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.77 -179.407 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . 0.449 ' N ' HG13 ' A' ' 88' ' ' VAL . . . -61.97 -39.17 91.24 Favored 'General case' 0 C--O 1.223 -0.341 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.107 -178.695 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 38.4 tp10 -50.23 -54.96 17.42 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.852 -179.807 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 9.2 mtmp? -52.58 -34.89 52.59 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.69 -179.504 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.432 ' O ' ' HB3' ' A' ' 95' ' ' ALA . 43.4 t80 -59.17 -43.59 92.15 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.725 -179.248 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 90.6 t -56.76 -47.71 82.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.453 -178.696 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 67.0 mt -53.42 -38.0 31.29 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.104 -179.904 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . 0.432 ' HB3' ' O ' ' A' ' 92' ' ' PHE . . . -52.58 -43.38 65.24 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.458 -179.491 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . 0.546 ' N ' HD12 ' A' ' 96' ' ' ILE . 1.7 mp -62.16 -44.86 99.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.417 -179.955 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 7.7 tm-20 -61.39 -50.07 74.33 Favored 'General case' 0 C--N 1.323 -0.56 0 O-C-N 123.442 0.464 . . . . 0.0 110.214 -178.616 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 78.4 tt0 -66.06 -39.72 90.32 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.34 -179.47 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 80.2 tt0 -67.54 -32.79 73.82 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.562 -179.676 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -57.49 -40.17 78.03 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.518 -179.496 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 20.2 m -61.69 -47.62 84.49 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.54 179.871 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 64.1 mttp -74.69 -24.64 58.81 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.376 -179.724 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 37.4 tp . . . . . 0 CA--C 1.508 -0.638 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.933 -179.739 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 80.7 p . . . . . 0 C--O 1.232 0.155 0 CA-C-O 120.702 0.287 . . . . 0.0 110.86 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -61.66 -45.45 96.26 Favored Glycine 0 CA--C 1.522 0.505 0 N-CA-C 111.191 -0.764 . . . . 0.0 111.191 -179.826 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 10.5 mm-40 -70.56 -44.05 68.24 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.708 0.29 . . . . 0.0 110.709 -179.646 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 61.5 m-85 -65.52 -36.61 84.34 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.536 -179.938 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 55.1 m -53.87 -33.95 57.97 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.385 179.813 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -65.57 -28.43 69.14 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.416 179.693 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 63.0 mmm -73.78 -41.96 61.69 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.876 -179.792 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 33.6 t80 -64.99 -34.54 78.69 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.439 179.911 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 45.4 t0 -56.67 -46.52 81.08 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.169 -179.346 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 83.6 mt -55.42 -39.01 69.72 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.519 179.761 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 119' ' ' MET . . . . . 0.434 ' C ' ' SD ' ' A' ' 119' ' ' MET . 0.0 OUTLIER -60.63 -53.98 50.86 Favored 'General case' 0 C--N 1.318 -0.769 0 O-C-N 123.544 0.527 . . . . 0.0 110.393 -179.831 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 67.1 t80 -60.77 -47.5 86.02 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.901 -178.76 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 78.9 mm-40 -56.56 -39.74 73.97 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.818 -179.726 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 69.7 t -81.19 -23.69 10.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.582 179.785 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 53.2 p -70.84 -23.0 62.26 Favored 'General case' 0 C--N 1.309 -1.171 0 CA-C-N 116.572 -0.285 . . . . 0.0 110.928 -179.783 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . 0.49 ' CB ' ' HD3' ' A' ' 125' ' ' PRO . 16.8 mtmt -72.04 -56.55 4.43 Favored Pre-proline 0 C--N 1.329 -0.297 0 C-N-CA 120.755 -0.378 . . . . 0.0 111.445 -178.71 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 125' ' ' PRO . . . . . 0.49 ' HD3' ' CB ' ' A' ' 124' ' ' LYS . 54.0 Cg_exo -49.22 -44.98 31.68 Favored 'Trans proline' 0 C--N 1.304 -1.787 0 C-N-CA 122.351 2.034 . . . . 0.0 112.172 178.237 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.486 HD22 ' N ' ' A' ' 126' ' ' LEU . 4.3 mm? -70.38 -21.92 62.81 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.24 179.764 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 4.7 tm0? -63.31 -47.37 82.55 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.746 -179.672 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 99.7 mttt -53.58 -44.73 69.58 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 -178.461 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.525 HD23 ' O ' ' A' ' 129' ' ' LEU . 1.1 tt -63.72 -45.08 91.55 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 121.295 0.569 . . . . 0.0 110.556 179.566 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 99.2 90.54 2.01 Favored Glycine 0 N--CA 1.462 0.428 0 N-CA-C 110.815 -0.914 . . . . 0.0 110.815 -179.865 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 131' ' ' ILE . . . . . 0.4 ' O ' ' CG ' ' A' ' 132' ' ' GLN . 47.3 mm -105.81 -71.56 0.7 Allowed 'Isoleucine or valine' 0 CA--C 1.507 -0.699 0 N-CA-C 111.5 0.185 . . . . 0.0 111.5 179.391 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 132' ' ' GLN . . . . . 0.4 ' CG ' ' O ' ' A' ' 131' ' ' ILE . 56.7 mt-30 -159.75 -166.93 1.86 Allowed 'General case' 0 C--N 1.327 -0.393 0 O-C-N 123.511 0.507 . . . . 0.0 110.821 -179.898 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 92.8 mt-10 -88.09 44.44 1.2 Allowed 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 116.184 -0.462 . . . . 0.0 109.81 179.895 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 44.6 tpp -59.21 -58.91 6.54 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.157 -178.833 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 23.3 p -46.42 -26.79 0.91 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.522 -179.14 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 62.4 mttp -90.56 -45.12 9.12 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.007 178.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 75.7 m -61.17 -43.56 98.68 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.73 -178.964 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 138' ' ' VAL . . . . . 0.453 HG13 ' N ' ' A' ' 139' ' ' SER . 9.8 p -65.55 -40.88 89.46 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.74 -179.156 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 139' ' ' SER . . . . . 0.453 ' N ' HG13 ' A' ' 138' ' ' VAL . 34.2 t -75.48 -34.09 60.86 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.2 -179.278 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 64.6 t0 -64.11 -28.55 69.85 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.322 0.582 . . . . 0.0 110.642 -179.762 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -73.11 -24.91 60.68 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.945 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -59.58 -33.39 71.38 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.015 0.436 . . . . 0.0 111.0 -179.032 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 143' ' ' GLU . . . . . 0.413 ' OE1' ' N ' ' A' ' 143' ' ' GLU . 38.3 mp0 -73.08 -36.34 66.81 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.5 -0.318 . . . . 0.0 111.201 179.818 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 144' ' ' GLU . . . . . 0.439 ' O ' ' ND2' ' A' ' 145' ' ' ASN . 44.6 tp10 -64.52 -48.11 76.33 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.581 -179.699 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 145' ' ' ASN . . . . . 0.439 ' ND2' ' O ' ' A' ' 144' ' ' GLU . 31.3 m120 -148.47 77.17 9.78 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.228 -179.457 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 146' ' ' PRO . . . . . . . . . . . . . 86.8 Cg_exo -42.79 105.41 0.06 OUTLIER 'Trans proline' 0 N--CA 1.483 0.86 0 C-N-CA 122.923 2.415 . . . . 0.0 112.096 -179.781 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 147' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_exo -45.26 101.66 0.04 OUTLIER 'Trans proline' 0 C--N 1.312 -1.36 0 C-N-CA 122.375 2.05 . . . . 0.0 112.556 -179.251 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 53.4 m -120.17 -13.6 8.92 Favored 'General case' 0 CA--C 1.515 -0.379 0 CA-C-O 120.928 0.394 . . . . 0.0 110.409 179.504 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 149' ' ' THR . . . . . 0.659 HG22 ' N ' ' A' ' 150' ' ' ALA . 50.1 m -136.99 171.19 14.88 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.961 0.41 . . . . 0.0 110.621 179.801 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 150' ' ' ALA . . . . . 0.659 ' N ' HG22 ' A' ' 149' ' ' THR . . . -58.43 -40.39 82.4 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.789 179.798 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 76.1 mt-30 -66.76 -24.52 66.22 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.938 0.399 . . . . 0.0 110.831 179.804 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . -67.33 -40.27 91.82 Favored Glycine 0 CA--C 1.525 0.674 0 N-CA-C 111.155 -0.778 . . . . 0.0 111.155 -179.828 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 153' ' ' VAL . . . . . . . . . . . . . 54.3 t -68.54 -32.26 54.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-O 120.724 0.297 . . . . 0.0 110.636 -179.71 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 7.4 mp -56.56 -36.38 69.23 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.508 -179.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -60.11 -53.48 57.26 Favored 'General case' 0 C--N 1.321 -0.633 0 O-C-N 123.607 0.567 . . . . 0.0 109.863 -179.876 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 156' ' ' ILE . . . . . 0.591 ' N ' HD12 ' A' ' 156' ' ' ILE . 1.8 mp -60.38 -44.47 96.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 N-CA-C 109.91 -0.404 . . . . 0.0 109.91 -179.635 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -51.09 -51.72 50.64 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.029 -178.775 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 63.0 mttp -60.13 -41.1 91.94 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.934 0.397 . . . . 0.0 110.11 179.747 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 38.6 mmtm -64.94 -30.56 71.56 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.908 0.385 . . . . 0.0 110.763 179.503 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 160' ' ' MET . . . . . 0.406 ' O ' ' CB ' ' A' ' 164' ' ' LEU . 2.2 mtm -74.23 -53.93 8.77 Favored 'General case' 0 C--O 1.219 -0.505 0 C-N-CA 120.46 -0.496 . . . . 0.0 111.562 -179.757 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 60.8 ttp180 -62.51 -41.3 98.74 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.074 -179.105 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 68.2 mm-40 -62.82 -57.64 10.16 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.694 -179.431 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 163' ' ' LYS . . . . . . . . . . . . . 63.0 tttp -66.66 -52.97 38.9 Favored 'General case' 0 C--N 1.324 -0.52 0 O-C-N 123.5 0.5 . . . . 0.0 111.046 -179.122 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 164' ' ' LEU . . . . . 0.711 ' O ' HG22 ' A' ' 167' ' ' VAL . 53.9 tp -47.81 -37.44 13.7 Favored 'General case' 0 C--O 1.212 -0.891 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.605 -178.772 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 59.2 tt0 -68.93 -27.62 65.92 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.497 -179.662 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 57.4 ttm-85 -55.02 -22.67 16.31 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.888 -179.516 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 167' ' ' VAL . . . . . 0.711 HG22 ' O ' ' A' ' 164' ' ' LEU . 18.2 m -60.47 -42.27 90.61 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.934 0 O-C-N 124.087 0.867 . . . . 0.0 109.923 -179.526 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 168' ' ' HIS . . . . . 0.52 ' N ' HG23 ' A' ' 167' ' ' VAL . 3.5 t60 -77.38 -22.26 51.94 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.554 -179.428 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 169' ' ' THR . . . . . . . . . . . . . 23.7 m -66.35 -47.24 74.08 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.143 -179.921 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 170' ' ' LYS . . . . . 0.476 ' O ' HG23 ' A' ' 174' ' ' THR . 68.9 mttm -63.99 -47.09 81.7 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.513 -179.588 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 171' ' ' ASN . . . . . . . . . . . . . 75.3 m-20 -64.29 -39.63 94.32 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.732 179.959 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 172' ' ' TYR . . . . . . . . . . . . . 85.1 t80 -69.76 -38.6 76.82 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.93 -179.417 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 48.2 t -78.06 -42.44 32.29 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.07 -0.513 . . . . 0.0 111.054 -178.952 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 174' ' ' THR . . . . . 0.476 HG23 ' O ' ' A' ' 170' ' ' LYS . 17.4 p -59.96 -45.88 91.23 Favored 'General case' 0 C--O 1.216 -0.688 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.005 -179.293 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 76.4 mt -63.11 -31.71 72.92 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.21 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 29.9 mttt -64.35 -5.67 5.61 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.933 -179.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 177' ' ' LYS . . . . . . . . . . . . . 20.8 ptmt -58.81 -31.2 68.23 Favored 'General case' 0 C--N 1.318 -0.791 0 O-C-N 123.423 0.452 . . . . 0.0 110.315 -179.252 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 178' ' ' LYS . . . . . . . . . . . . . 16.7 mmmt . . . . . 0 N--CA 1.453 -0.301 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.806 -179.795 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.051 0 CA-C-O 120.588 0.232 . . . . 0.0 111.172 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 11.8 m -58.26 -45.6 87.52 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.647 -179.363 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 13.2 tppt? -63.37 -54.19 40.66 Favored 'General case' 0 N--CA 1.442 -0.871 0 C-N-CA 120.406 -0.517 . . . . 0.0 110.942 179.766 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 97.0 mt -59.79 -42.48 89.02 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 N-CA-C 109.373 -0.603 . . . . 0.0 109.373 -178.479 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 72.1 ttt-85 -61.88 -37.6 85.15 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.872 0.368 . . . . 0.0 110.745 -179.431 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 36.1 mt -67.44 -39.81 85.43 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.548 -0.296 . . . . 0.0 111.431 178.961 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 82.3 tt0 -68.3 -44.96 74.31 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.32 -179.766 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 71.7 ttt-85 -65.95 -44.16 85.82 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.357 179.927 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 15.4 m -69.74 -34.03 73.27 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.681 -179.911 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -72.01 -41.54 67.46 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.869 179.993 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -59.53 -31.33 69.3 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.527 -179.79 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 81.1 m-20 -68.15 -22.78 64.84 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.085 0.469 . . . . 0.0 110.807 -178.924 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 68.6 mt -65.89 -53.94 32.67 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.417 -179.457 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 71.0 p -76.01 -35.62 59.47 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.086 0.47 . . . . 0.0 111.274 -179.014 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 67.0 t0 -65.61 -39.97 92.11 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.745 -177.948 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 59.1 mm-40 -68.2 -51.16 48.68 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.95 -179.326 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 8.0 pt -67.68 -27.26 37.54 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.728 0 O-C-N 123.645 0.591 . . . . 0.0 110.694 -179.335 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 12.2 m-20 -62.43 -42.02 99.14 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.133 -179.892 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -52.28 -29.68 24.4 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.136 -179.179 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 57.1 mt -66.01 -43.28 92.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.239 179.363 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -56.15 -44.42 79.25 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 -179.004 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 5.9 mtpm? -64.56 -39.25 93.41 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.722 179.569 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 83.1 m-20 -58.61 -32.34 68.91 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.209 -179.099 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -67.0 -32.19 73.26 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.835 0.35 . . . . 0.0 110.657 179.481 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -57.01 -37.39 71.63 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.673 -179.239 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.531 HD12 ' N ' ' A' ' 55' ' ' LEU . 10.1 mp . . . . . 0 C--N 1.325 -0.471 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.524 -179.691 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 17.6 m120 . . . . . 0 N--CA 1.448 -0.552 0 N-CA-C 110.548 -0.167 . . . . 0.0 110.548 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 69.9 Cg_endo -75.66 -3.82 14.39 Favored 'Trans proline' 0 C--N 1.316 -1.138 0 C-N-CA 122.596 2.197 . . . . 0.0 111.916 179.757 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 69.6 t80 -68.88 -60.02 2.67 Favored 'General case' 0 C--N 1.319 -0.72 0 C-N-CA 120.784 -0.367 . . . . 0.0 111.383 -179.085 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 20.2 tt -76.06 -24.98 16.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.125 -179.001 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 3.3 mp -72.53 -55.0 7.64 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.742 -179.435 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -63.32 -27.94 69.66 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.24 -179.424 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -61.55 -31.47 71.51 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.584 -179.749 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 33.8 ttmt -63.45 -22.68 67.03 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.72 -179.53 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 31.2 t -70.6 -44.74 76.5 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.998 -179.785 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 81.5 mmt-85 -61.71 -35.83 79.18 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.937 -178.993 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -62.47 -47.9 81.96 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.237 -179.827 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 73.6 p -67.25 -27.34 67.13 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.694 -179.716 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 31.2 m -61.35 -54.21 46.67 Favored 'General case' 0 C--N 1.326 -0.436 0 C-N-CA 120.573 -0.451 . . . . 0.0 111.424 -178.709 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 46.2 t -71.51 -45.72 66.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.248 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -56.32 -39.86 73.47 Favored 'General case' 0 C--O 1.218 -0.554 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.7 -178.662 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 79.7 tt0 -55.14 -47.8 74.57 Favored 'General case' 0 C--N 1.319 -0.761 0 C-N-CA 120.842 -0.343 . . . . 0.0 110.574 -179.938 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 53.3 mtpt -53.81 -36.77 62.85 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.587 -179.07 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 73.8 t80 -60.44 -42.21 95.64 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.592 179.663 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 58.7 t -59.1 -48.42 86.81 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.517 -177.924 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 70.4 mt -54.33 -42.06 55.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.393 179.906 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -53.85 -35.02 61.05 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.419 -179.777 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 37.4 mm -62.53 -43.32 98.27 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.781 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 83.4 tt0 -61.22 -44.86 96.59 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.962 -179.469 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 4.0 mp0 -59.55 -37.74 79.22 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.71 -179.728 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 73.1 mm-40 -67.87 -39.14 83.78 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.526 -179.543 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -60.45 -33.96 73.3 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.343 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 97.2 m -62.28 -44.05 97.42 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.395 -179.821 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 65.2 mttp -67.04 -11.13 56.21 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.401 -179.351 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 61.2 mt . . . . . 0 CA--C 1.502 -0.879 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.625 -179.732 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 78.5 p . . . . . 0 C--O 1.231 0.085 0 CA-C-O 120.913 0.387 . . . . 0.0 110.756 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -64.92 -36.27 92.89 Favored Glycine 0 CA--C 1.522 0.501 0 N-CA-C 111.079 -0.808 . . . . 0.0 111.079 -179.769 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 12.5 tm-20 -62.31 -47.52 83.91 Favored 'General case' 0 C--N 1.325 -0.458 0 C-N-CA 120.784 -0.367 . . . . 0.0 110.812 -179.443 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 69.3 m-85 -65.21 -38.53 90.72 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.329 -179.386 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 67.3 m -56.42 -40.93 75.53 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.417 -179.839 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -66.09 -28.31 68.73 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.376 179.405 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 42.1 tpp -74.12 -53.66 9.44 Favored 'General case' 0 C--N 1.333 -0.15 0 C-N-CA 120.66 -0.416 . . . . 0.0 110.713 -179.145 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 41.1 t80 -51.26 -37.83 49.33 Favored 'General case' 0 N--CA 1.461 0.086 0 N-CA-C 110.1 -0.333 . . . . 0.0 110.1 -179.576 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 26.2 m-20 -61.93 -41.65 98.2 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.001 179.552 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.549 HD23 ' O ' ' A' ' 118' ' ' LEU . 1.2 tt -60.1 -41.55 92.78 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-O 120.933 0.397 . . . . 0.0 110.064 -179.636 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 119' ' ' MET . . . . . 0.542 ' SD ' ' SD ' ' A' ' 160' ' ' MET . 14.7 tpt -57.53 -47.69 81.33 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.536 -0.756 . . . . 0.0 109.503 -179.86 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 74.2 t80 -59.63 -43.51 93.8 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.432 -179.514 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 97.6 mt-10 -59.08 -35.74 73.9 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.716 -179.766 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 122' ' ' VAL . . . . . 0.636 ' O ' HD23 ' A' ' 126' ' ' LEU . 87.7 t -82.61 -24.31 8.76 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.662 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.399 -179.855 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 15.6 m -75.53 -27.94 58.9 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-O 121.078 0.466 . . . . 0.0 111.048 -179.324 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . 0.538 ' N ' ' HD2' ' A' ' 125' ' ' PRO . 4.0 mmtm -63.02 -58.04 18.26 Favored Pre-proline 0 C--O 1.213 -0.852 0 C-N-CA 120.563 -0.455 . . . . 0.0 112.185 -179.513 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 125' ' ' PRO . . . . . 0.538 ' HD2' ' N ' ' A' ' 124' ' ' LYS . 28.5 Cg_endo -59.8 -30.23 91.47 Favored 'Trans proline' 0 C--N 1.302 -1.893 0 C-N-CA 122.647 2.231 . . . . 0.0 112.532 -178.927 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.636 HD23 ' O ' ' A' ' 122' ' ' VAL . 3.2 mm? -60.72 -35.35 76.1 Favored 'General case' 0 C--N 1.312 -1.045 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.783 -179.635 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 127' ' ' GLN . . . . . 0.404 ' CG ' ' N ' ' A' ' 128' ' ' LYS . 8.3 pt20 -51.5 -38.15 52.61 Favored 'General case' 0 C--N 1.311 -1.108 0 O-C-N 123.825 0.703 . . . . 0.0 110.504 -179.257 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 128' ' ' LYS . . . . . 0.404 ' N ' ' CG ' ' A' ' 127' ' ' GLN . 55.6 mtpt -63.53 -10.4 17.81 Favored 'General case' 0 CA--C 1.514 -0.412 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.922 -178.582 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 15.8 mt -117.61 21.86 12.72 Favored 'General case' 0 CA--C 1.509 -0.625 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.936 179.883 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 130' ' ' GLY . . . . . 0.517 ' O ' ' C ' ' A' ' 131' ' ' ILE . . . 101.15 -121.76 7.35 Favored Glycine 0 CA--C 1.506 -0.474 0 N-CA-C 110.735 -0.946 . . . . 0.0 110.735 179.589 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 131' ' ' ILE . . . . . 0.81 HD12 ' N ' ' A' ' 131' ' ' ILE . 2.0 mp 21.79 81.78 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 CA-C-N 116.591 0.195 . . . . 0.0 111.131 -179.439 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 69.5 tp60 -106.51 74.88 1.04 Allowed 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 -178.564 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 174.81 -6.81 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 O-C-N 123.452 0.47 . . . . 0.0 110.456 179.847 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 7.5 tpt -51.21 -40.33 58.5 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.493 -179.123 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 24.8 m -73.0 -59.76 2.56 Favored 'General case' 0 C--O 1.214 -0.777 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.048 179.444 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 136' ' ' LYS . . . . . 0.41 ' H ' ' HG2' ' A' ' 136' ' ' LYS . 44.9 mmtm -43.46 -50.8 6.9 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.982 -0.377 . . . . 0.0 109.982 -178.798 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 91.5 m -58.54 -52.11 67.06 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.629 -0.428 . . . . 0.0 110.925 179.621 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 48.7 t -64.03 -44.01 97.69 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.856 179.929 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 73.9 m -64.4 -42.19 96.24 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.495 -179.397 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 19.1 m-20 -67.07 -30.53 70.61 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.46 -179.58 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -71.43 -28.29 63.87 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.826 -179.433 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 142' ' ' ALA . . . . . 0.455 ' O ' ' O ' ' A' ' 143' ' ' GLU . . . -75.07 -29.97 60.84 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.695 -179.372 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 143' ' ' GLU . . . . . 0.533 ' O ' ' N ' ' A' ' 145' ' ' ASN . 69.3 tt0 -60.48 -119.47 0.0 OUTLIER 'General case' 0 C--O 1.211 -0.956 0 CA-C-O 119.082 -0.485 . . . . 0.0 109.811 -179.382 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 144' ' ' GLU . . . . . 0.501 ' C ' ' O ' ' A' ' 143' ' ' GLU . 84.0 tt0 18.54 -82.98 0.0 OUTLIER 'General case' 0 CA--C 1.518 -0.263 0 O-C-N 123.696 0.623 . . . . 0.0 111.678 -179.599 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 145' ' ' ASN . . . . . 0.533 ' N ' ' O ' ' A' ' 143' ' ' GLU . 57.7 t30 -127.19 95.58 36.07 Favored Pre-proline 0 CA--C 1.534 0.365 0 CA-C-N 115.467 -0.788 . . . . 0.0 111.24 178.332 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 146' ' ' PRO . . . . . . . . . . . . . 69.8 Cg_exo -50.07 125.16 14.15 Favored 'Trans proline' 0 C--N 1.321 -0.915 0 C-N-CA 122.653 2.235 . . . . 0.0 112.183 179.367 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 147' ' ' PRO . . . . . 0.442 ' C ' ' H ' ' A' ' 149' ' ' THR . 68.2 Cg_endo -75.37 70.52 5.52 Favored 'Trans proline' 0 C--N 1.312 -1.395 0 C-N-CA 122.527 2.151 . . . . 0.0 112.646 -179.402 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 40.2 p -77.88 22.05 0.29 Allowed 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.352 -179.914 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 149' ' ' THR . . . . . 0.478 HG22 ' N ' ' A' ' 150' ' ' ALA . 16.6 m -137.6 163.36 31.41 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.539 179.55 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 150' ' ' ALA . . . . . 0.478 ' N ' HG22 ' A' ' 149' ' ' THR . . . -62.99 -41.39 99.56 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.609 179.432 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 87.9 mt-30 -68.31 -33.68 74.76 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.139 179.804 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . -63.77 -51.42 53.88 Favored Glycine 0 CA--C 1.526 0.724 0 N-CA-C 110.834 -0.906 . . . . 0.0 110.834 -179.843 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 153' ' ' VAL . . . . . . . . . . . . . 69.1 t -60.77 -25.01 34.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 N-CA-C 110.157 -0.312 . . . . 0.0 110.157 -179.589 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 154' ' ' LEU . . . . . 0.535 HD23 ' O ' ' A' ' 154' ' ' LEU . 1.0 OUTLIER -59.03 -39.74 82.9 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 121.133 0.492 . . . . 0.0 109.776 -179.011 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -59.84 -50.92 71.93 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 179.86 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 20.1 mm -54.31 -56.06 11.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 C-N-CA 120.789 -0.364 . . . . 0.0 110.452 -179.417 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -50.32 -49.03 54.98 Favored 'General case' 0 C--N 1.33 -0.277 0 O-C-N 123.502 0.501 . . . . 0.0 110.339 179.9 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 158' ' ' LYS . . . . . 0.459 ' NZ ' ' OE2' ' A' ' 162' ' ' GLU . 63.6 tttm -64.91 -37.28 87.11 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.445 179.004 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 61.5 tttp -66.87 -31.96 72.91 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.308 -179.82 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 160' ' ' MET . . . . . 0.542 ' SD ' ' SD ' ' A' ' 119' ' ' MET . 3.8 mtm -67.3 -44.73 78.48 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.36 179.475 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 78.1 ttt180 -65.59 -33.23 75.43 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.411 -179.888 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 162' ' ' GLU . . . . . 0.459 ' OE2' ' NZ ' ' A' ' 158' ' ' LYS . 95.7 mt-10 -71.25 -29.68 65.4 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.152 -0.477 . . . . 0.0 111.0 -179.711 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 163' ' ' LYS . . . . . . . . . . . . . 2.0 tmtm? -83.11 -42.74 17.04 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-O 121.804 0.811 . . . . 0.0 110.94 -179.104 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 6.0 mt -67.82 -30.74 70.23 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.695 -0.684 . . . . 0.0 112.016 -178.607 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 165' ' ' GLN . . . . . 0.401 ' HG3' ' O ' ' A' ' 162' ' ' GLU . 4.5 pp0? -64.28 -31.82 73.17 Favored 'General case' 0 C--N 1.314 -0.963 0 O-C-N 123.776 0.673 . . . . 0.0 110.575 -179.08 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 58.4 ttt85 -65.88 -31.28 72.13 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.049 -179.346 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 167' ' ' VAL . . . . . . . . . . . . . 21.3 t -70.04 -45.22 77.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.066 -179.836 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 14.4 t60 -77.91 -30.03 50.43 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.627 -178.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 169' ' ' THR . . . . . . . . . . . . . 97.0 m -71.39 -46.54 60.03 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.952 -179.697 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 36.2 ttpt -60.76 -44.0 97.3 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.91 -179.286 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 171' ' ' ASN . . . . . . . . . . . . . 10.7 m120 -62.35 -30.88 71.49 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.608 179.725 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 172' ' ' TYR . . . . . . . . . . . . . 43.7 t80 -73.33 -35.29 66.01 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.09 0.472 . . . . 0.0 110.732 -179.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 1.9 t -76.61 -31.52 57.48 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.803 -179.375 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 9.2 p -60.82 -48.89 79.73 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.193 -179.1 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 11.0 mp -69.38 -32.19 71.07 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.338 179.23 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 33.9 ttmt -58.84 -28.52 66.14 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.091 -179.693 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 177' ' ' LYS . . . . . . . . . . . . . 58.9 tttm -55.48 -28.84 56.94 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.426 179.659 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 178' ' ' LYS . . . . . . . . . . . . . 25.2 mmtp . . . . . 0 C--N 1.324 -0.539 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.441 -179.119 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.221 -0.426 0 CA-C-O 121.531 0.681 . . . . 0.0 110.822 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 88.9 m -46.2 -34.31 4.26 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.369 -178.551 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 18.6 mmtp -64.25 -24.01 67.51 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.468 179.811 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 44.2 mm -62.0 -42.53 95.2 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.887 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 -179.073 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 45.0 ttm180 -63.32 -42.77 99.03 Favored 'General case' 0 C--N 1.321 -0.668 0 O-C-N 123.488 0.493 . . . . 0.0 110.141 -179.845 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 41.5 mt -66.66 -37.11 84.13 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.441 -179.765 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 80.4 tt0 -62.58 -45.51 92.6 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.6 -179.381 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -66.59 -40.82 89.09 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.329 179.937 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 83.5 p -73.49 -22.76 60.05 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.449 179.824 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -70.09 -49.54 49.9 Favored 'General case' 0 C--O 1.224 -0.27 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.768 -179.807 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 65.3 tttp -54.78 -42.68 72.05 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.567 -179.86 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . 0.413 ' OD1' ' N ' ' A' ' 41' ' ' ASP . 2.0 m-20 -50.44 -23.51 2.48 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.642 -179.336 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 72.2 mt -63.71 -50.89 75.96 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.094 -179.703 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 76.0 p -76.03 -38.51 57.15 Favored 'General case' 0 C--O 1.223 -0.3 0 CA-C-O 121.406 0.622 . . . . 0.0 110.797 -178.686 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 48.2 t0 -61.86 -35.99 79.93 Favored 'General case' 0 CA--C 1.519 -0.239 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.66 -177.472 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 66.1 mm-40 -71.26 -53.32 14.74 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.24 -179.76 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 9.3 pt -69.34 -31.84 51.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.706 -178.879 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 35.5 t0 -63.76 -29.45 70.66 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.181 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -67.31 -36.03 80.65 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.411 -0.358 . . . . 0.0 110.709 -179.763 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 70.4 mt -59.21 -48.42 86.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.137 -179.07 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 9.4 mtmp? -64.76 -36.4 84.19 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.469 179.707 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -62.74 -44.33 96.5 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.998 -0.547 . . . . 0.0 110.536 -179.688 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 60.1 m-20 -77.14 -35.34 56.23 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 116.511 -0.313 . . . . 0.0 110.896 -179.95 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -70.26 -38.81 75.2 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.799 -179.895 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . 0.526 ' O ' ' C ' ' A' ' 55' ' ' LEU . . . -50.79 -52.67 38.72 Favored 'General case' 0 CA--C 1.501 -0.936 0 CA-C-O 118.832 -0.604 . . . . 0.0 111.093 -178.929 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.53 ' H ' ' CD2' ' A' ' 55' ' ' LEU . 4.5 mm? . . . . . 0 CA--C 1.497 -1.095 0 O-C-N 124.423 1.077 . . . . 0.0 111.469 -179.744 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . 0.639 ' N ' HD22 ' A' ' 75' ' ' ASN . 0.0 OUTLIER . . . . . 0 CA--C 1.544 0.717 0 CA-C-O 119.817 -0.135 . . . . 0.0 110.858 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -51.14 -1.22 0.05 OUTLIER 'Trans proline' 0 C--N 1.31 -1.454 0 C-N-CA 122.564 2.176 . . . . 0.0 112.2 -179.038 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . 0.557 ' H ' ' C ' ' A' ' 75' ' ' ASN . 20.1 m-85 -66.79 -46.93 73.71 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-O 120.668 0.271 . . . . 0.0 110.662 -179.763 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 77.4 mt -72.17 -32.64 43.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-O 121.127 0.489 . . . . 0.0 110.358 -179.248 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.687 HD22 ' N ' ' A' ' 79' ' ' LEU . 3.2 mm? -66.88 -48.31 69.16 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.801 -178.723 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -69.31 -27.13 65.11 Favored 'General case' 0 C--N 1.317 -0.836 0 O-C-N 123.698 0.624 . . . . 0.0 109.969 179.664 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -79.24 -19.56 50.37 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.086 0.47 . . . . 0.0 110.837 179.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . 0.47 ' NZ ' ' CG2' ' A' ' 167' ' ' VAL . 53.1 tttm -70.5 -46.34 63.88 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.606 -179.499 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 16.4 m -71.59 -38.11 66.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.494 179.807 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -62.6 -38.64 90.95 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.662 -179.754 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -58.97 -42.26 89.5 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.698 -179.811 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 33.3 p -81.33 -20.0 41.65 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.706 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 85.9 m -62.09 -53.11 60.1 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 120.666 -0.413 . . . . 0.0 110.984 -178.471 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 48.9 t -69.37 -41.3 80.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 121.147 0.499 . . . . 0.0 110.639 -179.427 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -62.96 -36.81 84.71 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.769 -178.859 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 79.2 tt0 -54.94 -31.35 60.38 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.637 -179.906 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 63.8 mttp -66.51 -36.2 82.13 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.565 -179.969 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 87.6 t80 -62.35 -60.65 3.25 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.429 -178.624 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 16.5 m -51.65 -40.99 27.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-O 121.093 0.473 . . . . 0.0 110.602 -178.72 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 49.3 mt -57.04 -41.79 78.13 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 N-CA-C 109.783 -0.451 . . . . 0.0 109.783 -179.94 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.99 -36.56 79.76 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.081 -179.77 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 30.5 mm -63.87 -43.94 97.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.535 -179.857 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 75.7 tt0 -58.34 -46.78 85.59 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.358 -179.404 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -70.74 -35.44 72.68 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.97 0.414 . . . . 0.0 110.793 -179.48 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 47.8 tp10 -62.75 -46.67 86.99 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.686 -179.27 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -56.12 -38.62 71.05 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.877 0.37 . . . . 0.0 110.478 -179.17 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 19.5 m -61.64 -41.86 98.09 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.653 -179.652 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -64.38 -40.76 96.45 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.912 -178.826 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 33.9 mt . . . . . 0 C--O 1.2 -1.542 0 CA-C-O 116.993 -1.479 . . . . 0.0 111.013 -178.702 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 77.9 p . . . . . 0 N--CA 1.457 -0.122 0 CA-C-O 120.79 0.329 . . . . 0.0 110.555 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -63.61 -40.69 98.92 Favored Glycine 0 CA--C 1.524 0.62 0 N-CA-C 111.127 -0.789 . . . . 0.0 111.127 -179.548 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -67.58 -41.58 83.92 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.649 0.261 . . . . 0.0 110.586 -179.801 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 40.8 m-85 -63.06 -39.57 95.12 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.35 179.923 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 36.9 t -55.2 -38.21 68.09 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.144 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -69.88 -24.08 63.36 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.624 178.923 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 36.8 tpp -76.68 -45.79 28.29 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.063 -179.841 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 37.3 t80 -64.11 -36.24 83.37 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.877 0.37 . . . . 0.0 110.26 -179.374 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -65.6 -29.34 69.92 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.382 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.572 HD23 ' O ' ' A' ' 118' ' ' LEU . 3.1 tt -64.18 -49.3 72.57 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 122.134 0.969 . . . . 0.0 110.723 -179.564 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 15.8 tpt -50.54 -41.64 54.25 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.146 -179.29 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 51.9 t80 -60.29 -41.97 94.48 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.059 0.457 . . . . 0.0 111.326 -179.83 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -58.98 -51.95 67.87 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.913 -178.991 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 29.1 m -72.94 -24.0 20.77 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-O 121.096 0.474 . . . . 0.0 110.856 -179.431 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 40.5 t -61.55 -27.18 68.44 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.454 -179.906 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . 0.45 ' CB ' ' CD ' ' A' ' 125' ' ' PRO . 16.2 mmtt -64.47 -59.19 11.29 Favored Pre-proline 0 C--O 1.222 -0.391 0 C-N-CA 120.575 -0.45 . . . . 0.0 111.775 -179.19 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 125' ' ' PRO . . . . . 0.45 ' CD ' ' CB ' ' A' ' 124' ' ' LYS . 61.1 Cg_exo -41.22 -36.89 2.69 Favored 'Trans proline' 0 C--N 1.306 -1.695 0 C-N-CA 122.537 2.158 . . . . 0.0 112.199 178.039 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 31.7 mt -67.52 -22.86 65.42 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.068 -179.438 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 127' ' ' GLN . . . . . 0.477 ' C ' ' H ' ' A' ' 129' ' ' LEU . 84.3 mt-30 -66.13 -50.93 62.3 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.995 0.426 . . . . 0.0 110.922 -179.621 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 73.8 mmtt -55.01 -6.11 0.12 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.609 179.713 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.477 ' H ' ' C ' ' A' ' 127' ' ' GLN . 12.1 mt -118.08 19.25 13.66 Favored 'General case' 0 N--CA 1.465 0.299 0 O-C-N 123.451 0.47 . . . . 0.0 110.826 179.328 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 130' ' ' GLY . . . . . 0.544 ' O ' ' HB ' ' A' ' 131' ' ' ILE . . . 73.02 -177.13 42.73 Favored Glycine 0 CA--C 1.493 -1.333 0 N-CA-C 109.608 -1.397 . . . . 0.0 109.608 179.623 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 131' ' ' ILE . . . . . 0.919 ' O ' ' O ' ' A' ' 132' ' ' GLN . 60.9 mt 85.7 -20.91 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.476 -1.893 0 CA-C-O 116.996 -1.478 . . . . 0.0 110.78 178.576 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 132' ' ' GLN . . . . . 0.919 ' O ' ' O ' ' A' ' 131' ' ' ILE . 67.8 mt-30 -8.19 -145.58 0.0 OUTLIER 'General case' 0 N--CA 1.479 0.976 0 O-C-N 125.544 1.778 . . . . 0.0 112.097 -179.727 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 51.53 4.44 0.02 OUTLIER 'General case' 0 C--N 1.303 -1.417 0 O-C-N 120.032 -1.667 . . . . 0.0 111.409 179.385 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 134' ' ' MET . . . . . 0.58 ' N ' ' O ' ' A' ' 132' ' ' GLN . 0.0 OUTLIER -63.19 -43.35 98.44 Favored 'General case' 0 N--CA 1.444 -0.751 0 N-CA-C 109.926 -0.398 . . . . 0.0 109.926 -179.229 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 38.6 p -71.1 -22.4 62.09 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.737 -0.665 . . . . 0.0 109.97 179.655 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 16.3 ttmm -76.6 -57.05 4.08 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.323 -178.946 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 96.6 m -52.04 -53.17 45.21 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 120.686 -0.406 . . . . 0.0 110.628 -179.296 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 138' ' ' VAL . . . . . 0.472 HG13 ' N ' ' A' ' 139' ' ' SER . 13.8 p -62.4 -39.64 85.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.787 -179.26 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 139' ' ' SER . . . . . 0.472 ' N ' HG13 ' A' ' 138' ' ' VAL . 4.5 t -57.25 -33.29 67.44 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.382 -179.345 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -60.53 -39.85 89.34 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.47 -179.775 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -58.27 -51.28 70.42 Favored 'General case' 0 CA--C 1.515 -0.368 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.433 -179.752 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -41.29 -42.08 2.08 Favored 'General case' 0 CA--C 1.533 0.315 0 O-C-N 123.176 0.298 . . . . 0.0 110.482 -179.093 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 94.4 mt-10 -85.78 66.66 9.73 Favored 'General case' 0 C--N 1.322 -0.602 0 O-C-N 123.781 0.676 . . . . 0.0 109.727 177.993 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -179.45 -21.76 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 O-C-N 123.546 0.529 . . . . 0.0 110.606 179.813 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 145' ' ' ASN . . . . . 0.481 HD21 ' CD1' ' A' ' 156' ' ' ILE . 3.0 p-10 -173.04 68.31 0.37 Allowed Pre-proline 0 C--N 1.327 -0.41 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.247 -179.512 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 146' ' ' PRO . . . . . 0.541 ' O ' ' N ' ' A' ' 148' ' ' THR . 94.1 Cg_exo -37.39 118.27 0.24 Allowed 'Trans proline' 0 C--N 1.317 -1.131 0 C-N-CA 123.139 2.559 . . . . 0.0 111.69 -179.845 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 147' ' ' PRO . . . . . 0.419 ' C ' ' H ' ' A' ' 149' ' ' THR . 31.2 Cg_exo -59.98 39.86 0.05 OUTLIER 'Trans proline' 0 N--CA 1.498 1.794 0 C-N-CA 122.826 2.35 . . . . 0.0 112.408 178.931 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 148' ' ' THR . . . . . 0.541 ' N ' ' O ' ' A' ' 146' ' ' PRO . 20.6 p -65.61 0.39 1.65 Allowed 'General case' 0 N--CA 1.448 -0.573 0 N-CA-C 110.031 -0.359 . . . . 0.0 110.031 179.69 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 149' ' ' THR . . . . . 0.419 ' H ' ' C ' ' A' ' 147' ' ' PRO . 24.3 p -141.54 166.33 25.03 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.392 179.693 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -68.42 -41.31 80.59 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.626 179.778 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 99.1 mm-40 -66.76 -25.71 66.62 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.209 -179.63 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . -68.77 -33.71 76.23 Favored Glycine 0 CA--C 1.521 0.444 0 N-CA-C 111.237 -0.745 . . . . 0.0 111.237 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 153' ' ' VAL . . . . . . . . . . . . . 57.5 t -60.5 -26.48 37.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-O 120.921 0.391 . . . . 0.0 110.756 -178.786 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 154' ' ' LEU . . . . . 0.561 ' N ' HD22 ' A' ' 154' ' ' LEU . 4.0 mm? -62.97 -37.75 88.37 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.315 -179.073 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 42.3 tp10 -64.39 -32.93 74.74 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.064 -179.708 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 156' ' ' ILE . . . . . 0.548 ' N ' HD12 ' A' ' 156' ' ' ILE . 1.6 mp -77.06 -45.1 30.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.659 179.334 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -55.6 -43.2 75.83 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.541 -177.953 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -55.67 -47.28 76.99 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.022 -179.714 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 32.5 mmtp -65.66 -32.6 74.26 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.475 -0.33 . . . . 0.0 110.692 179.812 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 160' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -70.98 -53.23 15.62 Favored 'General case' 0 CA--C 1.515 -0.369 0 C-N-CA 120.505 -0.478 . . . . 0.0 111.309 -179.52 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 60.2 ttp180 -65.77 -42.58 90.65 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.736 -179.524 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 52.6 tp10 -57.8 -53.96 52.29 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.94 -179.061 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 163' ' ' LYS . . . . . . . . . . . . . 52.9 tptt -57.03 -35.26 69.08 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.708 -178.813 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 23.1 mt -69.57 -38.86 77.55 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.244 0.545 . . . . 0.0 111.709 -179.449 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 84.8 mt-30 -72.71 -32.11 65.5 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.648 -178.776 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 75.0 ttt180 -66.66 -40.96 88.84 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-O 121.951 0.882 . . . . 0.0 111.298 -178.622 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 167' ' ' VAL . . . . . 0.47 ' CG2' ' NZ ' ' A' ' 82' ' ' LYS . 7.7 p -75.17 -34.27 30.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 115.723 -0.672 . . . . 0.0 110.965 -179.958 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 168' ' ' HIS . . . . . 0.429 ' C ' ' ND1' ' A' ' 168' ' ' HIS . 14.6 t-80 -76.92 -41.66 42.61 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.935 -179.076 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 169' ' ' THR . . . . . . . . . . . . . 35.3 m -66.88 -43.8 82.52 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.235 -179.928 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 64.6 tttm -59.84 -48.19 82.69 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.842 -178.542 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 171' ' ' ASN . . . . . . . . . . . . . 20.0 t-20 -67.27 -40.72 86.21 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.009 0.433 . . . . 0.0 110.836 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 172' ' ' TYR . . . . . . . . . . . . . 64.1 t80 -68.76 -25.41 64.71 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.549 -179.293 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 17.0 t -78.47 -30.15 47.19 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.822 -179.209 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 22.7 p -73.06 -34.7 66.42 Favored 'General case' 0 C--O 1.222 -0.394 0 CA-C-O 121.333 0.587 . . . . 0.0 110.615 -178.983 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 99.0 mt -64.72 -43.54 93.11 Favored 'General case' 0 C--N 1.317 -0.828 0 C-N-CA 120.667 -0.413 . . . . 0.0 111.793 -178.617 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 17.7 ptpt -73.76 -14.25 61.09 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.009 -179.1 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 177' ' ' LYS . . . . . . . . . . . . . 14.9 pttp -46.93 -30.15 2.4 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.477 -0.329 . . . . 0.0 110.54 -178.98 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 178' ' ' LYS . . . . . . . . . . . . . 9.1 mtmp? . . . . . 0 C--N 1.329 -0.32 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.858 -178.111 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.371 0 CA-C-O 121.086 0.47 . . . . 0.0 111.062 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 11.1 m -64.04 -32.74 74.39 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.351 -179.924 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 1.9 tmtp? -61.95 -50.36 72.43 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.785 179.678 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 64.8 mt -64.75 -28.94 45.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.455 -179.558 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 59.9 ttm-85 -69.27 -42.63 75.27 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.628 -179.421 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 79.4 mt -65.72 -35.0 79.49 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.637 -179.589 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 80.2 mm-40 -67.19 -50.24 61.68 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.761 179.879 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 23.3 mmm180 -63.42 -43.75 96.58 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.923 0.392 . . . . 0.0 110.832 -179.234 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 78.7 p -66.86 -38.59 86.63 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.319 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -70.62 -37.08 73.77 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.872 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 33.8 tptt -62.31 -31.92 72.6 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.846 -179.252 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 82.3 m-20 -67.02 -23.6 65.93 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.86 -179.384 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 73.3 mt -62.45 -53.39 47.89 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.365 0 C-N-CA 120.731 -0.388 . . . . 0.0 110.995 -179.391 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 52.6 p -74.1 -39.99 63.03 Favored 'General case' 0 C--O 1.226 -0.183 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.475 -178.583 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -60.26 -39.54 87.16 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.119 -0.491 . . . . 0.0 112.03 -178.435 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 43.2 tp10 -70.33 -53.5 16.47 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.092 0.473 . . . . 0.0 111.385 -178.612 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 6.5 pt -67.27 -27.05 37.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.588 -179.056 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 31.7 t0 -61.82 -40.92 96.95 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 120.576 -0.449 . . . . 0.0 110.388 179.9 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -52.96 -24.85 10.24 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.383 -178.875 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 62.3 mt -64.55 -46.56 92.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.298 179.65 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 49.0 mtmt -56.53 -41.29 76.54 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.28 -178.5 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 71.4 mmtt -65.98 -41.68 90.83 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.192 179.613 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -61.87 -41.48 97.91 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.471 -179.834 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -61.34 -31.39 71.26 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.669 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -61.89 -34.06 75.34 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.763 -179.759 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 52.3 mt . . . . . 0 C--N 1.329 -0.321 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.948 -179.374 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 6.2 m-20 . . . . . 0 CA--C 1.547 0.858 0 N-CA-C 110.33 -0.248 . . . . 0.0 110.33 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -75.59 -14.14 20.0 Favored 'Trans proline' 0 N--CA 1.496 1.628 0 C-N-CA 121.709 1.606 . . . . 0.0 112.027 -179.932 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 59.3 t80 -74.31 -51.04 16.4 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-O 120.853 0.359 . . . . 0.0 111.555 -179.611 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 71.8 mt -67.47 -30.45 48.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.691 -179.482 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 8.5 mp -75.93 -48.85 19.61 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 121.097 0.475 . . . . 0.0 110.016 179.337 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -62.14 -28.06 69.38 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.937 -0.574 . . . . 0.0 109.963 179.742 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -66.37 -37.57 85.58 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.663 179.82 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 36.6 ttpt -62.82 -26.64 68.84 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.799 -179.794 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 54.0 t -70.43 -44.96 76.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.398 179.609 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 44.0 ttm180 -64.16 -35.69 81.62 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.089 -179.529 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -63.12 -41.74 99.4 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.949 0.404 . . . . 0.0 111.176 -179.333 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 41.3 p -72.76 -23.72 60.86 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.427 179.719 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 25.2 m -60.71 -51.18 70.47 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 120.787 -0.365 . . . . 0.0 111.0 -179.473 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 21.9 t -78.54 -48.24 22.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-O 121.209 0.528 . . . . 0.0 111.92 179.791 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -54.62 -45.59 73.73 Favored 'General case' 0 C--O 1.223 -0.331 0 CA-C-N 115.397 -0.819 . . . . 0.0 111.62 -177.387 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.423 ' CG ' ' N ' ' A' ' 91' ' ' LYS . 14.3 pt-20 -59.75 -42.57 93.52 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.989 0.424 . . . . 0.0 110.594 -179.569 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . 0.423 ' N ' ' CG ' ' A' ' 90' ' ' GLU . 67.6 mttm -59.09 -38.3 79.17 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.35 -179.221 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.412 ' CE2' HD11 ' A' ' 96' ' ' ILE . 88.2 t80 -60.81 -38.49 85.59 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.654 179.532 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 52.9 t -59.02 -44.65 91.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.247 -178.492 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 71.7 mt -54.69 -37.34 39.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.247 -179.787 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.33 -37.67 81.36 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.577 -179.867 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . 0.412 HD11 ' CE2' ' A' ' 92' ' ' PHE . 38.4 mm -61.94 -43.95 98.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 120.91 0.386 . . . . 0.0 110.031 -179.751 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 81.6 tt0 -65.04 -41.83 94.87 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 120.683 -0.407 . . . . 0.0 110.707 179.489 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 40.9 tp10 -59.77 -46.46 89.11 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.924 0.392 . . . . 0.0 110.563 -178.908 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 80.2 mm-40 -60.96 -37.45 82.46 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.225 -179.743 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -64.82 -38.07 89.74 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.606 179.867 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 18.7 m -64.08 -47.7 79.05 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.062 -179.455 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -75.15 -18.94 60.11 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.3 -179.462 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 39.1 tp . . . . . 0 N--CA 1.466 0.339 0 CA-C-O 121.179 0.514 . . . . 0.0 110.218 -179.766 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 39.9 p . . . . . 0 CA--C 1.528 0.118 0 CA-C-O 120.857 0.361 . . . . 0.0 110.318 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -65.59 -30.19 76.87 Favored Glycine 0 CA--C 1.524 0.617 0 N-CA-C 110.881 -0.888 . . . . 0.0 110.881 179.819 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 78.4 tt0 -60.31 -38.13 82.72 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.69 0.281 . . . . 0.0 110.498 -179.601 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 54.7 m-85 -60.6 -44.91 95.74 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.537 -0.301 . . . . 0.0 110.557 -179.829 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 70.0 m -50.78 -30.58 14.51 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.698 -179.52 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -62.13 -32.18 72.74 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.75 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 50.6 mmm -67.76 -40.64 84.06 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-O 121.058 0.456 . . . . 0.0 110.906 -179.744 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 55.8 m-85 -62.74 -30.85 71.74 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.183 -179.938 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -55.91 -37.99 69.65 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.994 0.426 . . . . 0.0 110.618 -179.612 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.512 HD22 ' N ' ' A' ' 118' ' ' LEU . 4.1 mm? -61.42 -40.36 94.14 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.819 -0.628 . . . . 0.0 109.682 -179.178 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 119' ' ' MET . . . . . 0.408 ' C ' ' SD ' ' A' ' 119' ' ' MET . 0.0 OUTLIER -60.46 -53.21 60.28 Favored 'General case' 0 C--N 1.319 -0.727 0 C-N-CA 119.745 -0.782 . . . . 0.0 109.906 -179.632 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 20.1 m-85 -61.52 -46.36 90.3 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.667 -179.717 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 9.7 tm-20 -58.0 -44.87 87.48 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.185 -179.062 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 86.9 t -75.95 -21.47 15.67 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.33 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.078 179.804 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 32.2 t -71.43 -26.85 62.92 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 120.467 -0.493 . . . . 0.0 111.288 179.775 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . 0.428 ' N ' ' HD2' ' A' ' 125' ' ' PRO . 2.4 mptm? -58.8 -59.29 14.19 Favored Pre-proline 0 CA--C 1.542 0.64 0 C-N-CA 120.911 -0.316 . . . . 0.0 110.738 -179.827 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 125' ' ' PRO . . . . . 0.428 ' HD2' ' N ' ' A' ' 124' ' ' LYS . 37.3 Cg_endo -61.86 -50.04 5.85 Favored 'Trans proline' 0 N--CA 1.494 1.511 0 C-N-CA 122.039 1.826 . . . . 0.0 111.493 179.183 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.583 ' HB3' HD12 ' A' ' 131' ' ' ILE . 8.1 mp -56.71 -43.13 80.28 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.113 -179.16 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 11.9 tm0? -64.15 -49.98 70.01 Favored 'General case' 0 C--N 1.316 -0.849 0 C-N-CA 119.975 -0.69 . . . . 0.0 109.819 179.571 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -56.29 -19.38 14.02 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.188 -179.869 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 1.7 tt -93.72 -65.65 0.98 Allowed 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.742 179.886 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -151.8 -136.85 2.51 Favored Glycine 0 N--CA 1.462 0.374 0 N-CA-C 110.944 -0.862 . . . . 0.0 110.944 -178.955 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 131' ' ' ILE . . . . . 0.65 HG22 ' N ' ' A' ' 132' ' ' GLN . 81.2 mt 52.01 -114.58 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.333 -0.126 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 -178.977 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 132' ' ' GLN . . . . . 0.65 ' N ' HG22 ' A' ' 131' ' ' ILE . 57.6 tp60 97.15 55.4 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.803 0 O-C-N 124.138 0.899 . . . . 0.0 110.705 179.137 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 25.1 tt0 -170.42 -21.38 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 120.339 -0.544 . . . . 0.0 111.038 179.786 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 134' ' ' MET . . . . . 0.585 ' HG3' HG21 ' A' ' 131' ' ' ILE . 0.3 OUTLIER -52.26 -53.21 46.75 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.191 0.52 . . . . 0.0 110.618 -178.766 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 24.5 m -61.47 -28.54 69.36 Favored 'General case' 0 C--N 1.314 -0.945 0 C-N-CA 120.655 -0.418 . . . . 0.0 110.526 -179.494 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 30.3 ttpt -79.76 -57.05 3.85 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 116.14 -0.482 . . . . 0.0 112.141 -178.505 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 137' ' ' THR . . . . . 0.503 HG23 ' N ' ' A' ' 138' ' ' VAL . 14.1 t -59.71 -43.35 94.15 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.291 -178.298 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 138' ' ' VAL . . . . . 0.503 ' N ' HG23 ' A' ' 137' ' ' THR . 70.3 t -63.78 -44.77 98.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.425 -179.753 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 77.9 p -62.53 -38.25 89.24 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.845 0.355 . . . . 0.0 110.69 -179.593 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 93.8 m-20 -70.78 -30.58 67.1 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.584 179.857 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -65.11 -26.3 68.15 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.991 -179.873 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 142' ' ' ALA . . . . . 0.473 ' O ' ' O ' ' A' ' 143' ' ' GLU . . . -65.64 -29.01 69.52 Favored 'General case' 0 CA--C 1.51 -0.592 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.646 -179.3 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 143' ' ' GLU . . . . . 0.577 ' O ' ' N ' ' A' ' 145' ' ' ASN . 14.2 mm-40 -59.39 -123.49 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 -179.878 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 144' ' ' GLU . . . . . 0.406 ' C ' ' O ' ' A' ' 143' ' ' GLU . 72.0 mm-40 26.05 -81.09 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 123.574 0.749 . . . . 0.0 111.844 -179.981 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 145' ' ' ASN . . . . . 0.577 ' N ' ' O ' ' A' ' 143' ' ' GLU . 24.7 t30 -129.67 91.66 39.94 Favored Pre-proline 0 CA--C 1.55 0.964 0 CA-C-N 115.584 -0.735 . . . . 0.0 110.38 178.27 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 146' ' ' PRO . . . . . 0.487 ' O ' ' N ' ' A' ' 148' ' ' THR . 96.1 Cg_exo -43.67 106.73 0.08 OUTLIER 'Trans proline' 0 N--CA 1.501 1.939 0 C-N-CA 122.738 2.292 . . . . 0.0 112.052 -179.796 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 147' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_exo -48.48 81.78 0.02 OUTLIER 'Trans proline' 0 N--CA 1.5 1.87 0 C-N-CA 122.299 1.999 . . . . 0.0 112.661 179.848 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 148' ' ' THR . . . . . 0.487 ' N ' ' O ' ' A' ' 146' ' ' PRO . 1.2 m -97.12 14.42 25.84 Favored 'General case' 0 N--CA 1.47 0.556 0 O-C-N 122.14 -0.35 . . . . 0.0 110.112 179.994 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 149' ' ' THR . . . . . . . . . . . . . 28.4 p -140.82 167.91 21.05 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.518 -179.811 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -62.26 -44.15 97.21 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.503 -179.851 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 151' ' ' GLN . . . . . 0.448 ' C ' HE21 ' A' ' 151' ' ' GLN . 0.0 OUTLIER -66.28 -37.0 84.4 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.756 -179.763 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 152' ' ' GLY . . . . . 0.433 ' N ' HE21 ' A' ' 151' ' ' GLN . . . -55.53 -46.9 79.79 Favored Glycine 0 CA--C 1.523 0.59 0 N-CA-C 110.985 -0.846 . . . . 0.0 110.985 -179.26 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 153' ' ' VAL . . . . . . . . . . . . . 55.0 t -64.14 -24.69 36.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-O 120.828 0.347 . . . . 0.0 110.334 -179.62 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 154' ' ' LEU . . . . . 0.492 ' O ' HD23 ' A' ' 154' ' ' LEU . 1.1 tt -60.46 -40.44 91.21 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 109.558 -0.534 . . . . 0.0 109.558 -178.887 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -57.54 -46.07 84.31 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.062 179.535 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 156' ' ' ILE . . . . . 0.489 HG22 ' SD ' ' A' ' 160' ' ' MET . 16.0 mm -61.36 -43.63 97.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 -178.521 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -54.51 -50.02 68.83 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.38 179.202 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 158' ' ' LYS . . . . . 0.492 ' NZ ' ' OE2' ' A' ' 162' ' ' GLU . 65.1 tttm -62.72 -40.96 98.81 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.05 179.862 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 65.1 mmtt -65.92 -31.97 73.2 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.217 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 160' ' ' MET . . . . . 0.489 ' SD ' HG22 ' A' ' 156' ' ' ILE . 2.0 mtp -67.71 -47.89 68.1 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.228 0.537 . . . . 0.0 110.334 -179.5 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 62.4 ttp180 -66.44 -34.04 77.05 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.604 -179.716 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 162' ' ' GLU . . . . . 0.492 ' OE2' ' NZ ' ' A' ' 158' ' ' LYS . 48.5 mt-10 -69.95 -40.0 75.72 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.995 179.927 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 163' ' ' LYS . . . . . . . . . . . . . 17.0 tptp -67.35 -40.85 85.85 Favored 'General case' 0 C--N 1.325 -0.458 0 C-N-CA 120.553 -0.459 . . . . 0.0 111.135 -179.299 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 7.9 mt -69.15 -26.33 64.82 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.269 -179.628 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 50.7 tt0 -59.98 -45.3 93.17 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.728 -179.146 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 84.8 mtp180 -61.8 -29.46 70.17 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.35 0.595 . . . . 0.0 110.889 -179.723 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 167' ' ' VAL . . . . . . . . . . . . . 22.3 t -67.93 -46.85 81.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.491 -179.827 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 168' ' ' HIS . . . . . 0.463 ' O ' ' ND1' ' A' ' 168' ' ' HIS . 29.4 t-80 -79.23 -28.99 42.53 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.28 179.943 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 169' ' ' THR . . . . . . . . . . . . . 27.8 m -72.72 -48.52 38.04 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.781 0.324 . . . . 0.0 111.351 -179.562 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 56.0 mtpt -64.08 -43.39 95.57 Favored 'General case' 0 C--N 1.326 -0.436 0 C-N-CA 120.756 -0.377 . . . . 0.0 110.692 -179.52 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 171' ' ' ASN . . . . . . . . . . . . . 42.8 t-20 -65.79 -35.04 79.59 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.597 -179.866 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 172' ' ' TYR . . . . . . . . . . . . . 89.4 t80 -74.65 -45.06 47.2 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.734 -0.667 . . . . 0.0 110.639 179.699 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 16.8 t -66.82 -44.04 82.19 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.177 -179.381 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 12.6 p -60.92 -46.34 91.06 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.186 -179.648 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 33.8 tp -63.85 -31.98 73.34 Favored 'General case' 0 C--N 1.319 -0.741 0 C-N-CA 120.581 -0.448 . . . . 0.0 110.719 -179.227 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 2.7 tptm -65.04 -2.85 3.0 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.648 -178.729 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 177' ' ' LYS . . . . . . . . . . . . . 20.7 ptmt -61.66 -16.04 45.2 Favored 'General case' 0 C--N 1.318 -0.769 0 C-N-CA 120.651 -0.419 . . . . 0.0 111.183 -178.962 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 178' ' ' LYS . . . . . . . . . . . . . 74.5 mmtt . . . . . 0 C--N 1.325 -0.493 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.893 -179.324 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.458 -0.074 0 CA-C-O 120.953 0.406 . . . . 0.0 110.554 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.419 HG23 HH21 ' A' ' 34' ' ' ARG . 86.0 m -50.47 -39.73 48.95 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.473 -179.953 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 6.2 tmtt? -49.77 -29.35 7.61 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.673 -179.766 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 96.4 mt -52.86 -52.96 23.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.697 -179.19 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.419 HH21 HG23 ' A' ' 31' ' ' THR . 87.9 mtm180 -62.19 -41.31 98.23 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.458 -179.472 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.55 HD22 ' N ' ' A' ' 35' ' ' LEU . 4.2 mm? -64.17 -52.01 61.04 Favored 'General case' 0 N--CA 1.455 -0.22 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.037 -179.705 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 83.7 tt0 -65.27 -46.17 81.55 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.598 -179.401 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 44.7 ttm180 -64.59 -45.43 87.03 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.794 -179.148 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 30.2 t -72.14 -37.11 69.51 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.916 -178.725 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -71.51 -49.69 38.6 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.231 -178.383 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 64.3 mmtt -57.77 -30.64 65.79 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.683 -178.667 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 86.1 m-20 -68.36 -24.43 64.79 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.87 -178.268 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 63.0 mt -63.03 -56.74 15.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.281 -178.278 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 55.8 p -75.78 -38.36 58.34 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.143 -178.455 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 96.3 m-20 -61.5 -38.53 87.69 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.978 -176.99 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 14.3 tm-20 -72.22 -58.5 3.36 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.114 -0.493 . . . . 0.0 111.248 -178.057 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 7.4 pt -61.22 -28.53 44.0 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.188 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.782 -178.539 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -66.51 -38.58 87.52 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.814 179.288 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . 0.414 ' O ' ' OD2' ' A' ' 52' ' ' ASP . . . -55.92 -25.1 41.55 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.485 -179.904 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 66.9 mt -58.39 -43.02 85.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.678 -179.631 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -60.6 -34.21 73.89 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.57 -179.8 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -61.72 -51.75 67.11 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.964 -179.036 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . 0.414 ' OD2' ' O ' ' A' ' 48' ' ' ALA . 0.4 OUTLIER -70.21 -19.8 63.14 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.753 -179.189 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -72.92 -32.92 65.65 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.734 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -58.06 -25.79 61.7 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.63 -179.786 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 79.3 mt . . . . . 0 C--N 1.33 -0.239 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.366 -179.346 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 33.6 m120 . . . . . 0 C--O 1.233 0.215 0 CA-C-O 120.553 0.216 . . . . 0.0 110.91 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -71.08 4.4 2.79 Favored 'Trans proline' 0 C--N 1.301 -1.925 0 C-N-CA 122.794 2.329 . . . . 0.0 112.353 -178.968 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 52.5 t80 -63.74 -51.63 64.06 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.774 -179.261 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 76.6 mt -70.08 -48.08 64.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.9 -179.158 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.546 ' N ' HD12 ' A' ' 79' ' ' LEU . 10.0 mp -52.23 -51.42 58.4 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.499 -179.073 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.416 ' O ' ' NH1' ' A' ' 84' ' ' ARG . 96.1 mt-10 -65.52 -31.83 73.11 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.438 -179.982 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -65.25 -38.14 89.4 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.634 -179.684 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -54.58 -24.93 23.23 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.425 -179.618 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 44.2 t -72.5 -43.85 62.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.978 -179.446 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . 0.416 ' NH1' ' O ' ' A' ' 80' ' ' GLU . 12.0 mpt_? -61.8 -29.21 70.0 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.6 -179.101 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -64.08 -44.93 90.86 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.917 -178.725 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 54.9 p -71.18 -20.18 62.31 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.769 -179.216 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 26.0 m -64.33 -53.89 41.6 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.218 -178.642 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 41.3 t -69.27 -46.5 77.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.094 -178.311 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -57.35 -37.44 72.59 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.744 -178.094 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 17.3 mm-40 -55.22 -42.24 73.1 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.701 -179.391 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 14.6 mptt -64.75 -23.37 67.23 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.639 -178.406 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 53.8 t80 -74.1 -59.57 2.66 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.316 -177.924 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 4.5 m -49.92 -38.3 13.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.674 -177.64 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 81.1 mt -58.91 -39.42 77.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.136 179.475 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -51.55 -40.77 60.33 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.569 -179.521 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . 0.563 ' N ' HD12 ' A' ' 96' ' ' ILE . 1.7 mp -61.99 -41.64 91.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.597 -179.809 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 75.6 mt-10 -60.54 -49.43 77.59 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.962 -178.718 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 39.7 tp10 -68.3 -42.51 79.35 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.852 -178.878 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 91.1 mt-10 -69.48 -32.27 71.05 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.762 -178.911 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -57.38 -30.95 65.31 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.566 -179.588 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 21.1 m -63.65 -52.84 59.01 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.738 -179.253 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -66.76 -28.75 68.65 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.351 179.754 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.478 ' O ' HD13 ' A' ' 103' ' ' LEU . 0.1 OUTLIER . . . . . 0 N--CA 1.451 -0.388 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.836 179.994 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 18.9 p . . . . . 0 C--O 1.231 0.128 0 CA-C-O 120.756 0.312 . . . . 0.0 110.386 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -75.52 -28.67 61.05 Favored Glycine 0 CA--C 1.525 0.682 0 N-CA-C 111.008 -0.837 . . . . 0.0 111.008 178.896 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . 0.459 ' OE1' ' N ' ' A' ' 111' ' ' GLU . 13.1 mp0 -56.78 -27.53 59.84 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.76 0.314 . . . . 0.0 110.536 -179.354 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 30.6 m-85 -53.28 -26.03 16.9 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.456 179.618 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 66.5 m -50.9 -34.48 28.54 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.538 179.934 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -57.41 -31.52 65.93 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.394 179.175 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 115' ' ' MET . . . . . 0.434 ' SD ' HG23 ' A' ' 96' ' ' ILE . 45.7 ttm -77.99 -40.45 39.1 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.936 179.448 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 30.4 t80 -64.06 -31.69 72.97 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.431 179.606 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 94.2 m-20 -59.92 -35.75 75.56 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.606 -179.409 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 81.5 mt -56.62 -38.61 72.33 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.326 179.743 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 119' ' ' MET . . . . . 0.478 ' C ' ' SD ' ' A' ' 119' ' ' MET . 0.0 OUTLIER -56.4 -50.13 72.48 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.476 179.612 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 68.6 t80 -63.84 -44.3 93.58 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.959 0.409 . . . . 0.0 110.693 -179.735 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . 0.405 ' O ' ' CD ' ' A' ' 125' ' ' PRO . 78.0 tt0 -53.98 -40.11 66.63 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.566 -179.706 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 95.1 t -83.42 -18.97 10.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.746 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 51.4 p -71.31 -30.29 66.06 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.809 -178.874 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . 0.534 ' CB ' ' HD3' ' A' ' 125' ' ' PRO . 5.6 mmtp -69.58 -55.2 9.63 Favored Pre-proline 0 C--N 1.33 -0.241 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.279 -177.509 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 125' ' ' PRO . . . . . 0.534 ' HD3' ' CB ' ' A' ' 124' ' ' LYS . 68.3 Cg_exo -50.66 -44.45 40.44 Favored 'Trans proline' 0 C--N 1.306 -1.707 0 C-N-CA 122.61 2.207 . . . . 0.0 111.887 179.06 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 75.4 mt -64.01 -21.2 66.4 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.575 -179.479 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 6.4 tm0? -62.91 -49.47 74.67 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.863 -179.627 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 70.7 mmtt -62.11 -6.75 3.23 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.443 -179.718 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.503 HD23 ' O ' ' A' ' 129' ' ' LEU . 1.1 tt -108.2 -50.71 3.0 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.562 179.792 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 130' ' ' GLY . . . . . 0.593 ' O ' ' C ' ' A' ' 131' ' ' ILE . . . 170.83 -120.97 0.88 Allowed Glycine 0 CA--C 1.52 0.36 0 N-CA-C 110.935 -0.866 . . . . 0.0 110.935 -179.688 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 131' ' ' ILE . . . . . 0.593 ' C ' ' O ' ' A' ' 130' ' ' GLY . 81.1 mt 21.83 94.23 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 120.65 0.262 . . . . 0.0 110.712 179.976 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 132' ' ' GLN . . . . . 0.474 ' O ' ' HG2' ' A' ' 133' ' ' GLU . 47.0 tt0 -117.59 158.66 24.23 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.542 -179.642 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 133' ' ' GLU . . . . . 0.474 ' HG2' ' O ' ' A' ' 132' ' ' GLN . 0.6 OUTLIER 79.57 -12.17 1.1 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.539 179.173 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 26.4 ttm -58.5 -22.41 55.05 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.508 -179.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 34.9 m -67.79 -65.85 0.64 Allowed 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.689 179.559 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 136' ' ' LYS . . . . . 0.477 ' O ' ' N ' ' A' ' 140' ' ' ASP . 19.4 ttmm -51.4 -33.57 30.79 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.676 -0.491 . . . . 0.0 109.676 179.135 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 99.8 m -54.19 -66.05 0.46 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.654 -179.448 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 7.2 p -62.39 -33.38 58.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.624 -179.127 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 1.2 p -71.31 -31.93 68.02 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.613 -179.881 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 140' ' ' ASP . . . . . 0.477 ' N ' ' O ' ' A' ' 136' ' ' LYS . 49.9 t0 -68.89 -27.6 65.93 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.497 -179.816 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -69.36 -25.97 64.44 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.953 -178.84 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -64.6 -29.12 70.13 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.815 -178.513 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 80.9 mm-40 -67.19 -37.62 83.97 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.678 -179.455 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -65.56 -33.24 75.46 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.599 -179.728 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 145' ' ' ASN . . . . . . . . . . . . . 48.4 t30 -159.75 83.92 2.24 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.529 -179.358 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 146' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_exo -47.13 106.36 0.1 Allowed 'Trans proline' 0 C--N 1.305 -1.739 0 C-N-CA 122.875 2.384 . . . . 0.0 112.098 179.898 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 147' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_exo -48.72 110.57 0.36 Allowed 'Trans proline' 0 C--N 1.304 -1.815 0 C-N-CA 122.774 2.316 . . . . 0.0 112.252 -179.534 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 10.0 t -124.17 1.51 8.51 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.377 179.314 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 149' ' ' THR . . . . . 0.421 HG23 ' H ' ' A' ' 152' ' ' GLY . 5.1 t -162.12 -178.99 6.74 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.636 -179.843 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 150' ' ' ALA . . . . . 0.4 ' N ' ' OG1' ' A' ' 149' ' ' THR . . . -62.79 -34.27 76.93 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.583 -179.59 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 12.6 tt0 -66.21 -45.14 81.79 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.741 -179.707 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 152' ' ' GLY . . . . . 0.421 ' H ' HG23 ' A' ' 149' ' ' THR . . . -61.43 -44.75 97.63 Favored Glycine 0 CA--C 1.524 0.655 0 N-CA-C 110.869 -0.892 . . . . 0.0 110.869 -179.884 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 153' ' ' VAL . . . . . . . . . . . . . 99.4 t -65.77 -42.78 93.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-O 120.836 0.35 . . . . 0.0 110.468 -179.86 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 7.8 mt -51.46 -31.96 25.19 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.36 179.68 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 34.4 tp10 -64.68 -47.3 78.9 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.327 179.056 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 156' ' ' ILE . . . . . 0.57 ' N ' HD12 ' A' ' 156' ' ' ILE . 1.7 mp -64.12 -43.53 97.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.479 179.472 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -49.46 -46.89 48.51 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.358 -179.407 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 63.9 tttp -61.91 -41.91 98.46 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.092 178.89 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -65.42 -31.1 72.02 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.394 179.713 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 160' ' ' MET . . . . . . . . . . . . . 1.6 mtm -67.89 -51.49 47.39 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.869 179.689 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 76.1 ttt180 -67.77 -35.36 78.55 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.455 -179.939 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 81.1 tt0 -62.61 -48.7 78.24 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.89 -178.853 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 163' ' ' LYS . . . . . . . . . . . . . 41.1 tptt -65.42 -33.91 77.06 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.548 -179.43 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 14.2 mt -67.17 -30.45 70.42 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.915 -178.884 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 90.1 mt-30 -66.11 -35.17 79.8 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.741 -179.146 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 92.3 mtt-85 -64.73 -34.08 77.49 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.451 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 167' ' ' VAL . . . . . . . . . . . . . 11.1 t -68.39 -43.31 84.25 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.426 0 CA-C-O 120.893 0.378 . . . . 0.0 110.762 179.992 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 168' ' ' HIS . . . . . 0.402 ' ND1' ' O ' ' A' ' 168' ' ' HIS . 24.9 t-80 -80.01 -33.48 39.21 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.767 -179.546 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 169' ' ' THR . . . . . . . . . . . . . 91.5 m -70.15 -45.29 67.08 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.991 -178.542 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 58.9 mmtt -60.13 -44.27 95.03 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.612 -179.278 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 171' ' ' ASN . . . . . . . . . . . . . 48.6 t-20 -68.76 -33.05 73.25 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.992 0.425 . . . . 0.0 110.597 -179.703 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 172' ' ' TYR . . . . . 0.567 ' CE2' ' NZ ' ' A' ' 176' ' ' LYS . 53.7 t80 -62.93 -47.39 83.45 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.639 -179.442 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 68.7 m -73.75 -37.63 64.98 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.708 -179.332 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 89.5 m -62.03 -48.37 80.56 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.588 -179.315 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 12.3 tp -66.42 -34.32 77.67 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.548 -179.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 176' ' ' LYS . . . . . 0.567 ' NZ ' ' CE2' ' A' ' 172' ' ' TYR . 23.5 mmtp -78.01 -8.0 57.61 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.972 -179.266 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 177' ' ' LYS . . . . . . . . . . . . . 13.7 ptmt -62.5 -22.8 66.55 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.411 -179.696 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 178' ' ' LYS . . . . . . . . . . . . . 31.7 ttmt . . . . . 0 N--CA 1.455 -0.203 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.836 -179.328 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.527 0.088 0 CA-C-O 120.802 0.334 . . . . 0.0 110.492 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 98.0 m -61.53 -23.53 66.0 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.465 179.725 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 17.2 tptp -68.45 -47.21 67.75 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.245 0.545 . . . . 0.0 110.817 179.606 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.585 ' N ' HD12 ' A' ' 33' ' ' ILE . 1.7 mp -57.17 -45.49 84.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 N-CA-C 109.152 -0.684 . . . . 0.0 109.152 -179.33 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 44.8 ttm180 -69.79 -27.79 65.2 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.047 0.451 . . . . 0.0 109.968 -179.703 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 44.5 tp -68.44 -47.9 65.97 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.066 -179.605 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 22.1 pt-20 -76.83 -39.8 50.04 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.612 -179.731 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 79.5 ttt180 -62.94 -42.71 99.89 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.028 -0.533 . . . . 0.0 109.997 -179.15 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 78.0 p -63.84 -26.45 68.62 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.097 0.475 . . . . 0.0 110.256 -179.755 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -83.16 -32.22 26.73 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.067 0.461 . . . . 0.0 111.105 179.366 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -63.81 -35.18 79.77 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.015 -0.538 . . . . 0.0 111.0 -179.003 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . 0.496 ' OD1' ' N ' ' A' ' 42' ' ' ILE . 15.2 p30 -61.92 -23.62 66.46 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.669 -179.261 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.496 ' N ' ' OD1' ' A' ' 41' ' ' ASP . 75.3 mt -59.84 -49.74 82.73 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.633 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.676 -179.097 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 40.3 p -72.6 -36.73 68.17 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.047 0.451 . . . . 0.0 111.305 -178.76 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 66.4 t0 -63.0 -39.94 96.26 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.96 -178.232 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 68.2 mm-40 -71.16 -55.92 7.16 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 112.233 0.456 . . . . 0.0 112.233 -179.285 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 7.0 pt -62.0 -26.33 39.73 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.107 -178.788 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -65.47 -39.09 91.57 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.91 -0.587 . . . . 0.0 110.687 -179.836 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.16 -24.33 67.12 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-O 121.059 0.457 . . . . 0.0 110.687 -178.89 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 65.2 mt -65.94 -52.82 44.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.007 -0.542 . . . . 0.0 112.365 -178.249 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 38.5 pttt -59.33 -30.19 68.18 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.857 -178.554 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 49.6 mtpt -63.89 -43.98 94.38 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.33 -179.678 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -65.42 -43.47 90.44 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.559 -179.895 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -58.34 -30.45 66.74 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.754 -179.578 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -66.47 -35.61 80.69 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.006 -179.858 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 53.7 mt . . . . . 0 C--N 1.325 -0.468 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.31 -178.945 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 17.1 m120 . . . . . 0 CA--C 1.532 0.284 0 N-CA-C 110.265 -0.272 . . . . 0.0 110.265 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -73.52 -8.23 21.38 Favored 'Trans proline' 0 N--CA 1.489 1.236 0 C-N-CA 122.79 2.327 . . . . 0.0 112.003 -179.343 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 53.4 t80 -76.96 -50.94 12.06 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.04 0.448 . . . . 0.0 110.275 -179.92 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 16.8 tt -75.48 -27.58 19.26 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.144 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.307 -179.883 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 3.1 mp -74.0 -37.96 64.25 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.6 179.776 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 10.5 mm-40 -63.14 -25.19 68.24 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.377 -179.858 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -65.98 -45.21 82.47 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.747 -179.35 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 6.5 ttpm? -55.97 -25.75 45.22 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.627 -179.735 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 26.9 t -74.49 -46.17 43.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.724 179.685 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 91.2 mtm180 -67.25 -28.03 67.71 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.167 0.508 . . . . 0.0 110.377 -179.705 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -58.41 -41.37 84.78 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.012 -179.204 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 68.7 p -76.86 -24.1 52.65 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.716 -179.906 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 86.2 m -60.23 -51.92 67.51 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.805 -178.947 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 56.1 t -67.92 -43.34 85.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.693 -179.396 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -64.13 -31.8 73.13 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.854 -179.065 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -55.43 -41.81 73.31 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.004 -179.579 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -58.09 -34.04 69.75 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.595 -179.325 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.602 ' O ' ' HB3' ' A' ' 95' ' ' ALA . 46.0 t80 -71.29 -45.48 63.0 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.902 -179.91 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 57.3 t -53.18 -56.87 6.14 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.793 -177.627 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.402 HG21 HD13 ' A' ' 94' ' ' ILE . 23.3 pt -54.14 -30.71 20.68 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.661 -179.959 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . 0.602 ' HB3' ' O ' ' A' ' 92' ' ' PHE . . . -52.56 -41.89 63.97 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.351 -179.641 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . 0.54 ' N ' HD12 ' A' ' 96' ' ' ILE . 1.6 mp -63.87 -41.81 93.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 116.073 -0.512 . . . . 0.0 109.945 179.255 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 79.4 tt0 -61.18 -49.89 75.38 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.073 -178.452 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 80.9 mm-40 -68.04 -41.41 82.13 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.42 -179.988 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 48.5 tp10 -62.1 -43.07 99.64 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.284 -179.88 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -62.36 -35.66 79.84 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.877 0.37 . . . . 0.0 110.572 -179.545 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 99.3 m -59.3 -43.4 92.62 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.164 -179.698 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 60.1 mttp -55.69 -36.43 67.13 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.237 -0.438 . . . . 0.0 109.849 -179.459 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.536 HD22 ' N ' ' A' ' 103' ' ' LEU . 4.2 mm? . . . . . 0 CA--C 1.511 -0.556 0 N-CA-C 109.916 -0.402 . . . . 0.0 109.916 179.112 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.462 0.166 0 CA-C-O 120.924 0.392 . . . . 0.0 110.449 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -66.97 -28.03 73.64 Favored Glycine 0 CA--C 1.523 0.559 0 N-CA-C 110.686 -0.966 . . . . 0.0 110.686 -179.9 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 82.0 tt0 -61.23 -43.29 99.12 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.794 0.33 . . . . 0.0 110.544 -179.312 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 70.2 m-85 -65.43 -40.15 92.98 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.608 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 59.8 p -57.12 -31.91 65.8 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.33 -179.509 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -63.9 -29.58 70.75 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.445 179.592 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 37.3 mtp -74.95 -51.93 12.48 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.485 -179.221 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 41.6 t80 -50.15 -35.88 27.85 Favored 'General case' 0 N--CA 1.463 0.194 0 N-CA-C 110.042 -0.355 . . . . 0.0 110.042 -179.427 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 97.2 m-20 -61.8 -41.89 98.32 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.184 -0.462 . . . . 0.0 109.841 179.352 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.512 HD23 ' O ' ' A' ' 118' ' ' LEU . 1.4 tt -59.66 -40.56 88.16 Favored 'General case' 0 C--O 1.222 -0.343 0 CA-C-O 121.369 0.604 . . . . 0.0 109.685 -179.761 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 119' ' ' MET . . . . . 0.444 ' C ' ' SD ' ' A' ' 119' ' ' MET . 0.1 OUTLIER -53.15 -45.96 68.63 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.187 0.518 . . . . 0.0 109.858 -179.456 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 50.5 t80 -63.43 -41.21 98.69 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.176 0.512 . . . . 0.0 110.652 -179.013 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 14.5 mm-40 -55.48 -48.48 74.48 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.289 -178.903 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 31.1 m -71.27 -16.93 19.58 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.524 0 O-C-N 123.429 0.456 . . . . 0.0 110.819 -179.491 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 9.4 m -72.34 -24.98 61.37 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-O 121.191 0.519 . . . . 0.0 110.748 179.593 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . 0.541 ' N ' ' HD2' ' A' ' 125' ' ' PRO . 2.5 mptp? -65.05 -57.8 14.56 Favored Pre-proline 0 C--N 1.323 -0.578 0 CA-C-N 116.194 -0.457 . . . . 0.0 112.113 -179.376 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 125' ' ' PRO . . . . . 0.541 ' HD2' ' N ' ' A' ' 124' ' ' LYS . 30.2 Cg_endo -60.32 -30.63 91.48 Favored 'Trans proline' 0 C--N 1.307 -1.644 0 C-N-CA 122.441 2.094 . . . . 0.0 112.453 -179.01 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 92.6 mt -70.69 -24.82 62.74 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.71 179.854 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 55.2 tt0 -65.21 -39.43 92.77 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.148 -179.99 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 17.0 tptm -50.27 -44.37 53.7 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 120.576 -0.449 . . . . 0.0 110.546 -178.249 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 18.5 mt -57.52 -110.37 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.824 178.727 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 130' ' ' GLY . . . . . 0.42 ' C ' ' NE2' ' A' ' 132' ' ' GLN . . . -147.85 17.25 1.41 Allowed Glycine 0 C--N 1.332 0.356 0 N-CA-C 110.876 -0.889 . . . . 0.0 110.876 -179.489 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 76.3 mt -111.71 115.22 49.26 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.393 0 CA-C-O 120.904 0.383 . . . . 0.0 110.247 179.816 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 132' ' ' GLN . . . . . 0.478 ' O ' ' HB2' ' A' ' 133' ' ' GLU . 8.1 mp0 -139.93 -178.71 5.56 Favored 'General case' 0 CA--C 1.508 -0.645 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.077 -179.701 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 133' ' ' GLU . . . . . 0.478 ' HB2' ' O ' ' A' ' 132' ' ' GLN . 75.0 mt-10 75.48 -21.91 0.29 Allowed 'General case' 0 CA--C 1.52 -0.195 0 O-C-N 123.895 0.747 . . . . 0.0 110.622 179.497 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 134' ' ' MET . . . . . 0.462 ' H ' ' C ' ' A' ' 132' ' ' GLN . 48.5 mtp -51.27 -23.25 3.34 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.165 179.662 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 34.7 p -63.0 -63.82 1.09 Allowed 'General case' 0 C--O 1.221 -0.411 0 CA-C-O 121.486 0.66 . . . . 0.0 109.251 179.625 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 136' ' ' LYS . . . . . 0.432 ' HG2' ' H ' ' A' ' 136' ' ' LYS . 59.0 mmtt -51.38 -38.3 52.63 Favored 'General case' 0 C--N 1.318 -0.791 0 O-C-N 121.661 -0.649 . . . . 0.0 109.827 179.549 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 46.1 m -54.84 -66.01 0.48 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.548 -179.547 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 14.8 p -63.33 -34.65 68.4 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.146 -178.902 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 5.8 p -73.22 -33.55 65.41 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.758 -178.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 140' ' ' ASP . . . . . 0.403 ' N ' ' O ' ' A' ' 136' ' ' LYS . 8.9 t70 -65.1 -30.73 71.7 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.427 -179.614 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -62.91 -27.22 69.22 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.778 -179.176 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -59.85 -28.91 67.91 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.67 -179.169 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 70.0 mm-40 -81.53 66.16 6.97 Favored 'General case' 0 CA--C 1.517 -0.291 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.543 -179.777 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER 175.78 -37.93 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.783 -179.981 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 145' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -143.62 73.83 17.04 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.138 -179.318 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 146' ' ' PRO . . . . . 0.629 ' C ' ' H ' ' A' ' 148' ' ' THR . 86.8 Cg_exo -38.7 106.47 0.05 OUTLIER 'Trans proline' 0 C--N 1.32 -0.956 0 C-N-CA 122.945 2.43 . . . . 0.0 111.8 179.89 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 147' ' ' PRO . . . . . 0.538 ' C ' ' H ' ' A' ' 149' ' ' THR . 49.6 Cg_exo -55.17 10.27 0.03 OUTLIER 'Trans proline' 0 C--N 1.309 -1.551 0 C-N-CA 122.665 2.243 . . . . 0.0 112.4 179.224 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 148' ' ' THR . . . . . 0.629 ' H ' ' C ' ' A' ' 146' ' ' PRO . 61.8 m -55.38 -2.65 0.05 OUTLIER 'General case' 0 N--CA 1.445 -0.713 0 CA-C-O 120.744 0.307 . . . . 0.0 110.714 179.303 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 149' ' ' THR . . . . . 0.538 ' H ' ' C ' ' A' ' 147' ' ' PRO . 62.5 p -124.28 162.55 23.51 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-O 121.012 0.434 . . . . 0.0 110.223 179.458 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -68.05 -47.53 68.11 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.716 -179.814 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 87.1 mt-30 -66.14 -30.27 70.73 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.621 -179.812 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . -59.98 -34.29 82.67 Favored Glycine 0 CA--C 1.523 0.553 0 N-CA-C 111.085 -0.806 . . . . 0.0 111.085 -179.287 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 153' ' ' VAL . . . . . . . . . . . . . 62.4 t -65.61 -41.68 91.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 120.783 0.325 . . . . 0.0 110.688 -179.798 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 78.9 mt -45.31 -37.58 4.94 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.598 -179.108 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -62.3 -58.82 6.31 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.136 178.989 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 24.0 mm -53.68 -42.63 51.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.735 -179.439 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -56.71 -47.58 79.63 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 123.562 0.539 . . . . 0.0 110.548 178.948 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 34.8 tptt -61.66 -36.61 81.32 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.376 -179.797 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -72.32 -30.19 64.53 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.476 -179.658 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 160' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -66.11 -50.95 62.25 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.266 179.742 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 61.6 ttp180 -65.0 -31.24 72.38 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.099 179.522 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 40.9 tp10 -64.34 -61.31 2.31 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.124 -178.77 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 163' ' ' LYS . . . . . . . . . . . . . 23.9 tptp -60.36 -34.36 73.75 Favored 'General case' 0 N--CA 1.447 -0.605 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.533 -179.981 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 38.3 tp -66.21 -37.84 86.52 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.249 -179.881 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 65.9 mm-40 -70.14 -28.37 65.31 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.909 -179.64 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 166' ' ' ARG . . . . . 0.644 HH21 ' HZ1' ' A' ' 170' ' ' LYS . 76.0 ttt180 -63.76 -34.13 77.21 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.399 -179.91 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 167' ' ' VAL . . . . . . . . . . . . . 70.1 t -67.04 -43.69 88.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.321 -179.667 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 12.6 t60 -78.59 -31.57 47.24 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.816 -179.277 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 169' ' ' THR . . . . . . . . . . . . . 92.6 m -68.5 -47.03 68.07 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.849 -179.49 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 170' ' ' LYS . . . . . 0.644 ' HZ1' HH21 ' A' ' 166' ' ' ARG . 28.1 mmtp -60.74 -45.39 94.48 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.694 -179.539 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 171' ' ' ASN . . . . . . . . . . . . . 6.8 m120 -66.61 -36.82 83.53 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.51 179.58 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 172' ' ' TYR . . . . . . . . . . . . . 84.4 t80 -66.53 -41.6 88.51 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.67 -179.434 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 41.0 t -67.75 -39.64 84.2 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.685 -179.444 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 174' ' ' THR . . . . . 0.405 HG23 ' O ' ' A' ' 170' ' ' LYS . 31.4 p -66.01 -34.94 79.23 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.794 -179.62 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 6.3 mt -64.17 -38.45 91.11 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.032 179.497 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 66.3 mmtt -62.4 -5.76 2.74 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.527 179.979 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 177' ' ' LYS . . . . . . . . . . . . . 62.9 tttp -63.76 -42.16 97.86 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.823 179.548 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 178' ' ' LYS . . . . . . . . . . . . . 98.9 mttt . . . . . 0 C--N 1.326 -0.443 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.649 -179.827 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.172 0 CA-C-O 120.892 0.377 . . . . 0.0 110.648 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 24.8 m -64.14 -31.18 72.27 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.1 179.568 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 55.7 tptt -63.36 -50.19 70.91 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 120.315 -0.554 . . . . 0.0 110.646 -179.478 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 71.4 mt -63.16 -27.95 44.12 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.003 -178.921 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 41.4 ttm180 -71.41 -39.46 71.11 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.889 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 64.9 mt -68.93 -37.71 79.07 Favored 'General case' 0 CA--C 1.514 -0.415 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.73 -179.583 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 47.0 tp10 -73.21 -43.37 61.41 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.496 -179.741 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 43.7 ttm180 -63.4 -43.75 96.64 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.588 -179.324 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 37.9 m -69.0 -29.68 67.92 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.273 -179.961 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -75.05 -36.27 61.84 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.902 179.855 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -65.42 -31.42 72.51 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.832 -179.556 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 10.9 m-20 -66.93 -24.67 66.11 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.967 -179.635 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 98.3 mt -64.37 -48.42 85.37 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.311 0 C-N-CA 120.678 -0.409 . . . . 0.0 111.088 -179.19 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 77.2 p -73.23 -38.66 65.97 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.102 -178.712 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 65.6 t0 -64.0 -37.89 89.09 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.663 -179.364 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 9.9 tm-20 -67.36 -49.53 63.59 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.922 0.391 . . . . 0.0 111.434 -179.352 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 8.4 pt -72.18 -26.71 25.3 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.732 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.46 -179.614 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -62.33 -42.31 99.28 Favored 'General case' 0 C--N 1.322 -0.609 0 C-N-CA 120.729 -0.389 . . . . 0.0 110.525 179.337 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -53.22 -27.68 23.15 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.215 -178.918 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 66.2 mt -63.11 -45.76 97.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.077 179.62 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 23.3 mmtp -54.57 -41.31 69.7 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.153 -179.17 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 28.3 mmtp -65.51 -43.73 89.18 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.588 179.624 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 47.3 t0 -62.06 -43.86 97.92 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.386 -179.731 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -58.99 -30.73 68.19 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.909 -179.809 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -56.09 -37.45 69.38 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.054 -179.392 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.513 HD12 ' N ' ' A' ' 55' ' ' LEU . 10.0 mp . . . . . 0 C--N 1.326 -0.455 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.131 -178.487 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . 0.452 ' OD1' ' N ' ' A' ' 75' ' ' ASN . 1.4 m-20 . . . . . 0 CA--C 1.535 0.388 0 N-CA-C 110.664 -0.124 . . . . 0.0 110.664 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -70.19 6.07 1.6 Allowed 'Trans proline' 0 N--CA 1.494 1.53 0 C-N-CA 122.156 1.904 . . . . 0.0 112.156 -179.26 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 68.0 t80 -77.52 -58.99 2.97 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.948 0.404 . . . . 0.0 111.515 -179.946 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 19.6 tt -75.64 -27.98 19.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.768 -179.643 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 82.9 mt -73.54 -49.95 23.84 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.463 -178.855 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 99.2 mt-10 -64.45 -22.79 67.07 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.298 179.859 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -59.69 -28.44 67.3 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.867 0.365 . . . . 0.0 110.912 -179.862 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -69.44 -20.48 63.77 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.536 -179.921 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 50.3 t -73.66 -45.08 51.75 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-O 120.998 0.428 . . . . 0.0 110.805 179.621 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 84.3 mtp180 -66.95 -35.39 79.87 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.553 -179.799 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -66.15 -39.36 89.77 Favored 'General case' 0 CA--C 1.517 -0.324 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.58 -179.701 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 34.0 p -78.91 -14.5 59.19 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.716 -179.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 33.4 m -62.07 -54.5 40.46 Favored 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 120.417 -0.513 . . . . 0.0 111.456 -179.224 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.517 HG13 ' N ' ' A' ' 89' ' ' ALA . 13.2 p -79.76 -44.55 23.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-O 121.35 0.595 . . . . 0.0 111.491 179.008 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . 0.517 ' N ' HG13 ' A' ' 88' ' ' VAL . . . -53.58 -49.36 67.9 Favored 'General case' 0 CA--C 1.52 -0.208 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.324 -176.672 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.451 ' CG ' ' N ' ' A' ' 91' ' ' LYS . 16.0 pt-20 -58.74 -45.67 89.14 Favored 'General case' 0 C--N 1.315 -0.911 0 C-N-CA 120.793 -0.363 . . . . 0.0 110.807 -179.91 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . 0.451 ' N ' ' CG ' ' A' ' 90' ' ' GLU . 98.3 mttt -58.23 -36.51 73.28 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.064 -0.517 . . . . 0.0 109.856 -179.194 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 56.4 t80 -62.43 -41.6 98.84 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.834 179.612 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 81.0 t -58.27 -45.08 89.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.203 -179.142 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 65.4 mt -53.93 -42.12 52.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-O 120.802 0.334 . . . . 0.0 110.331 -179.818 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -52.47 -36.99 56.06 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.22 -179.679 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 34.9 mm -65.45 -43.54 94.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.301 -179.773 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -64.87 -49.24 71.3 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.752 -179.674 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 80.8 tt0 -63.54 -38.98 93.19 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.011 0.434 . . . . 0.0 110.413 -179.364 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -71.19 -28.98 64.62 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.296 -179.954 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -65.84 -52.38 50.93 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.657 -179.181 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . 0.405 ' H ' HG22 ' A' ' 101' ' ' THR . 1.7 t -58.27 -35.41 71.74 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.812 -179.535 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 47.3 mttp -63.77 -29.06 70.31 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.666 179.806 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 67.1 mt . . . . . 0 C--N 1.33 -0.264 0 CA-C-O 120.732 0.301 . . . . 0.0 110.691 -179.476 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 69.0 p . . . . . 0 N--CA 1.466 0.341 0 CA-C-O 120.904 0.383 . . . . 0.0 110.432 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -72.25 -28.31 68.35 Favored Glycine 0 CA--C 1.525 0.657 0 N-CA-C 111.341 -0.704 . . . . 0.0 111.341 179.666 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 79.9 tt0 -54.38 -34.29 60.92 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.71 0.291 . . . . 0.0 110.753 -179.129 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 61.4 m-85 -61.25 -39.04 88.84 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.607 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 40.0 t -58.84 -39.9 82.63 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.34 -179.793 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -63.7 -35.71 81.47 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.79 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 96.1 mtp -68.1 -40.35 82.62 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.131 -179.901 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 29.7 t80 -58.67 -28.13 65.45 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.313 179.87 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 66.3 t0 -57.54 -35.26 70.08 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.91 0.386 . . . . 0.0 110.48 -179.112 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 21.3 mt -58.5 -40.48 82.92 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.052 0.453 . . . . 0.0 110.034 -179.62 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.26 -53.6 52.75 Favored 'General case' 0 C--N 1.313 -0.996 0 C-N-CA 120.083 -0.647 . . . . 0.0 110.058 -179.335 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 52.8 t80 -59.36 -47.05 86.91 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.112 -179.316 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 51.3 tp10 -60.16 -35.38 75.19 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.089 -179.496 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 42.8 t -83.45 -19.85 9.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 N-CA-C 110.001 -0.37 . . . . 0.0 110.001 179.841 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 60.0 p -74.88 -27.2 60.15 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.931 0.396 . . . . 0.0 111.213 -179.612 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . 0.501 ' N ' ' HD2' ' A' ' 125' ' ' PRO . 8.0 mmtp -66.29 -57.25 13.28 Favored Pre-proline 0 C--N 1.323 -0.585 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.53 -179.541 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 125' ' ' PRO . . . . . 0.501 ' HD2' ' N ' ' A' ' 124' ' ' LYS . 23.8 Cg_endo -58.44 -31.66 94.63 Favored 'Trans proline' 0 C--N 1.314 -1.242 0 C-N-CA 122.24 1.96 . . . . 0.0 111.837 -179.358 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 81.2 mt -68.34 -32.53 72.71 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.676 -179.942 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -59.24 -47.05 86.78 Favored 'General case' 0 C--N 1.317 -0.82 0 C-N-CA 120.406 -0.517 . . . . 0.0 110.421 -179.29 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -69.67 -11.74 61.08 Favored 'General case' 0 CA--C 1.509 -0.619 0 CA-C-N 116.041 -0.527 . . . . 0.0 109.799 -179.614 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.422 HD22 ' HA ' ' A' ' 129' ' ' LEU . 0.2 OUTLIER -87.45 -55.93 3.58 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.168 0.509 . . . . 0.0 110.5 -179.741 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -175.67 -137.68 2.62 Favored Glycine 0 N--CA 1.451 -0.353 0 N-CA-C 110.675 -0.97 . . . . 0.0 110.675 -179.084 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 131' ' ' ILE . . . . . 0.687 HG22 ' H ' ' A' ' 132' ' ' GLN . 1.7 mt 54.26 -150.38 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 N-CA-C 109.944 -0.391 . . . . 0.0 109.944 179.309 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 132' ' ' GLN . . . . . 0.687 ' H ' HG22 ' A' ' 131' ' ' ILE . 4.6 tt0 179.99 138.15 0.12 Allowed 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.424 179.785 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 51.06 24.74 2.0 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.882 0.372 . . . . 0.0 110.848 178.479 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 10.4 tpt -58.95 -40.19 83.94 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.895 -0.593 . . . . 0.0 109.985 -179.605 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 21.7 m -74.19 -61.34 1.89 Allowed 'General case' 0 N--CA 1.467 0.413 0 CA-C-O 121.606 0.717 . . . . 0.0 110.284 -179.996 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 2.2 tppp? -49.31 -42.17 40.58 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-O 121.518 0.675 . . . . 0.0 110.451 -178.354 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 23.0 m -56.11 -68.49 0.2 Allowed 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.298 -0.864 . . . . 0.0 111.194 -179.241 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 14.6 p -55.92 -34.74 38.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 C-N-CA 120.723 -0.391 . . . . 0.0 110.681 -178.629 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 25.0 p -63.91 -36.89 85.44 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.622 -179.863 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 57.0 t0 -66.19 -28.06 68.48 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.594 179.811 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -67.23 -42.34 84.18 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-O 120.837 0.351 . . . . 0.0 111.1 -179.655 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -62.94 -30.13 71.33 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.396 -179.513 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 77.5 tt0 -68.31 -39.98 81.85 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.768 0.318 . . . . 0.0 110.71 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 78.7 tt0 -70.27 -41.32 73.58 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.904 -179.591 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 145' ' ' ASN . . . . . . . . . . . . . 30.0 m120 -135.27 76.57 56.54 Favored Pre-proline 0 N--CA 1.468 0.45 0 CA-C-N 116.607 -0.269 . . . . 0.0 110.556 -179.459 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 146' ' ' PRO . . . . . . . . . . . . . 78.5 Cg_exo -48.72 109.59 0.27 Allowed 'Trans proline' 0 N--CA 1.492 1.4 0 C-N-CA 122.601 2.201 . . . . 0.0 111.45 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 147' ' ' PRO . . . . . . . . . . . . . 85.1 Cg_exo -46.86 116.93 1.87 Allowed 'Trans proline' 0 N--CA 1.494 1.505 0 C-N-CA 121.813 1.675 . . . . 0.0 112.472 -179.759 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 9.1 m -130.7 -7.64 4.06 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.637 179.247 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 149' ' ' THR . . . . . 0.585 HG22 ' N ' ' A' ' 150' ' ' ALA . 85.3 m -159.51 167.34 28.84 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.849 0.357 . . . . 0.0 110.266 179.506 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 150' ' ' ALA . . . . . 0.585 ' N ' HG22 ' A' ' 149' ' ' THR . . . -51.91 -28.91 17.92 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.131 179.769 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 84.7 mt-30 -73.07 -40.48 65.0 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.476 179.501 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . -59.53 -46.09 94.53 Favored Glycine 0 C--O 1.223 -0.555 0 N-CA-C 111.015 -0.834 . . . . 0.0 111.015 -179.593 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 153' ' ' VAL . . . . . . . . . . . . . 58.3 t -63.4 -42.25 95.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-O 120.831 0.348 . . . . 0.0 110.459 -179.807 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 154' ' ' LEU . . . . . 0.406 HD23 ' O ' ' A' ' 154' ' ' LEU . 0.8 OUTLIER -51.28 -36.17 40.92 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.254 -178.881 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 97.3 mt-10 -67.51 -33.79 75.8 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.082 -179.952 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 11.6 mm -77.82 -39.08 25.81 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.275 0 CA-C-O 121.028 0.442 . . . . 0.0 111.024 179.496 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -62.4 -40.69 97.31 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.641 -179.127 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -60.11 -45.87 91.51 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.045 0.45 . . . . 0.0 110.041 -179.802 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 61.8 tttm -66.65 -27.56 67.77 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.92 -179.716 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 160' ' ' MET . . . . . . . . . . . . . 22.6 mtp -74.17 -51.63 14.95 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.883 0.373 . . . . 0.0 110.451 -179.492 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 28.7 ttm180 -64.56 -37.47 87.67 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.671 -179.196 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 51.4 mm-40 -62.21 -42.73 99.56 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.854 -179.214 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 163' ' ' LYS . . . . . . . . . . . . . 86.5 tttt -65.44 -55.22 19.17 Favored 'General case' 0 C--N 1.323 -0.547 0 C-N-CA 120.316 -0.553 . . . . 0.0 110.653 -179.191 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 9.1 mp -53.34 -32.45 49.17 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.948 0.404 . . . . 0.0 110.152 -179.333 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 61.2 tp60 -62.09 -45.92 91.39 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.439 -179.412 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 69.2 ttp85 -64.3 -30.76 71.79 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.24 0.543 . . . . 0.0 111.041 -179.845 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 167' ' ' VAL . . . . . . . . . . . . . 56.0 t -69.56 -44.84 79.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 115.41 -0.814 . . . . 0.0 110.511 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 168' ' ' HIS . . . . . 0.423 ' O ' ' ND1' ' A' ' 168' ' ' HIS . 31.0 t-80 -77.7 -30.3 51.76 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.081 179.995 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 169' ' ' THR . . . . . 0.442 ' O ' ' SG ' ' A' ' 173' ' ' CYS . 91.3 m -69.26 -49.84 52.5 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.841 -179.913 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 28.5 mmtp -63.73 -45.05 91.65 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.828 0.346 . . . . 0.0 111.068 -179.263 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 171' ' ' ASN . . . . . . . . . . . . . 97.9 m-20 -65.21 -39.71 93.14 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.121 -179.753 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 172' ' ' TYR . . . . . . . . . . . . . 66.2 t80 -75.04 -34.42 61.86 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.799 179.83 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 173' ' ' CYS . . . . . 0.442 ' SG ' ' O ' ' A' ' 169' ' ' THR . 66.9 m -71.62 -23.05 61.64 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.482 179.95 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 19.3 m -62.25 -42.77 99.62 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.689 -179.815 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 175' ' ' LEU . . . . . 0.498 HD12 ' N ' ' A' ' 175' ' ' LEU . 10.1 mp -65.83 -34.61 78.55 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.575 -179.238 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -55.49 -30.79 61.27 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.322 -179.553 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 177' ' ' LYS . . . . . . . . . . . . . 85.8 tttt -61.08 -33.75 73.83 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.57 179.543 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 178' ' ' LYS . . . . . . . . . . . . . 55.7 mtpt . . . . . 0 C--N 1.32 -0.68 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.085 -179.912 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.144 0 CA-C-O 120.957 0.408 . . . . 0.0 110.315 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 19.6 m -65.4 -35.38 80.76 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.585 179.653 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 64.0 tttp -62.72 -53.14 58.95 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.046 0.45 . . . . 0.0 110.685 -179.57 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 71.1 mt -63.1 -30.23 49.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.093 -179.842 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 40.5 ttm180 -67.23 -41.97 84.82 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.754 -179.85 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 46.8 mt -73.47 -36.37 65.82 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.504 -0.316 . . . . 0.0 111.132 -179.61 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 78.6 tt0 -63.18 -50.77 69.03 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.537 -179.112 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -69.93 -44.61 69.23 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.841 0.353 . . . . 0.0 110.628 -179.671 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 70.3 m -62.68 -35.81 80.87 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.614 -179.974 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -73.69 -39.65 64.23 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.351 -179.913 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 37.4 ttmt -61.44 -31.94 71.9 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.66 -179.051 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -68.18 -23.52 64.86 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.73 -179.437 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 63.5 mt -64.91 -50.38 75.36 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 C-N-CA 120.627 -0.429 . . . . 0.0 111.333 -179.143 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 71.9 p -75.24 -42.28 55.64 Favored 'General case' 0 C--O 1.223 -0.321 0 CA-C-O 121.043 0.449 . . . . 0.0 111.762 -178.662 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 82.2 m-20 -62.11 -34.34 76.15 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.773 -178.322 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 55.5 mm-40 -72.76 -56.1 5.76 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.874 0.369 . . . . 0.0 111.571 -179.529 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.562 ' O ' HG22 ' A' ' 49' ' ' ILE . 9.7 pt -63.81 -27.75 43.52 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.069 -178.838 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 88.4 m-20 -70.72 -35.08 72.54 Favored 'General case' 0 N--CA 1.465 0.275 0 O-C-N 123.342 0.401 . . . . 0.0 110.907 179.841 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -52.66 -21.18 3.69 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.45 -179.501 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.562 HG22 ' O ' ' A' ' 46' ' ' ILE . 16.9 tt -60.61 -40.55 84.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.837 -179.501 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.441 ' N ' HG23 ' A' ' 49' ' ' ILE . 56.0 mtpt -51.6 -34.92 39.43 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.505 -178.744 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 34.4 mmtp -66.87 -39.5 87.55 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.61 179.865 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 50.5 t0 -70.35 -51.82 27.15 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.776 0.322 . . . . 0.0 110.844 -179.756 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -55.07 -34.34 63.51 Favored 'General case' 0 C--O 1.222 -0.351 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.445 -179.5 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -58.66 -31.69 68.41 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.887 0.375 . . . . 0.0 110.819 179.956 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 61.0 mt . . . . . 0 C--N 1.326 -0.426 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.937 -179.268 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . 0.577 ' C ' ' H ' ' A' ' 77' ' ' PHE . 8.0 m120 . . . . . 0 N--CA 1.472 0.653 0 N-CA-C 109.465 -0.569 . . . . 0.0 109.465 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_exo -59.3 18.62 0.03 OUTLIER 'Trans proline' 0 N--CA 1.498 1.789 0 C-N-CA 122.642 2.228 . . . . 0.0 112.401 179.656 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . 0.577 ' H ' ' C ' ' A' ' 75' ' ' ASN . 75.3 t80 -75.06 -52.75 10.28 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.017 0.437 . . . . 0.0 110.925 179.803 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 15.1 tt -76.33 -27.57 17.66 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.244 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.319 -179.879 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 56.6 mt -72.99 -43.69 61.92 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.032 0.444 . . . . 0.0 111.377 -179.684 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 92.0 mt-10 -67.6 -24.17 65.45 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.54 179.477 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -64.92 -34.33 78.16 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.878 0.37 . . . . 0.0 111.004 -179.9 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 48.7 mtmt -72.89 -20.64 61.05 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.698 -179.663 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 48.3 t -72.81 -44.89 57.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 121.016 0.436 . . . . 0.0 110.61 179.865 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 91.4 mtt-85 -71.14 -30.03 65.98 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.361 -179.874 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -65.07 -46.4 81.31 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.047 0.451 . . . . 0.0 111.568 -179.146 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 5.7 t -75.43 -20.87 58.6 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.288 179.966 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 96.3 m -62.05 -53.54 54.13 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.528 -0.469 . . . . 0.0 111.244 -179.218 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 35.4 t -70.41 -44.32 77.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-O 121.092 0.473 . . . . 0.0 110.829 -179.591 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -59.17 -36.7 75.78 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.971 -0.558 . . . . 0.0 110.601 -179.052 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 84.3 tt0 -56.68 -44.93 81.93 Favored 'General case' 0 C--N 1.323 -0.577 0 C-N-CA 120.565 -0.454 . . . . 0.0 110.515 -179.933 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 9.7 mtpm? -56.66 -39.18 73.29 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.371 -179.3 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 76.9 t80 -59.3 -45.97 89.84 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.806 -179.855 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 65.2 t -56.03 -44.86 79.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-O 120.83 0.348 . . . . 0.0 110.401 -178.817 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 96.7 mt -58.94 -41.17 82.26 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 -179.335 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -56.1 -44.7 79.32 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.464 -0.334 . . . . 0.0 110.751 -179.452 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 44.4 mm -61.42 -41.78 91.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.177 -179.682 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 83.7 tt0 -60.61 -48.57 81.2 Favored 'General case' 0 C--N 1.323 -0.58 0 C-N-CA 120.651 -0.42 . . . . 0.0 110.586 -179.825 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 14.8 mm-40 -66.22 -32.22 73.52 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.561 -179.55 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -59.7 -39.65 85.32 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.417 -179.152 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -59.28 -27.59 65.96 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.037 -0.528 . . . . 0.0 110.302 -179.416 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 8.5 m -60.65 -43.33 97.71 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.504 -179.48 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -71.22 -16.57 62.51 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.472 -179.603 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 77.8 mt . . . . . 0 CA--C 1.5 -0.966 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.406 -179.341 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 15.0 m . . . . . 0 CA--C 1.527 0.091 0 CA-C-O 120.844 0.354 . . . . 0.0 110.449 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -59.04 -33.36 73.99 Favored Glycine 0 CA--C 1.522 0.487 0 N-CA-C 110.792 -0.923 . . . . 0.0 110.792 -179.658 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 42.7 tp10 -66.73 -43.34 84.5 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 120.77 -0.372 . . . . 0.0 110.3 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 112' ' ' PHE . . . . . 0.436 ' O ' ' N ' ' A' ' 115' ' ' MET . 48.3 m-85 -67.62 -37.57 82.68 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.625 -179.956 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 59.9 p -47.31 -34.71 7.08 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.967 0.413 . . . . 0.0 110.67 -179.039 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -76.44 -28.85 56.74 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.778 178.854 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 115' ' ' MET . . . . . 0.436 ' N ' ' O ' ' A' ' 112' ' ' PHE . 60.9 mmm -73.38 -44.71 58.0 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.234 -179.844 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 7.4 m-85 -60.24 -49.43 77.64 Favored 'General case' 0 CA--C 1.513 -0.445 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 -179.388 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 66.8 t0 -47.75 -32.15 5.58 Favored 'General case' 0 N--CA 1.453 -0.28 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 -179.084 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.515 HD13 ' O ' ' A' ' 118' ' ' LEU . 0.2 OUTLIER -62.23 -44.81 95.72 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.73 -179.992 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 119' ' ' MET . . . . . 0.415 ' C ' ' SD ' ' A' ' 119' ' ' MET . 0.0 OUTLIER -52.16 -42.91 63.79 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.238 -0.892 . . . . 0.0 109.724 -178.988 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 85.4 m-85 -68.06 -39.61 82.97 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.06 -179.828 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 87.7 mt-10 -59.61 -45.76 90.96 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.779 -179.344 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 122' ' ' VAL . . . . . 0.552 ' O ' HD23 ' A' ' 126' ' ' LEU . 7.7 p -75.08 -24.66 17.88 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.822 0 O-C-N 123.314 0.384 . . . . 0.0 110.042 179.344 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 23.0 t -75.5 -25.75 57.55 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.832 0.348 . . . . 0.0 111.037 179.862 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . 0.481 ' N ' ' HD2' ' A' ' 125' ' ' PRO . 43.6 tptt -59.55 -57.25 28.32 Favored Pre-proline 0 CA--C 1.549 0.92 0 C-N-CA 120.557 -0.457 . . . . 0.0 110.777 179.797 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 125' ' ' PRO . . . . . 0.481 ' HD2' ' N ' ' A' ' 124' ' ' LYS . 31.8 Cg_endo -60.28 -25.78 81.02 Favored 'Trans proline' 0 N--CA 1.489 1.208 0 C-N-CA 122.597 2.198 . . . . 0.0 111.783 -178.387 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.552 HD23 ' O ' ' A' ' 122' ' ' VAL . 2.5 mm? -64.65 -32.77 74.57 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.69 -179.211 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 78.6 mt-30 -57.28 -38.22 73.58 Favored 'General case' 0 C--N 1.31 -1.129 0 C-N-CA 120.403 -0.519 . . . . 0.0 110.306 -179.859 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 32.4 mmtp -61.61 -10.98 9.45 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.752 -179.614 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 15.4 mt -114.47 -2.52 13.18 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.973 179.743 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 130' ' ' GLY . . . . . 0.525 ' O ' ' C ' ' A' ' 131' ' ' ILE . . . 114.43 -94.78 0.7 Allowed Glycine 0 CA--C 1.503 -0.687 0 N-CA-C 109.82 -1.312 . . . . 0.0 109.82 179.942 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 131' ' ' ILE . . . . . 0.525 ' C ' ' O ' ' A' ' 130' ' ' GLY . 4.8 mp -3.46 88.46 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.084 0 O-C-N 124.902 1.001 . . . . 0.0 110.703 179.837 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 132' ' ' GLN . . . . . 0.489 ' O ' ' HB2' ' A' ' 133' ' ' GLU . 19.4 tt0 -123.51 162.62 22.54 Favored 'General case' 0 CA--C 1.486 -1.514 0 N-CA-C 107.294 -1.372 . . . . 0.0 107.294 -178.583 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 133' ' ' GLU . . . . . 0.489 ' HB2' ' O ' ' A' ' 132' ' ' GLN . 92.4 mt-10 106.22 -19.4 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.972 0 O-C-N 125.785 1.928 . . . . 0.0 109.757 179.536 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 5.0 mtp -52.85 -48.2 67.22 Favored 'General case' 0 C--N 1.319 -0.735 0 C-N-CA 120.36 -0.536 . . . . 0.0 110.899 -179.277 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 65.7 p -52.58 -21.62 4.07 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.57 178.796 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 70.3 mmtt -83.31 -48.09 10.8 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 115.626 -0.715 . . . . 0.0 111.304 -179.651 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 46.5 p -54.05 -50.22 67.2 Favored 'General case' 0 C--N 1.324 -0.505 0 C-N-CA 120.827 -0.349 . . . . 0.0 110.745 -178.983 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 58.3 t -68.72 -44.35 82.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.088 -179.881 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 47.6 t -65.34 -41.29 94.07 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.954 0.407 . . . . 0.0 111.14 -179.846 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -64.21 -42.1 96.76 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.665 -179.539 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -63.54 -47.59 80.96 Favored 'General case' 0 CA--C 1.519 -0.248 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.998 -179.626 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -46.54 -35.46 5.8 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.944 -179.292 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -90.61 77.15 6.43 Favored 'General case' 0 CA--C 1.517 -0.301 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 179.509 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 79.2 tt0 -177.64 -61.23 0.01 OUTLIER 'General case' 0 C--N 1.334 -0.077 0 O-C-N 123.593 0.558 . . . . 0.0 110.434 179.644 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 145' ' ' ASN . . . . . . . . . . . . . 7.2 p-10 -143.01 64.63 14.71 Favored Pre-proline 0 N--CA 1.467 0.402 0 CA-C-N 116.196 -0.457 . . . . 0.0 109.897 -179.575 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 146' ' ' PRO . . . . . 0.547 ' O ' ' N ' ' A' ' 148' ' ' THR . 80.7 Cg_exo -34.24 98.78 0.02 OUTLIER 'Trans proline' 0 N--CA 1.491 1.329 0 C-N-CA 123.304 2.669 . . . . 0.0 111.722 -179.503 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 147' ' ' PRO . . . . . 0.526 ' C ' ' H ' ' A' ' 149' ' ' THR . 59.6 Cg_exo -51.48 74.2 0.02 OUTLIER 'Trans proline' 0 N--CA 1.496 1.671 0 C-N-CA 122.354 2.036 . . . . 0.0 113.14 -179.294 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 148' ' ' THR . . . . . 0.547 ' N ' ' O ' ' A' ' 146' ' ' PRO . 8.1 p -73.17 21.43 0.08 Allowed 'General case' 0 C--N 1.329 -0.309 0 O-C-N 121.997 -0.439 . . . . 0.0 109.981 179.883 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 149' ' ' THR . . . . . 0.656 HG23 ' H ' ' A' ' 152' ' ' GLY . 1.2 t -148.52 156.36 42.34 Favored 'General case' 0 CA--C 1.52 -0.176 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.161 -179.881 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -64.75 -33.78 76.78 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.958 -179.784 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 7.2 tt0 -68.74 -44.41 73.85 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.881 0.372 . . . . 0.0 110.753 -179.784 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 152' ' ' GLY . . . . . 0.656 ' H ' HG23 ' A' ' 149' ' ' THR . . . -56.53 -38.3 79.97 Favored Glycine 0 CA--C 1.52 0.366 0 N-CA-C 110.871 -0.892 . . . . 0.0 110.871 -179.198 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 153' ' ' VAL . . . . . . . . . . . . . 75.9 t -53.51 -32.53 20.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 C-N-CA 120.923 -0.311 . . . . 0.0 110.503 -179.392 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 72.5 mt -56.85 -27.47 60.37 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.94 0.4 . . . . 0.0 110.112 -179.505 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 67.3 mm-40 -66.92 -32.82 74.33 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.258 179.583 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 156' ' ' ILE . . . . . 0.428 HG22 ' SD ' ' A' ' 160' ' ' MET . 14.7 mm -75.23 -41.53 44.07 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.182 0 CA-C-O 120.931 0.396 . . . . 0.0 110.88 179.605 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -50.8 -39.22 52.3 Favored 'General case' 0 CA--C 1.516 -0.341 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.379 -179.646 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 158' ' ' LYS . . . . . 0.436 ' O ' ' CB ' ' A' ' 162' ' ' GLU . 99.6 mttt -56.38 -56.63 18.76 Favored 'General case' 0 C--O 1.216 -0.664 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.447 179.787 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 42.7 mmtm -57.96 -36.49 72.66 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.757 0.313 . . . . 0.0 111.007 -179.375 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 160' ' ' MET . . . . . 0.428 ' SD ' HG22 ' A' ' 156' ' ' ILE . 6.2 mtp -67.44 -57.4 6.61 Favored 'General case' 0 C--N 1.322 -0.588 0 C-N-CA 120.398 -0.521 . . . . 0.0 110.826 -179.526 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 61.4 ttp180 -68.71 -35.86 77.71 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.881 -179.483 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 162' ' ' GLU . . . . . 0.436 ' CB ' ' O ' ' A' ' 158' ' ' LYS . 81.2 tt0 -65.14 -35.54 81.42 Favored 'General case' 0 CA--C 1.512 -0.495 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.536 -179.275 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 163' ' ' LYS . . . . . . . . . . . . . 23.3 tptm -70.58 -56.5 6.37 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 119.992 -0.683 . . . . 0.0 110.845 -179.131 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 4.8 mt -55.17 -28.96 56.67 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.187 0.518 . . . . 0.0 110.081 -178.519 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 54.3 tt0 -61.71 -47.82 83.56 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.718 -0.673 . . . . 0.0 110.388 -179.71 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -62.09 -30.52 71.06 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.4 0.619 . . . . 0.0 110.731 -179.595 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 167' ' ' VAL . . . . . . . . . . . . . 51.8 t -67.2 -46.57 83.89 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-N 115.038 -0.983 . . . . 0.0 110.693 -179.694 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 168' ' ' HIS . . . . . 0.469 ' O ' ' ND1' ' A' ' 168' ' ' HIS . 23.6 t-80 -79.68 -30.52 41.15 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.193 -179.791 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 169' ' ' THR . . . . . . . . . . . . . 27.5 m -72.99 -45.35 58.41 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.409 -179.904 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 64.7 tttm -61.9 -42.26 98.87 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.663 -179.047 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 171' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -69.84 -31.47 69.35 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.609 179.829 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 172' ' ' TYR . . . . . . . . . . . . . 74.2 t80 -70.05 -32.26 70.29 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.887 -179.833 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 86.5 m -76.24 -32.93 59.15 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.734 -179.822 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 21.4 p -63.62 -37.17 86.33 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.842 0.353 . . . . 0.0 110.477 -179.856 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 94.9 mt -65.49 -34.78 79.07 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.39 -179.928 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 72.6 mmtt -63.44 -8.63 9.64 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.477 -179.818 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 177' ' ' LYS . . . . . . . . . . . . . 62.7 tttm -63.42 -35.86 81.84 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.658 179.124 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 178' ' ' LYS . . . . . . . . . . . . . 99.5 mttt . . . . . 0 C--N 1.325 -0.491 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.863 179.897 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.55 0 CA-C-O 120.988 0.423 . . . . 0.0 109.963 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 25.4 m -49.18 -29.32 5.36 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.55 -178.86 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 21.0 pttp -61.94 -26.3 68.11 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.5 179.596 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 96.6 mt -59.07 -45.12 92.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 -178.549 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 10.1 tpt180 -65.61 -53.07 46.73 Favored 'General case' 0 C--N 1.324 -0.506 0 C-N-CA 120.158 -0.617 . . . . 0.0 110.365 -179.69 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.441 ' N ' HD12 ' A' ' 35' ' ' LEU . 11.0 mp -59.87 -44.9 93.92 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.054 -0.521 . . . . 0.0 109.696 -178.635 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 80.9 tt0 -58.94 -51.01 71.89 Favored 'General case' 0 C--N 1.32 -0.717 0 C-N-CA 120.479 -0.488 . . . . 0.0 110.234 -179.505 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 16.5 mmm180 -68.69 -42.43 77.8 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.962 0.411 . . . . 0.0 110.968 -179.766 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 52.0 m -67.52 -40.08 85.08 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.609 -179.89 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -61.01 -49.49 77.23 Favored 'General case' 0 C--O 1.219 -0.51 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.491 -179.536 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -54.4 -42.75 70.79 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 120.683 -0.407 . . . . 0.0 110.25 -179.09 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 23.9 m-20 -52.93 -22.87 6.11 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.713 179.594 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 81.1 mt -65.81 -59.01 4.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 C-N-CA 120.184 -0.606 . . . . 0.0 110.98 -179.819 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 82.8 p -76.71 -37.22 56.47 Favored 'General case' 0 C--O 1.225 -0.188 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.657 -179.009 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 52.6 t0 -61.94 -41.04 97.5 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.836 -0.62 . . . . 0.0 112.427 -178.088 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 64.8 mm-40 -69.1 -51.76 35.28 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.873 0.368 . . . . 0.0 111.419 -179.194 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 10.2 pt -66.91 -28.59 43.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.531 -179.333 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -61.43 -40.47 94.56 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 110.036 -0.357 . . . . 0.0 110.036 -179.785 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -53.41 -30.07 38.29 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.331 -179.15 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 62.8 mt -67.6 -43.42 86.96 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.333 179.454 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 69.0 mttm -58.21 -46.28 86.12 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.159 -179.087 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 52.1 mtmt -65.62 -41.07 93.11 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.662 179.401 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 96.6 m-20 -61.59 -39.37 90.93 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.029 -179.377 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -60.86 -31.97 71.4 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.596 -179.992 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -59.35 -30.82 68.67 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.892 0.377 . . . . 0.0 110.921 -179.701 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 57.3 mt . . . . . 0 C--N 1.325 -0.494 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.609 -179.349 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 69.8 m-20 . . . . . 0 CA--C 1.534 0.347 0 N-CA-C 110.321 -0.252 . . . . 0.0 110.321 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -74.53 -5.67 17.21 Favored 'Trans proline' 0 N--CA 1.495 1.58 0 C-N-CA 122.443 2.095 . . . . 0.0 111.971 179.903 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 53.5 t80 -72.36 -50.95 22.92 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.907 0.384 . . . . 0.0 111.513 -179.413 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 64.7 mt -69.74 -29.0 39.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.935 -179.296 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.421 ' N ' HD12 ' A' ' 79' ' ' LEU . 8.1 mp -77.01 -48.71 17.18 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 120.862 0.363 . . . . 0.0 110.174 179.778 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -65.44 -29.33 69.99 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.095 -0.502 . . . . 0.0 109.922 179.937 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -66.78 -37.28 84.27 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.706 179.662 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 37.0 ttpt -63.78 -24.2 67.67 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.744 -179.596 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 32.3 t -70.69 -46.6 68.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.668 179.859 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 57.8 ttt85 -62.28 -33.18 74.14 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.32 -179.642 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -59.28 -37.6 78.08 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.121 0.486 . . . . 0.0 110.895 -179.427 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 61.3 p -72.11 -27.7 62.8 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.36 179.638 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 25.0 m -57.61 -53.77 54.4 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 120.443 -0.503 . . . . 0.0 111.252 -178.778 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.565 HG23 ' N ' ' A' ' 89' ' ' ALA . 26.8 m -72.46 -50.8 32.57 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-O 120.92 0.39 . . . . 0.0 111.338 179.668 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . 0.565 ' N ' HG23 ' A' ' 88' ' ' VAL . . . -55.57 -44.25 76.71 Favored 'General case' 0 C--O 1.222 -0.376 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.341 -178.323 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 77.8 tt0 -58.2 -45.45 87.57 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.193 0.52 . . . . 0.0 110.584 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 57.3 mtpt -60.87 -29.65 69.67 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.63 -179.206 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.455 ' CZ ' HD12 ' A' ' 118' ' ' LEU . 82.7 t80 -71.05 -59.38 2.81 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.987 -178.859 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 8.4 m -49.4 -40.29 14.23 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.448 0 N-CA-C 109.921 -0.4 . . . . 0.0 109.921 -178.801 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 88.9 mt -61.94 -43.06 96.97 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 N-CA-C 109.888 -0.412 . . . . 0.0 109.888 179.52 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -57.52 -30.98 65.6 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 120.876 -0.33 . . . . 0.0 110.801 -179.112 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 40.7 mm -59.87 -36.51 67.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.44 -179.512 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -65.78 -34.41 78.12 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.938 179.907 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -65.05 -39.53 93.43 Favored 'General case' 0 C--N 1.326 -0.45 0 C-N-CA 120.851 -0.34 . . . . 0.0 110.358 -179.469 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 80.7 mm-40 -67.38 -39.0 85.59 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.908 0.385 . . . . 0.0 110.744 -179.832 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -53.27 -48.34 68.39 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.956 0.408 . . . . 0.0 110.81 -179.634 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 11.9 m -60.1 -48.24 82.57 Favored 'General case' 0 C--N 1.321 -0.652 0 C-N-CA 120.472 -0.491 . . . . 0.0 110.847 -179.392 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 5.8 mptp? -67.21 -31.57 72.03 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.802 0.334 . . . . 0.0 111.009 179.935 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 27.1 mt . . . . . 0 C--N 1.321 -0.635 0 CA-C-O 120.869 0.366 . . . . 0.0 110.679 -178.803 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 91.4 p . . . . . 0 N--CA 1.469 0.493 0 CA-C-O 120.675 0.274 . . . . 0.0 110.366 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -71.76 -52.79 10.97 Favored Glycine 0 CA--C 1.526 0.754 0 N-CA-C 111.355 -0.698 . . . . 0.0 111.355 179.89 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . 0.505 ' CD ' ' H ' ' A' ' 111' ' ' GLU . 2.5 mp0 -68.31 -22.62 64.7 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.916 0.389 . . . . 0.0 110.876 -179.491 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -59.42 -43.79 92.98 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.24 -178.987 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 43.8 t -60.1 -43.44 95.56 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.212 -179.891 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -65.11 -28.89 69.75 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.733 179.642 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 50.1 tpp -76.11 -52.54 9.92 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.245 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 36.9 t80 -62.08 -50.18 72.97 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 109.777 -0.453 . . . . 0.0 109.777 -179.685 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 52.2 t0 -48.58 -27.73 2.97 Favored 'General case' 0 CA--C 1.517 -0.29 0 N-CA-C 109.652 -0.499 . . . . 0.0 109.652 -179.073 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.49 ' O ' HD13 ' A' ' 118' ' ' LEU . 0.2 OUTLIER -64.68 -46.14 83.7 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.498 0.666 . . . . 0.0 109.893 -179.926 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 14.4 tpt -57.96 -34.26 69.74 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 114.987 -1.006 . . . . 0.0 109.638 -179.305 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 68.1 t80 -71.0 -41.1 71.38 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.317 -0.401 . . . . 0.0 112.046 -179.41 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 65.5 mm-40 -63.45 -44.87 93.24 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.87 -178.937 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 28.9 m -75.22 -23.97 17.37 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.405 0 O-C-N 123.326 0.391 . . . . 0.0 110.749 -179.898 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 21.2 t -68.0 -33.16 74.08 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.631 179.69 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 17.1 mttp -60.24 -56.68 33.06 Favored Pre-proline 0 CA--C 1.541 0.626 0 C-N-CA 121.05 -0.26 . . . . 0.0 110.833 -179.421 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 75.8 Cg_exo -43.58 -36.5 7.18 Favored 'Trans proline' 0 C--N 1.317 -1.113 0 C-N-CA 122.14 1.893 . . . . 0.0 112.442 178.402 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.51 ' HB3' HD13 ' A' ' 131' ' ' ILE . 10.1 mp -70.29 -35.13 73.51 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.981 -179.862 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 40.9 mm-40 -61.51 -52.41 64.6 Favored 'General case' 0 C--N 1.32 -0.683 0 C-N-CA 120.248 -0.581 . . . . 0.0 110.728 -179.427 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 50.1 mtmt -63.78 -10.98 22.82 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.18 -179.57 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.412 HD23 ' C ' ' A' ' 129' ' ' LEU . 2.5 tt -97.86 -67.62 0.84 Allowed 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.278 -179.778 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 130' ' ' GLY . . . . . 0.66 ' C ' HD12 ' A' ' 131' ' ' ILE . . . -155.51 -138.51 2.58 Favored Glycine 0 CA--C 1.518 0.259 0 N-CA-C 110.688 -0.965 . . . . 0.0 110.688 -179.231 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 131' ' ' ILE . . . . . 1.042 HG22 ' H ' ' A' ' 132' ' ' GLN . 3.3 mp 53.28 -158.41 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.517 -0.298 0 N-CA-C 109.654 -0.499 . . . . 0.0 109.654 -179.771 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 132' ' ' GLN . . . . . 1.042 ' H ' HG22 ' A' ' 131' ' ' ILE . 6.0 tp60 177.43 139.52 0.08 Allowed 'General case' 0 N--CA 1.446 -0.654 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 179.866 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 94.1 mt-10 59.28 26.12 14.88 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-O 120.966 0.412 . . . . 0.0 111.455 178.135 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 9.3 tpt -57.79 -39.93 78.69 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.087 -179.798 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 56.8 p -75.22 -61.72 1.8 Allowed 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 121.363 0.602 . . . . 0.0 110.696 -179.699 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 17.7 ttmm -49.24 -44.27 43.41 Favored 'General case' 0 C--N 1.32 -0.679 0 C-N-CA 120.455 -0.498 . . . . 0.0 110.524 -178.327 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 76.8 m -55.52 -68.44 0.2 Allowed 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.323 -179.299 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 138' ' ' VAL . . . . . 0.41 HG13 ' N ' ' A' ' 139' ' ' SER . 11.7 p -59.86 -38.89 78.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.993 0.425 . . . . 0.0 110.469 -178.891 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 139' ' ' SER . . . . . 0.41 ' N ' HG13 ' A' ' 138' ' ' VAL . 15.9 m -63.23 -38.5 91.4 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.753 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -63.09 -31.42 72.56 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.009 -0.542 . . . . 0.0 110.522 -179.859 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -64.43 -46.03 84.93 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.86 0.362 . . . . 0.0 111.119 -179.598 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -57.75 -31.18 66.24 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.713 -179.207 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 14.3 mm-40 -75.13 -44.59 46.18 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.861 0.362 . . . . 0.0 111.117 -179.99 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 46.3 tp10 -72.12 -45.79 59.17 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.022 -179.106 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 145' ' ' ASN . . . . . 0.537 HD21 ' CD1' ' A' ' 156' ' ' ILE . 3.5 p-10 -128.54 68.98 78.81 Favored Pre-proline 0 N--CA 1.469 0.513 0 CA-C-N 116.376 -0.374 . . . . 0.0 110.09 -179.045 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 146' ' ' PRO . . . . . . . . . . . . . 23.2 Cg_endo -60.28 112.69 1.39 Allowed 'Trans proline' 0 N--CA 1.492 1.418 0 C-N-CA 122.38 2.053 . . . . 0.0 111.303 -179.7 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 147' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -79.3 136.36 12.62 Favored 'Trans proline' 0 N--CA 1.491 1.378 0 C-N-CA 122.115 1.876 . . . . 0.0 111.768 -179.902 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 36.5 p -129.53 18.96 5.76 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.236 179.327 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 149' ' ' THR . . . . . . . . . . . . . 8.5 m -151.96 152.46 32.52 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 120.661 0.267 . . . . 0.0 110.354 179.578 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -49.47 -36.11 21.71 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.795 0.331 . . . . 0.0 110.559 -179.077 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 14.9 pt20 -77.74 -40.64 40.41 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.649 179.216 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . -56.4 -36.97 71.92 Favored Glycine 0 CA--C 1.519 0.302 0 N-CA-C 110.887 -0.885 . . . . 0.0 110.887 -178.839 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 153' ' ' VAL . . . . . 0.44 ' O ' ' N ' ' A' ' 156' ' ' ILE . 86.1 t -60.88 -42.07 91.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 C-N-CA 121.21 -0.196 . . . . 0.0 110.508 -179.839 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 79.3 mt -43.56 -23.42 0.07 Allowed 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 120.912 0.387 . . . . 0.0 110.86 -179.295 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 155' ' ' GLU . . . . . 0.411 ' N ' ' C ' ' A' ' 153' ' ' VAL . 95.2 mt-10 -64.86 -40.4 95.08 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.004 179.268 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 156' ' ' ILE . . . . . 0.651 HG22 ' SD ' ' A' ' 160' ' ' MET . 10.2 mm -71.48 -35.74 57.94 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.154 -179.709 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -60.13 -41.75 93.34 Favored 'General case' 0 N--CA 1.453 -0.278 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.864 -179.686 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 17.3 ttmm -60.74 -44.68 96.37 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.496 -179.405 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 53.6 tttm -73.77 -30.09 62.57 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.83 -179.371 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 160' ' ' MET . . . . . 0.651 ' SD ' HG22 ' A' ' 156' ' ' ILE . 12.0 mtp -67.49 -54.05 23.48 Favored 'General case' 0 C--O 1.221 -0.436 0 C-N-CA 120.508 -0.477 . . . . 0.0 110.174 -178.976 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 80.8 mtp180 -61.99 -31.75 72.15 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.394 179.922 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -58.4 -46.34 86.59 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.222 -179.269 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 163' ' ' LYS . . . . . . . . . . . . . 54.0 tttp -65.08 -52.28 56.52 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 120.357 -0.537 . . . . 0.0 110.78 -179.064 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -51.98 -36.08 48.54 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.998 0.427 . . . . 0.0 110.285 -179.071 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 57.6 tt0 -62.09 -40.04 94.48 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.325 179.896 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 20.3 mmt85 -65.89 -34.66 78.65 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.453 0.644 . . . . 0.0 111.434 -179.585 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 167' ' ' VAL . . . . . . . . . . . . . 38.6 t -66.76 -47.44 82.93 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.769 0 CA-C-N 115.139 -0.937 . . . . 0.0 110.284 -179.53 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 42.8 t-80 -79.44 -31.11 42.5 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.519 -179.471 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 169' ' ' THR . . . . . . . . . . . . . 90.2 m -71.64 -44.43 64.35 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.126 -179.828 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 59.8 mmtt -62.01 -41.76 98.43 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.99 0.424 . . . . 0.0 110.733 -179.021 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 171' ' ' ASN . . . . . . . . . . . . . 10.3 m120 -68.63 -34.92 76.57 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.628 179.473 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 172' ' ' TYR . . . . . 0.414 ' CZ ' ' NZ ' ' A' ' 176' ' ' LYS . 86.8 t80 -63.85 -40.46 96.64 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.115 -179.524 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 7.2 t -76.11 -46.85 26.83 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.783 -178.679 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 24.5 p -58.2 -47.83 82.23 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.078 -178.808 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -64.1 -35.14 79.78 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-O 120.808 0.337 . . . . 0.0 110.721 -179.911 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 176' ' ' LYS . . . . . 0.414 ' NZ ' ' CZ ' ' A' ' 172' ' ' TYR . 14.2 tptt -54.71 -19.3 5.93 Favored 'General case' 0 C--N 1.313 -1.003 0 C-N-CA 120.274 -0.57 . . . . 0.0 110.461 -179.158 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 177' ' ' LYS . . . . . . . . . . . . . 61.0 tttm -68.98 -39.77 79.21 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 121.712 0.768 . . . . 0.0 111.368 179.846 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 178' ' ' LYS . . . . . . . . . . . . . 20.0 mtpp . . . . . 0 C--N 1.31 -1.138 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.024 -178.721 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.156 0 CA-C-O 120.796 0.331 . . . . 0.0 110.583 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 24.7 m -64.63 -30.29 71.3 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.351 -179.969 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 63.9 tttp -68.48 -50.7 50.44 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.807 179.973 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 65.0 mt -60.38 -42.48 91.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.361 -179.196 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 -56.35 -42.64 78.08 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.75 -179.517 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 26.8 mt -68.97 -34.18 74.9 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.55 0.214 . . . . 0.0 111.319 -179.147 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -64.93 -52.76 54.61 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.868 -179.43 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 50.3 ptt85 -71.81 -39.71 69.65 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.882 0.372 . . . . 0.0 110.799 -179.625 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 39.4 t -64.85 -39.25 93.27 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.965 -179.595 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -76.53 -34.0 58.56 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.1 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 64.8 tttm -66.36 -33.01 74.77 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.905 -179.623 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 39.7 m-20 -67.35 -27.04 66.8 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.821 -179.307 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 52.8 mt -61.47 -50.19 81.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 C-N-CA 120.885 -0.326 . . . . 0.0 110.846 -179.08 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 68.4 p -73.73 -36.5 65.2 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.801 0.334 . . . . 0.0 111.46 -178.294 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 85.7 m-20 -66.2 -35.09 79.54 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.561 -178.306 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 68.8 mm-40 -74.4 -57.77 3.73 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.933 0.397 . . . . 0.0 111.513 -178.935 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 6.7 pt -58.56 -23.14 22.12 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.637 -178.92 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -62.94 -39.24 94.01 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.072 0.463 . . . . 0.0 110.502 179.459 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -55.24 -22.5 18.33 Favored 'General case' 0 C--N 1.319 -0.728 0 C-N-CA 120.669 -0.412 . . . . 0.0 110.676 -179.924 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 81.4 mt -60.25 -52.72 58.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.462 -178.549 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 5.1 ptmm? -65.85 -30.92 71.61 Favored 'General case' 0 C--N 1.324 -0.542 0 C-N-CA 120.693 -0.403 . . . . 0.0 110.366 -179.167 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 37.7 ttmt -63.83 -47.72 79.69 Favored 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 120.756 -0.378 . . . . 0.0 110.227 179.859 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 95.1 m-20 -65.47 -33.3 75.6 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.17 179.816 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -64.01 -28.39 69.77 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.835 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -60.05 -32.51 70.99 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.891 -179.673 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 55.0 mt . . . . . 0 C--N 1.325 -0.475 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.438 -179.216 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . 0.469 ' ND2' HD12 ' A' ' 78' ' ' ILE . 2.0 p30 . . . . . 0 CA--C 1.541 0.623 0 N-CA-C 109.41 -0.589 . . . . 0.0 109.41 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 77.0 Cg_exo -43.79 -19.94 0.23 Allowed 'Trans proline' 0 N--CA 1.496 1.659 0 C-N-CA 122.505 2.137 . . . . 0.0 112.226 -179.46 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . 0.428 ' N ' ' O ' ' A' ' 75' ' ' ASN . 58.0 t80 -62.26 -52.78 62.36 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.632 -0.427 . . . . 0.0 110.711 -179.872 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . 0.469 HD12 ' ND2' ' A' ' 75' ' ' ASN . 94.4 mt -69.35 -46.16 77.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.427 179.819 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.479 ' O ' ' ND2' ' A' ' 171' ' ' ASN . 39.9 mt -55.57 -51.63 66.45 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.095 -178.442 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 95.6 mt-10 -63.49 -36.0 82.32 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.191 179.475 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -64.46 -40.43 95.7 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.499 179.967 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 33.9 ttmt -54.88 -19.37 6.45 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.088 0.471 . . . . 0.0 110.528 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 5.6 t -79.43 -44.65 23.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.818 179.943 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 84.7 mtp180 -62.96 -31.4 72.49 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.413 -179.672 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -67.32 -42.77 83.07 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.91 0.386 . . . . 0.0 111.274 -179.341 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 38.3 p -67.77 -21.51 65.25 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.245 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 24.5 m -59.0 -54.03 51.75 Favored 'General case' 0 C--N 1.323 -0.571 0 C-N-CA 120.506 -0.478 . . . . 0.0 111.027 -179.051 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 45.2 t -73.13 -49.18 40.12 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-O 121.057 0.456 . . . . 0.0 111.3 -179.445 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -57.18 -43.15 82.37 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.672 -178.896 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 7.1 tm-20 -56.28 -47.83 77.83 Favored 'General case' 0 C--N 1.317 -0.84 0 C-N-CA 120.404 -0.518 . . . . 0.0 110.718 -179.613 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 70.0 mmtt -59.0 -36.75 75.43 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.895 -178.97 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 87.7 t80 -56.99 -38.88 73.67 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.506 -179.926 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 49.0 t -58.03 -41.93 81.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-O 120.926 0.393 . . . . 0.0 110.173 -179.02 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 64.3 mt -54.51 -39.91 47.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.327 179.944 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -53.3 -45.32 68.93 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.631 -179.762 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . 0.52 ' N ' HD12 ' A' ' 96' ' ' ILE . 1.6 mp -60.63 -44.37 96.76 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 116.311 -0.404 . . . . 0.0 109.986 -179.586 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 14.1 tm-20 -64.43 -49.36 71.81 Favored 'General case' 0 C--N 1.32 -0.71 0 C-N-CA 120.576 -0.45 . . . . 0.0 110.649 -178.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 83.0 tt0 -63.15 -46.48 86.99 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.58 -179.166 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 79.3 mm-40 -65.86 -35.13 79.81 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.743 -179.794 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -60.68 -41.63 95.49 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.57 -179.853 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 33.0 m -63.32 -49.07 75.43 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.643 -179.996 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 35.3 ttmt -69.32 -19.67 63.88 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.508 -179.924 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 41.1 tp . . . . . 0 C--N 1.326 -0.452 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.433 -179.402 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 54.4 p . . . . . 0 N--CA 1.456 -0.154 0 CA-C-O 120.816 0.341 . . . . 0.0 110.507 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -62.55 -31.38 79.58 Favored Glycine 0 CA--C 1.521 0.425 0 N-CA-C 110.876 -0.89 . . . . 0.0 110.876 -179.961 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 44.9 tp10 -53.72 -45.61 70.52 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.864 0.364 . . . . 0.0 110.368 -179.544 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 65.1 m-85 -65.23 -41.17 94.65 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.575 -179.869 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 6.1 t -57.17 -33.28 67.27 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.499 -179.725 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -61.9 -35.89 79.69 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.452 -179.92 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 28.9 tpp -66.4 -47.65 72.61 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.958 0.409 . . . . 0.0 110.91 -179.871 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 37.1 t80 -51.12 -32.17 21.82 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.548 -179.542 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 63.6 t0 -60.05 -44.71 94.5 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.756 -179.889 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.472 ' N ' HD12 ' A' ' 118' ' ' LEU . 10.8 mp -58.33 -39.21 78.84 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.289 -0.414 . . . . 0.0 109.922 -179.222 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 13.4 tpt -61.84 -32.29 72.61 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.365 179.941 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . 0.566 ' CZ ' ' NZ ' ' A' ' 124' ' ' LYS . 14.6 t80 -77.42 -46.01 24.01 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.353 0.597 . . . . 0.0 111.035 -179.851 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -59.91 -42.46 93.92 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.699 -178.424 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 122' ' ' VAL . . . . . 0.432 ' O ' HD13 ' A' ' 126' ' ' LEU . 11.1 p -74.53 -25.86 19.62 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.385 0 CA-C-O 120.942 0.401 . . . . 0.0 110.687 -179.785 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 11.5 t -65.47 -21.08 66.6 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 116.611 -0.268 . . . . 0.0 111.193 179.912 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . 0.566 ' NZ ' ' CZ ' ' A' ' 120' ' ' PHE . 5.1 mptt -71.3 -59.31 3.33 Favored Pre-proline 0 C--N 1.324 -0.511 0 N-CA-C 112.139 0.422 . . . . 0.0 112.139 -178.906 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 125' ' ' PRO . . . . . 0.481 ' HD2' ' N ' ' A' ' 124' ' ' LYS . 18.6 Cg_endo -56.6 -32.01 88.84 Favored 'Trans proline' 0 C--N 1.309 -1.506 0 C-N-CA 122.204 1.936 . . . . 0.0 112.106 -178.036 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.432 HD13 ' O ' ' A' ' 122' ' ' VAL . 7.4 mp -60.98 -39.61 90.28 Favored 'General case' 0 CA--C 1.51 -0.57 0 CA-C-N 116.431 -0.349 . . . . 0.0 110.552 -179.839 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -44.69 -28.71 0.65 Allowed 'General case' 0 C--N 1.318 -0.791 0 CA-C-O 120.922 0.391 . . . . 0.0 110.923 179.858 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 128' ' ' LYS . . . . . 0.484 ' C ' HD22 ' A' ' 129' ' ' LEU . 97.9 mttt -64.99 -8.55 16.35 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.83 -179.399 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.49 ' N ' HD22 ' A' ' 129' ' ' LEU . 4.2 mm? -102.75 -10.35 19.24 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.604 -179.663 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 83.65 17.61 65.64 Favored Glycine 0 CA--C 1.52 0.381 0 N-CA-C 110.438 -1.065 . . . . 0.0 110.438 179.684 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 131' ' ' ILE . . . . . 0.72 ' O ' HG22 ' A' ' 131' ' ' ILE . 81.4 mt -77.82 15.36 0.25 Allowed 'Isoleucine or valine' 0 CA--C 1.518 -0.27 0 N-CA-C 110.038 -0.356 . . . . 0.0 110.038 -179.835 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 132' ' ' GLN . . . . . 0.531 ' C ' ' O ' ' A' ' 131' ' ' ILE . 59.1 tt0 -25.84 122.9 0.07 Allowed 'General case' 0 CA--C 1.507 -0.694 0 CA-C-O 118.941 -0.552 . . . . 0.0 109.666 179.968 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 133' ' ' GLU . . . . . 0.503 ' CB ' ' O ' ' A' ' 132' ' ' GLN . 8.6 mm-40 148.22 -21.95 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.201 0 O-C-N 124.677 1.236 . . . . 0.0 110.343 -178.858 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 134' ' ' MET . . . . . 0.502 ' O ' HG12 ' A' ' 138' ' ' VAL . 24.6 mmt -62.01 -61.92 2.15 Favored 'General case' 0 C--N 1.319 -0.724 0 C-N-CA 120.849 -0.341 . . . . 0.0 111.138 -178.378 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 71.4 p -56.96 -30.38 64.02 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.834 -178.799 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 50.8 mtmt -82.69 -52.81 6.44 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.347 -179.745 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 137' ' ' THR . . . . . 0.42 ' CG2' ' NZ ' ' A' ' 159' ' ' LYS . 30.2 m -60.57 -46.12 91.41 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.857 -179.023 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 138' ' ' VAL . . . . . 0.502 HG12 ' O ' ' A' ' 134' ' ' MET . 9.0 p -61.4 -40.61 86.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-O 121.051 0.453 . . . . 0.0 110.68 -178.92 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 139' ' ' SER . . . . . 0.45 ' N ' HG13 ' A' ' 138' ' ' VAL . 23.7 t -72.5 -36.37 68.36 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.648 -179.841 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 84.7 m-20 -64.74 -30.18 71.18 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.64 -179.589 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -74.97 -28.23 60.49 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.81 -179.924 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -64.57 -34.09 77.44 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.114 -179.283 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 94.9 mt-10 -70.8 -36.91 73.22 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.743 0.306 . . . . 0.0 110.834 -179.422 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 47.6 tp10 -74.05 -43.49 57.64 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.012 -179.475 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 145' ' ' ASN . . . . . . . . . . . . . 70.3 m-80 -144.28 82.68 10.53 Favored Pre-proline 0 N--CA 1.466 0.349 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.197 -179.53 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 146' ' ' PRO . . . . . 0.456 ' O ' ' N ' ' A' ' 148' ' ' THR . 24.4 Cg_endo -61.02 113.05 1.56 Allowed 'Trans proline' 0 N--CA 1.493 1.446 0 C-N-CA 122.394 2.063 . . . . 0.0 111.694 -178.846 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 147' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_exo -45.79 87.61 0.02 OUTLIER 'Trans proline' 0 N--CA 1.493 1.489 0 C-N-CA 122.397 2.065 . . . . 0.0 112.786 -179.364 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 148' ' ' THR . . . . . 0.456 ' N ' ' O ' ' A' ' 146' ' ' PRO . 31.2 m -111.56 -15.43 13.5 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.335 179.284 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 149' ' ' THR . . . . . 0.634 HG22 ' N ' ' A' ' 150' ' ' ALA . 30.8 m -138.8 172.27 13.11 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.639 179.845 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 150' ' ' ALA . . . . . 0.634 ' N ' HG22 ' A' ' 149' ' ' THR . . . -58.88 -47.72 83.95 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.304 179.986 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 76.4 mt-30 -62.76 -29.61 70.82 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.021 0.439 . . . . 0.0 110.394 -179.851 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . -58.38 -42.28 95.59 Favored Glycine 0 CA--C 1.524 0.6 0 N-CA-C 110.691 -0.964 . . . . 0.0 110.691 179.792 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 153' ' ' VAL . . . . . . . . . . . . . 47.3 t -67.67 -41.48 85.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-O 120.834 0.349 . . . . 0.0 110.505 -179.986 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 8.4 mp -50.95 -38.51 51.02 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.256 -179.374 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -60.96 -47.57 85.83 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 179.12 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 156' ' ' ILE . . . . . 0.809 HG22 ' SD ' ' A' ' 160' ' ' MET . 15.3 mm -65.36 -43.57 94.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.034 -179.777 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -53.03 -51.46 61.66 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.247 179.923 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -62.58 -43.99 97.42 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.164 179.495 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 159' ' ' LYS . . . . . 0.42 ' NZ ' ' CG2' ' A' ' 137' ' ' THR . 63.2 tttm -65.11 -29.77 70.66 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.371 179.945 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 160' ' ' MET . . . . . 0.809 ' SD ' HG22 ' A' ' 156' ' ' ILE . 5.4 mtp -71.01 -53.27 15.36 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.48 -179.49 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 73.5 ttt-85 -67.8 -35.65 79.03 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.473 179.847 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 80.1 tt0 -66.97 -47.87 70.25 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.817 -179.08 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 163' ' ' LYS . . . . . 0.42 ' HZ1' ' HB3' ' A' ' 133' ' ' GLU . 1.2 tmtp? -65.97 -33.97 77.02 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.18 -179.394 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 5.8 mt -70.28 -26.61 63.89 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.657 179.942 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 46.5 tp60 -67.21 -35.73 80.22 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.472 -179.155 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 10.7 tpt180 -62.49 -28.49 69.86 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.37 0.605 . . . . 0.0 110.575 -179.187 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 167' ' ' VAL . . . . . . . . . . . . . 48.3 t -68.18 -44.01 84.52 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 CA-C-N 115.242 -0.89 . . . . 0.0 110.39 -179.708 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 168' ' ' HIS . . . . . 0.503 ' O ' ' ND1' ' A' ' 168' ' ' HIS . 20.6 t-80 -78.15 -28.83 48.44 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.636 -179.967 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 169' ' ' THR . . . . . . . . . . . . . 23.7 m -73.2 -46.68 49.06 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.301 -0.408 . . . . 0.0 111.156 -179.697 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -58.83 -43.86 90.79 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.555 -179.077 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 171' ' ' ASN . . . . . 0.479 ' ND2' ' O ' ' A' ' 79' ' ' LEU . 20.1 t-20 -72.03 -33.11 67.76 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.62 179.916 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 172' ' ' TYR . . . . . . . . . . . . . 80.7 t80 -75.18 -29.33 60.36 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.786 -179.629 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 11.5 t -74.35 -34.55 63.42 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.046 -179.511 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 26.2 p -73.04 -35.68 66.77 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.967 -179.268 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 87.0 mt -77.72 -53.1 7.93 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.521 -178.843 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 16.2 ptmt -56.24 -21.72 25.28 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 121.183 0.516 . . . . 0.0 110.37 -179.265 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 177' ' ' LYS . . . . . . . . . . . . . 56.2 tttp -66.38 -13.67 60.98 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.236 -179.966 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 178' ' ' LYS . . . . . . . . . . . . . 99.2 mttt . . . . . 0 C--N 1.322 -0.589 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.857 -179.922 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 33.0 t . . . . . 0 N--CA 1.49 1.547 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -68.21 82.29 0.23 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.717 -179.86 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 176.17 113.24 0.33 Allowed Glycine 0 CA--C 1.516 0.155 0 N-CA-C 110.781 -0.928 . . . . 0.0 110.781 179.817 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.521 HD23 ' O ' ' A' ' 27' ' ' LEU . 1.0 OUTLIER -141.2 -44.9 0.38 Allowed 'General case' 0 C--N 1.334 -0.107 0 CA-C-O 120.835 0.35 . . . . 0.0 110.627 179.525 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 46.9 p 40.37 -149.1 0.02 OUTLIER 'General case' 0 C--O 1.234 0.253 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.803 -179.282 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -77.52 -130.08 0.47 Allowed Glycine 0 CA--C 1.521 0.455 0 N-CA-C 110.952 -0.859 . . . . 0.0 110.952 179.387 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -83.48 3.54 31.73 Favored 'General case' 0 C--N 1.329 -0.294 0 O-C-N 122.716 -0.285 . . . . 0.0 110.441 -179.832 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 9.9 m -61.84 -36.3 80.78 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.844 -179.683 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 23.4 tptm -65.11 -57.27 9.04 Favored 'General case' 0 N--CA 1.447 -0.578 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.079 -179.709 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 22.1 pt -62.39 -28.64 45.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.331 -179.578 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 78.8 ttt180 -65.35 -42.27 93.0 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.161 0.505 . . . . 0.0 110.497 179.798 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 17.0 mt -71.89 -32.86 67.85 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.065 -179.9 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 37.7 tp10 -62.48 -51.07 68.91 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.88 -179.551 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 89.3 mtm180 -67.37 -40.62 85.74 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.508 -179.507 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 26.8 t -67.83 -25.21 65.45 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.714 -179.751 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -75.66 -40.3 56.24 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.728 179.681 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -58.41 -39.66 80.34 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.817 -179.595 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 20.1 m-20 -58.14 -22.05 49.47 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 121.059 0.457 . . . . 0.0 110.766 -179.389 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 8.9 mm -64.79 -56.15 17.41 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.953 0 N-CA-C 112.244 0.461 . . . . 0.0 112.244 -178.865 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 52.5 p -76.34 -36.03 58.45 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.559 -179.878 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 95.8 m-20 -64.56 -35.14 80.02 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.688 -177.623 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 56.4 mm-40 -73.25 -57.82 3.75 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.745 -179.588 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.57 HG22 ' HA ' ' A' ' 85' ' ' ALA . 16.0 pt -60.03 -26.94 37.56 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.755 0 O-C-N 123.428 0.455 . . . . 0.0 110.879 -179.37 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 65.3 m-20 -66.54 -38.53 87.35 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.365 -179.567 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -53.9 -27.47 30.7 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.209 -179.288 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 66.3 mt -62.49 -47.47 92.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.118 179.689 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 63.8 mttp -58.76 -39.54 81.28 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.101 -179.465 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 71.6 mmtt -64.85 -44.22 90.48 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.558 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -67.12 -35.49 79.87 Favored 'General case' 0 C--O 1.224 -0.268 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.48 179.822 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.444 ' O ' ' O ' ' A' ' 56' ' ' LYS . . . -63.69 -29.02 70.3 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.673 -179.844 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -58.66 -35.28 72.31 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.792 -179.526 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.504 ' N ' HD12 ' A' ' 55' ' ' LEU . 10.0 mp -56.21 -44.75 79.79 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.511 -178.521 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.444 ' O ' ' O ' ' A' ' 53' ' ' ALA . 20.7 mtpp -109.02 139.79 43.41 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-O 121.113 0.482 . . . . 0.0 110.332 179.876 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -70.25 102.06 0.97 Allowed Glycine 0 CA--C 1.516 0.096 0 N-CA-C 110.795 -0.922 . . . . 0.0 110.795 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.47 HG22 ' H ' ' A' ' 60' ' ' PHE . 5.5 p -132.6 142.71 41.78 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.374 0 CA-C-O 120.974 0.416 . . . . 0.0 110.46 179.961 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 8.5 p30 -60.68 -44.35 96.61 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.927 179.765 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . 0.47 ' H ' HG22 ' A' ' 58' ' ' VAL . 81.3 t80 52.88 72.93 0.38 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.428 179.826 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . 0.47 ' H ' HD11 ' A' ' 78' ' ' ILE . 4.0 p30 172.23 -99.0 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.011 0.434 . . . . 0.0 110.189 -179.861 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.455 ' N ' ' OD1' ' A' ' 61' ' ' ASP . . . 47.1 31.61 1.68 Allowed 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.932 -179.863 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . 0.473 ' CZ ' ' O ' ' A' ' 129' ' ' LEU . 56.8 m-85 -89.09 9.99 23.38 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.134 -179.855 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 53.3 mtmt -61.7 125.46 23.9 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.615 -179.758 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 32.8 t70 49.79 -94.79 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.621 -179.883 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -140.89 138.48 33.93 Favored 'General case' 0 CA--C 1.52 -0.196 0 CA-C-O 121.19 0.519 . . . . 0.0 110.377 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 10.1 ptpp? -88.43 146.67 25.09 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.497 179.698 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 82.7 m -136.97 131.24 32.69 Favored 'General case' 0 CA--C 1.519 -0.249 0 CA-C-O 121.042 0.449 . . . . 0.0 110.473 179.794 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 150.38 -37.82 0.9 Allowed Glycine 0 CA--C 1.523 0.546 0 N-CA-C 110.805 -0.918 . . . . 0.0 110.805 179.613 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 23.3 m 53.43 80.7 0.1 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.81 0.338 . . . . 0.0 110.518 -179.72 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 72.21 -57.64 1.51 Allowed Glycine 0 CA--C 1.528 0.885 0 N-CA-C 110.763 -0.935 . . . . 0.0 110.763 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 47.5 t -61.11 133.13 26.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 O-C-N 122.689 -0.3 . . . . 0.0 110.303 -179.597 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 1.4 m 70.61 -59.24 0.53 Allowed 'General case' 0 C--N 1.334 -0.101 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.378 -179.584 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . 0.552 ' O ' ' C ' ' A' ' 75' ' ' ASN . 41.6 tp10 -68.75 91.92 0.46 Allowed 'General case' 0 N--CA 1.446 -0.645 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.715 -179.265 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . 0.592 ' N ' HD22 ' A' ' 75' ' ' ASN . 0.0 OUTLIER -18.82 98.33 0.05 OUTLIER Pre-proline 0 C--O 1.236 0.386 0 O-C-N 123.84 0.712 . . . . 0.0 111.103 179.166 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_exo -51.05 0.03 0.04 OUTLIER 'Trans proline' 0 C--N 1.312 -1.374 0 C-N-CA 122.611 2.207 . . . . 0.0 111.856 -178.572 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . 0.578 ' H ' ' C ' ' A' ' 75' ' ' ASN . 67.8 t80 -61.03 -49.46 77.33 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 116.561 -0.29 . . . . 0.0 110.709 -179.542 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . 0.47 HD11 ' H ' ' A' ' 61' ' ' ASP . 66.3 mt -64.17 -51.95 62.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.368 -179.854 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.523 ' N ' HD12 ' A' ' 79' ' ' LEU . 10.5 mp -56.52 -53.23 59.93 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.171 -178.616 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 94.9 mt-10 -62.68 -38.92 92.28 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 123.334 0.396 . . . . 0.0 110.221 179.911 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -63.39 -41.47 98.76 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.364 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 35.9 ttmt -52.53 -18.58 1.77 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 121.19 0.519 . . . . 0.0 110.776 -179.597 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 25.4 t -85.51 -48.38 16.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.485 179.722 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 84.4 mtt85 -64.97 -30.27 71.25 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.46 -179.585 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . 0.57 ' HA ' HG22 ' A' ' 46' ' ' ILE . . . -70.39 -45.75 65.38 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.748 -179.497 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . 0.415 ' CB ' HG21 ' A' ' 167' ' ' VAL . 74.2 p -77.6 -11.97 59.92 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.458 -179.163 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 85.6 m -60.34 -52.1 66.68 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.129 -178.736 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.449 HG13 ' N ' ' A' ' 89' ' ' ALA . 11.7 p -69.8 -39.55 77.98 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.77 -179.407 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . 0.449 ' N ' HG13 ' A' ' 88' ' ' VAL . . . -61.97 -39.17 91.24 Favored 'General case' 0 C--O 1.223 -0.341 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.107 -178.695 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 38.4 tp10 -50.23 -54.96 17.42 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.852 -179.807 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 9.2 mtmp? -52.58 -34.89 52.59 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.69 -179.504 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.432 ' O ' ' HB3' ' A' ' 95' ' ' ALA . 43.4 t80 -59.17 -43.59 92.15 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.725 -179.248 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 90.6 t -56.76 -47.71 82.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.453 -178.696 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 67.0 mt -53.42 -38.0 31.29 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.104 -179.904 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.432 ' HB3' ' O ' ' A' ' 92' ' ' PHE . . . -52.58 -43.38 65.24 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.458 -179.491 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.546 ' N ' HD12 ' A' ' 96' ' ' ILE . 1.7 mp -62.16 -44.86 99.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.417 -179.955 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 7.7 tm-20 -61.39 -50.07 74.33 Favored 'General case' 0 C--N 1.323 -0.56 0 O-C-N 123.442 0.464 . . . . 0.0 110.214 -178.616 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 78.4 tt0 -66.06 -39.72 90.32 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.34 -179.47 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 80.2 tt0 -67.54 -32.79 73.82 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.562 -179.676 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -57.49 -40.17 78.03 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.518 -179.496 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 20.2 m -61.69 -47.62 84.49 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.54 179.871 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 64.1 mttp -74.69 -24.64 58.81 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.376 -179.724 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.496 ' O ' ' C ' ' A' ' 104' ' ' LYS . 37.4 tp -73.53 -27.87 61.58 Favored 'General case' 0 CA--C 1.508 -0.638 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.933 -179.739 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.496 ' C ' ' O ' ' A' ' 103' ' ' LEU . 64.0 tttm -25.52 -50.31 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.616 0 O-C-N 123.499 0.5 . . . . 0.0 111.063 -179.637 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . 0.59 ' O ' ' N ' ' A' ' 107' ' ' GLY . 80.9 mm-40 -47.72 165.34 0.04 OUTLIER 'General case' 0 C--O 1.219 -0.511 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.905 178.682 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . 0.499 ' OG1' ' N ' ' A' ' 107' ' ' GLY . 32.0 p 55.29 -75.9 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.014 0.435 . . . . 0.0 110.762 -179.613 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . 0.59 ' N ' ' O ' ' A' ' 105' ' ' GLU . . . 82.17 -136.63 15.92 Favored Glycine 0 C--O 1.226 -0.381 0 N-CA-C 110.761 -0.936 . . . . 0.0 110.761 179.627 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 1.1 m 70.31 138.06 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 110.202 -0.296 . . . . 0.0 110.202 -179.594 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 80.7 p -57.65 -24.67 57.85 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.86 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -61.66 -45.45 96.26 Favored Glycine 0 CA--C 1.522 0.505 0 N-CA-C 111.191 -0.764 . . . . 0.0 111.191 -179.826 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 10.5 mm-40 -70.56 -44.05 68.24 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.708 0.29 . . . . 0.0 110.709 -179.646 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 61.5 m-85 -65.52 -36.61 84.34 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.536 -179.938 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 55.1 m -53.87 -33.95 57.97 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.385 179.813 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -65.57 -28.43 69.14 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.416 179.693 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 63.0 mmm -73.78 -41.96 61.69 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.876 -179.792 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 33.6 t80 -64.99 -34.54 78.69 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.439 179.911 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 45.4 t0 -56.67 -46.52 81.08 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.169 -179.346 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 83.6 mt -55.42 -39.01 69.72 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.519 179.761 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' MET . . . . . 0.434 ' C ' ' SD ' ' A' ' 119' ' ' MET . 0.0 OUTLIER -60.63 -53.98 50.86 Favored 'General case' 0 C--N 1.318 -0.769 0 O-C-N 123.544 0.527 . . . . 0.0 110.393 -179.831 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 67.1 t80 -60.77 -47.5 86.02 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.901 -178.76 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 78.9 mm-40 -56.56 -39.74 73.97 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.818 -179.726 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 69.7 t -81.19 -23.69 10.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.582 179.785 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 53.2 p -70.84 -23.0 62.26 Favored 'General case' 0 C--N 1.309 -1.171 0 CA-C-N 116.572 -0.285 . . . . 0.0 110.928 -179.783 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . 0.49 ' CB ' ' HD3' ' A' ' 125' ' ' PRO . 16.8 mtmt -72.04 -56.55 4.43 Favored Pre-proline 0 C--N 1.329 -0.297 0 C-N-CA 120.755 -0.378 . . . . 0.0 111.445 -178.71 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . 0.49 ' HD3' ' CB ' ' A' ' 124' ' ' LYS . 54.0 Cg_exo -49.22 -44.98 31.68 Favored 'Trans proline' 0 C--N 1.304 -1.787 0 C-N-CA 122.351 2.034 . . . . 0.0 112.172 178.237 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.486 HD22 ' N ' ' A' ' 126' ' ' LEU . 4.3 mm? -70.38 -21.92 62.81 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.24 179.764 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 4.7 tm0? -63.31 -47.37 82.55 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.746 -179.672 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 99.7 mttt -53.58 -44.73 69.58 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 -178.461 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.525 HD23 ' O ' ' A' ' 129' ' ' LEU . 1.1 tt -63.72 -45.08 91.55 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 121.295 0.569 . . . . 0.0 110.556 179.566 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 99.2 90.54 2.01 Favored Glycine 0 N--CA 1.462 0.428 0 N-CA-C 110.815 -0.914 . . . . 0.0 110.815 -179.865 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 131' ' ' ILE . . . . . 0.4 ' O ' ' CG ' ' A' ' 132' ' ' GLN . 47.3 mm -105.81 -71.56 0.7 Allowed 'Isoleucine or valine' 0 CA--C 1.507 -0.699 0 N-CA-C 111.5 0.185 . . . . 0.0 111.5 179.391 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . 0.4 ' CG ' ' O ' ' A' ' 131' ' ' ILE . 56.7 mt-30 -159.75 -166.93 1.86 Allowed 'General case' 0 C--N 1.327 -0.393 0 O-C-N 123.511 0.507 . . . . 0.0 110.821 -179.898 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 92.8 mt-10 -88.09 44.44 1.2 Allowed 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 116.184 -0.462 . . . . 0.0 109.81 179.895 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 44.6 tpp -59.21 -58.91 6.54 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.157 -178.833 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 23.3 p -46.42 -26.79 0.91 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.522 -179.14 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 62.4 mttp -90.56 -45.12 9.12 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.007 178.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 75.7 m -61.17 -43.56 98.68 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.73 -178.964 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 138' ' ' VAL . . . . . 0.453 HG13 ' N ' ' A' ' 139' ' ' SER . 9.8 p -65.55 -40.88 89.46 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.74 -179.156 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . 0.453 ' N ' HG13 ' A' ' 138' ' ' VAL . 34.2 t -75.48 -34.09 60.86 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.2 -179.278 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 64.6 t0 -64.11 -28.55 69.85 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.322 0.582 . . . . 0.0 110.642 -179.762 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -73.11 -24.91 60.68 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.945 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -59.58 -33.39 71.38 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.015 0.436 . . . . 0.0 111.0 -179.032 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . 0.413 ' OE1' ' N ' ' A' ' 143' ' ' GLU . 38.3 mp0 -73.08 -36.34 66.81 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.5 -0.318 . . . . 0.0 111.201 179.818 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 144' ' ' GLU . . . . . 0.439 ' O ' ' ND2' ' A' ' 145' ' ' ASN . 44.6 tp10 -64.52 -48.11 76.33 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.581 -179.699 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 145' ' ' ASN . . . . . 0.439 ' ND2' ' O ' ' A' ' 144' ' ' GLU . 31.3 m120 -148.47 77.17 9.78 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.228 -179.457 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 146' ' ' PRO . . . . . . . . . . . . . 86.8 Cg_exo -42.79 105.41 0.06 OUTLIER 'Trans proline' 0 N--CA 1.483 0.86 0 C-N-CA 122.923 2.415 . . . . 0.0 112.096 -179.781 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 147' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_exo -45.26 101.66 0.04 OUTLIER 'Trans proline' 0 C--N 1.312 -1.36 0 C-N-CA 122.375 2.05 . . . . 0.0 112.556 -179.251 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 53.4 m -120.17 -13.6 8.92 Favored 'General case' 0 CA--C 1.515 -0.379 0 CA-C-O 120.928 0.394 . . . . 0.0 110.409 179.504 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 149' ' ' THR . . . . . 0.659 HG22 ' N ' ' A' ' 150' ' ' ALA . 50.1 m -136.99 171.19 14.88 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.961 0.41 . . . . 0.0 110.621 179.801 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 150' ' ' ALA . . . . . 0.659 ' N ' HG22 ' A' ' 149' ' ' THR . . . -58.43 -40.39 82.4 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.789 179.798 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 76.1 mt-30 -66.76 -24.52 66.22 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.938 0.399 . . . . 0.0 110.831 179.804 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . -67.33 -40.27 91.82 Favored Glycine 0 CA--C 1.525 0.674 0 N-CA-C 111.155 -0.778 . . . . 0.0 111.155 -179.828 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 153' ' ' VAL . . . . . . . . . . . . . 54.3 t -68.54 -32.26 54.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-O 120.724 0.297 . . . . 0.0 110.636 -179.71 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 7.4 mp -56.56 -36.38 69.23 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.508 -179.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -60.11 -53.48 57.26 Favored 'General case' 0 C--N 1.321 -0.633 0 O-C-N 123.607 0.567 . . . . 0.0 109.863 -179.876 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 156' ' ' ILE . . . . . 0.591 ' N ' HD12 ' A' ' 156' ' ' ILE . 1.8 mp -60.38 -44.47 96.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 N-CA-C 109.91 -0.404 . . . . 0.0 109.91 -179.635 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -51.09 -51.72 50.64 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.029 -178.775 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 63.0 mttp -60.13 -41.1 91.94 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.934 0.397 . . . . 0.0 110.11 179.747 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 38.6 mmtm -64.94 -30.56 71.56 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.908 0.385 . . . . 0.0 110.763 179.503 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 160' ' ' MET . . . . . 0.406 ' O ' ' CB ' ' A' ' 164' ' ' LEU . 2.2 mtm -74.23 -53.93 8.77 Favored 'General case' 0 C--O 1.219 -0.505 0 C-N-CA 120.46 -0.496 . . . . 0.0 111.562 -179.757 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 60.8 ttp180 -62.51 -41.3 98.74 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.074 -179.105 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 68.2 mm-40 -62.82 -57.64 10.16 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.694 -179.431 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 163' ' ' LYS . . . . . . . . . . . . . 63.0 tttp -66.66 -52.97 38.9 Favored 'General case' 0 C--N 1.324 -0.52 0 O-C-N 123.5 0.5 . . . . 0.0 111.046 -179.122 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 164' ' ' LEU . . . . . 0.711 ' O ' HG22 ' A' ' 167' ' ' VAL . 53.9 tp -47.81 -37.44 13.7 Favored 'General case' 0 C--O 1.212 -0.891 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.605 -178.772 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 59.2 tt0 -68.93 -27.62 65.92 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.497 -179.662 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 57.4 ttm-85 -55.02 -22.67 16.31 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.888 -179.516 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 167' ' ' VAL . . . . . 0.711 HG22 ' O ' ' A' ' 164' ' ' LEU . 18.2 m -60.47 -42.27 90.61 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.934 0 O-C-N 124.087 0.867 . . . . 0.0 109.923 -179.526 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 168' ' ' HIS . . . . . 0.52 ' N ' HG23 ' A' ' 167' ' ' VAL . 3.5 t60 -77.38 -22.26 51.94 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.554 -179.428 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 169' ' ' THR . . . . . . . . . . . . . 23.7 m -66.35 -47.24 74.08 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.143 -179.921 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 170' ' ' LYS . . . . . 0.476 ' O ' HG23 ' A' ' 174' ' ' THR . 68.9 mttm -63.99 -47.09 81.7 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.513 -179.588 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 171' ' ' ASN . . . . . . . . . . . . . 75.3 m-20 -64.29 -39.63 94.32 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.732 179.959 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 172' ' ' TYR . . . . . . . . . . . . . 85.1 t80 -69.76 -38.6 76.82 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.93 -179.417 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 48.2 t -78.06 -42.44 32.29 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.07 -0.513 . . . . 0.0 111.054 -178.952 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 174' ' ' THR . . . . . 0.476 HG23 ' O ' ' A' ' 170' ' ' LYS . 17.4 p -59.96 -45.88 91.23 Favored 'General case' 0 C--O 1.216 -0.688 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.005 -179.293 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 76.4 mt -63.11 -31.71 72.92 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.21 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 29.9 mttt -64.35 -5.67 5.61 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.933 -179.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 177' ' ' LYS . . . . . . . . . . . . . 20.8 ptmt -58.81 -31.2 68.23 Favored 'General case' 0 C--N 1.318 -0.791 0 O-C-N 123.423 0.452 . . . . 0.0 110.315 -179.252 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 178' ' ' LYS . . . . . . . . . . . . . 16.7 mmmt -63.54 -44.86 92.96 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.806 -179.795 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 97.3 mt-10 -70.12 -42.75 72.21 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.297 -179.919 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 180' ' ' ASN . . . . . . . . . . . . . 94.2 m-20 -65.78 -40.75 92.27 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.377 179.939 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 36.8 t 51.07 -97.08 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.724 -179.673 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 182' ' ' THR . . . . . 0.432 ' OG1' ' N ' ' A' ' 183' ' ' PHE . 59.7 p -72.04 -115.85 0.0 OUTLIER 'General case' 0 N--CA 1.453 -0.278 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.33 -179.926 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 183' ' ' PHE . . . . . 0.432 ' N ' ' OG1' ' A' ' 182' ' ' THR . 36.1 m-85 41.75 83.69 0.02 OUTLIER 'General case' 0 C--N 1.334 -0.102 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.079 -179.392 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 37.6 p -80.08 35.72 0.33 Allowed 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.317 -0.401 . . . . 0.0 109.924 179.938 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 185' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -157.32 79.89 0.89 Allowed 'General case' 0 CA--C 1.517 -0.319 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.535 179.831 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 186' ' ' GLU . . . . . . . . . . . . . 69.5 mm-40 -134.05 94.84 3.31 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-O 120.952 0.406 . . . . 0.0 110.425 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 86.4 tttt -64.59 -32.21 73.76 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.512 179.902 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 188' ' ' CYS . . . . . . . . . . . . . 13.4 t 60.38 69.53 0.68 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.625 -179.7 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 189' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -130.6 81.29 1.99 Allowed 'General case' 0 CA--C 1.517 -0.296 0 CA-C-O 120.963 0.411 . . . . 0.0 110.415 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 190' ' ' ASN . . . . . . . . . . . . . 52.8 p30 -92.92 9.01 37.31 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.297 179.52 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 191' ' ' ASN . . . . . . . . . . . . . 56.8 t-20 . . . . . 0 C--O 1.22 -0.5 0 CA-C-O 118.013 -0.994 . . . . 0.0 110.57 179.939 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 68.6 m . . . . . 0 N--CA 1.49 1.567 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . 54.33 50.24 16.73 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.585 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -152.98 43.51 0.63 Allowed Glycine 0 N--CA 1.464 0.543 0 N-CA-C 110.861 -0.896 . . . . 0.0 110.861 -179.888 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.554 ' N ' HD12 ' A' ' 27' ' ' LEU . 8.6 mp -88.67 38.79 0.89 Allowed 'General case' 0 CA--C 1.513 -0.456 0 O-C-N 122.719 -0.283 . . . . 0.0 110.37 -179.801 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.419 ' C ' ' O ' ' A' ' 27' ' ' LEU . 49.5 p -35.8 -32.83 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.419 0 CA-C-O 120.904 0.383 . . . . 0.0 110.848 -179.917 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . 0.447 ' N ' ' O ' ' A' ' 27' ' ' LEU . . . 118.79 -100.08 0.81 Allowed Glycine 0 N--CA 1.464 0.557 0 N-CA-C 111.133 -0.787 . . . . 0.0 111.133 178.373 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -47.52 -55.09 9.86 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 121.029 -0.269 . . . . 0.0 111.172 -179.001 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 11.8 m -58.26 -45.6 87.52 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.647 -179.363 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 13.2 tppt? -63.37 -54.19 40.66 Favored 'General case' 0 N--CA 1.442 -0.871 0 C-N-CA 120.406 -0.517 . . . . 0.0 110.942 179.766 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 97.0 mt -59.79 -42.48 89.02 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 N-CA-C 109.373 -0.603 . . . . 0.0 109.373 -178.479 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 72.1 ttt-85 -61.88 -37.6 85.15 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.872 0.368 . . . . 0.0 110.745 -179.431 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 36.1 mt -67.44 -39.81 85.43 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.548 -0.296 . . . . 0.0 111.431 178.961 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 82.3 tt0 -68.3 -44.96 74.31 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.32 -179.766 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 71.7 ttt-85 -65.95 -44.16 85.82 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.357 179.927 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 15.4 m -69.74 -34.03 73.27 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.681 -179.911 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -72.01 -41.54 67.46 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.869 179.993 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -59.53 -31.33 69.3 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.527 -179.79 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 81.1 m-20 -68.15 -22.78 64.84 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.085 0.469 . . . . 0.0 110.807 -178.924 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 68.6 mt -65.89 -53.94 32.67 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.417 -179.457 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 71.0 p -76.01 -35.62 59.47 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.086 0.47 . . . . 0.0 111.274 -179.014 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 67.0 t0 -65.61 -39.97 92.11 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.745 -177.948 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 59.1 mm-40 -68.2 -51.16 48.68 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.95 -179.326 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 8.0 pt -67.68 -27.26 37.54 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.728 0 O-C-N 123.645 0.591 . . . . 0.0 110.694 -179.335 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 12.2 m-20 -62.43 -42.02 99.14 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.133 -179.892 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -52.28 -29.68 24.4 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.136 -179.179 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 57.1 mt -66.01 -43.28 92.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.239 179.363 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -56.15 -44.42 79.25 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 -179.004 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 5.9 mtpm? -64.56 -39.25 93.41 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.722 179.569 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 83.1 m-20 -58.61 -32.34 68.91 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.209 -179.099 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -67.0 -32.19 73.26 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.835 0.35 . . . . 0.0 110.657 179.481 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -57.01 -37.39 71.63 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.673 -179.239 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.531 ' N ' HD12 ' A' ' 55' ' ' LEU . 10.1 mp -52.47 -18.45 1.68 Allowed 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.524 -179.691 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 27.7 mtmm -129.71 146.08 51.5 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-O 120.919 0.39 . . . . 0.0 110.356 -179.744 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -73.24 47.19 1.32 Allowed Glycine 0 C--N 1.33 0.228 0 N-CA-C 111.035 -0.826 . . . . 0.0 111.035 -179.747 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.426 ' O ' HG13 ' A' ' 58' ' ' VAL . 12.5 p -112.96 131.48 64.43 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.429 0 CA-C-O 121.17 0.509 . . . . 0.0 110.369 -179.99 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . 0.442 ' C ' ' H ' ' A' ' 61' ' ' ASP . 10.3 m120 -86.74 179.08 6.83 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.088 0.47 . . . . 0.0 110.407 179.622 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . 0.631 ' O ' ' N ' ' A' ' 62' ' ' ALA . 0.2 OUTLIER -72.91 10.87 0.78 Allowed 'General case' 0 C--O 1.22 -0.499 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.175 179.061 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . 0.442 ' H ' ' C ' ' A' ' 59' ' ' ASN . 4.8 m-20 60.99 -51.21 0.1 Allowed 'General case' 0 C--N 1.321 -0.662 0 O-C-N 123.897 0.748 . . . . 0.0 110.918 -179.483 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.631 ' N ' ' O ' ' A' ' 60' ' ' PHE . . . 60.99 81.88 0.18 Allowed 'General case' 0 N--CA 1.446 -0.634 0 CA-C-N 116.52 -0.309 . . . . 0.0 110.356 179.76 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 25.9 m-85 -46.67 146.93 1.38 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.701 -179.562 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.443 ' HG3' ' H ' ' A' ' 65' ' ' ASP . 6.4 pttm -149.84 -60.18 0.2 Allowed 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.23 -179.325 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.443 ' H ' ' HG3' ' A' ' 64' ' ' LYS . 51.3 t0 -159.73 -23.64 0.07 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.508 -179.35 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 5.5 tmtt? -60.11 -49.12 78.89 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-O 121.202 0.525 . . . . 0.0 110.279 -178.869 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 26.3 ttpp -64.4 129.36 39.59 Favored 'General case' 0 CA--C 1.515 -0.377 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.459 179.953 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . 0.415 ' OG1' ' N ' ' A' ' 69' ' ' GLY . 75.5 p -105.19 -85.88 0.47 Allowed 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.181 179.888 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . 0.415 ' N ' ' OG1' ' A' ' 68' ' ' THR . . . -78.86 -113.27 0.21 Allowed Glycine 0 CA--C 1.525 0.674 0 N-CA-C 110.619 -0.992 . . . . 0.0 110.619 179.905 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 6.9 t -174.68 135.02 0.39 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.805 0.335 . . . . 0.0 110.538 179.879 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . 0.639 ' H ' ' CD2' ' A' ' 79' ' ' LEU . . . 76.7 3.2 78.66 Favored Glycine 0 N--CA 1.46 0.271 0 N-CA-C 110.716 -0.953 . . . . 0.0 110.716 179.497 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 41.2 t -116.77 -88.1 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.297 0 CA-C-O 120.806 0.336 . . . . 0.0 110.42 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 23.2 t -78.63 75.76 5.14 Favored 'General case' 0 CA--C 1.511 -0.55 0 N-CA-C 109.938 -0.393 . . . . 0.0 109.938 -179.403 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 168.0 -175.11 0.02 OUTLIER 'General case' 0 CA--C 1.517 -0.303 0 O-C-N 123.473 0.483 . . . . 0.0 110.453 -179.403 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 17.6 m120 -100.13 137.09 19.98 Favored Pre-proline 0 N--CA 1.448 -0.552 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.548 179.81 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 69.9 Cg_endo -75.66 -3.82 14.39 Favored 'Trans proline' 0 C--N 1.316 -1.138 0 C-N-CA 122.596 2.197 . . . . 0.0 111.916 179.757 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 69.6 t80 -68.88 -60.02 2.67 Favored 'General case' 0 C--N 1.319 -0.72 0 C-N-CA 120.784 -0.367 . . . . 0.0 111.383 -179.085 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . 0.509 ' CD1' ' O ' ' A' ' 60' ' ' PHE . 20.2 tt -76.06 -24.98 16.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.125 -179.001 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.639 ' CD2' ' H ' ' A' ' 71' ' ' GLY . 3.3 mp -72.53 -55.0 7.64 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.742 -179.435 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -63.32 -27.94 69.66 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.24 -179.424 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -61.55 -31.47 71.51 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.584 -179.749 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 33.8 ttmt -63.45 -22.68 67.03 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.72 -179.53 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 31.2 t -70.6 -44.74 76.5 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.998 -179.785 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 81.5 mmt-85 -61.71 -35.83 79.18 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.937 -178.993 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -62.47 -47.9 81.96 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.237 -179.827 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 73.6 p -67.25 -27.34 67.13 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.694 -179.716 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 31.2 m -61.35 -54.21 46.67 Favored 'General case' 0 C--N 1.326 -0.436 0 C-N-CA 120.573 -0.451 . . . . 0.0 111.424 -178.709 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 46.2 t -71.51 -45.72 66.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.248 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -56.32 -39.86 73.47 Favored 'General case' 0 C--O 1.218 -0.554 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.7 -178.662 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 79.7 tt0 -55.14 -47.8 74.57 Favored 'General case' 0 C--N 1.319 -0.761 0 C-N-CA 120.842 -0.343 . . . . 0.0 110.574 -179.938 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 53.3 mtpt -53.81 -36.77 62.85 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.587 -179.07 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 73.8 t80 -60.44 -42.21 95.64 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.592 179.663 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 58.7 t -59.1 -48.42 86.81 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.517 -177.924 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 70.4 mt -54.33 -42.06 55.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.393 179.906 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -53.85 -35.02 61.05 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.419 -179.777 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 37.4 mm -62.53 -43.32 98.27 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.781 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 83.4 tt0 -61.22 -44.86 96.59 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.962 -179.469 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 4.0 mp0 -59.55 -37.74 79.22 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.71 -179.728 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 73.1 mm-40 -67.87 -39.14 83.78 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.526 -179.543 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . 0.417 ' O ' ' N ' ' A' ' 104' ' ' LYS . . . -60.45 -33.96 73.3 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.343 -179.953 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 97.2 m -62.28 -44.05 97.42 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.395 -179.821 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 65.2 mttp -67.04 -11.13 56.21 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.401 -179.351 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.503 ' O ' ' C ' ' A' ' 104' ' ' LYS . 61.2 mt -115.23 -11.59 11.95 Favored 'General case' 0 CA--C 1.502 -0.879 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.625 -179.732 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.503 ' C ' ' O ' ' A' ' 103' ' ' LEU . 36.4 ttpt -23.31 -47.0 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.694 0 O-C-N 123.705 0.628 . . . . 0.0 111.107 179.881 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . 0.508 ' CD ' ' H ' ' A' ' 105' ' ' GLU . 1.9 mp0 -53.96 -154.27 0.0 OUTLIER 'General case' 0 C--O 1.225 -0.208 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.998 177.697 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . 0.755 HG23 ' H ' ' A' ' 107' ' ' GLY . 5.1 t -46.25 -58.88 3.28 Favored 'General case' 0 C--N 1.322 -0.625 0 O-C-N 122.122 -0.361 . . . . 0.0 110.924 179.77 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . 0.755 ' H ' HG23 ' A' ' 106' ' ' THR . . . 72.62 148.61 0.88 Allowed Glycine 0 CA--C 1.522 0.506 0 N-CA-C 110.554 -1.018 . . . . 0.0 110.554 -179.632 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 11.4 t -97.04 136.37 37.7 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 120.913 0.387 . . . . 0.0 110.361 179.721 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 78.5 p -63.73 -35.47 80.69 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.756 -179.888 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -64.92 -36.27 92.89 Favored Glycine 0 CA--C 1.522 0.501 0 N-CA-C 111.079 -0.808 . . . . 0.0 111.079 -179.769 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 12.5 tm-20 -62.31 -47.52 83.91 Favored 'General case' 0 C--N 1.325 -0.458 0 C-N-CA 120.784 -0.367 . . . . 0.0 110.812 -179.443 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 69.3 m-85 -65.21 -38.53 90.72 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.329 -179.386 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 67.3 m -56.42 -40.93 75.53 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.417 -179.839 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -66.09 -28.31 68.73 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.376 179.405 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 42.1 tpp -74.12 -53.66 9.44 Favored 'General case' 0 C--N 1.333 -0.15 0 C-N-CA 120.66 -0.416 . . . . 0.0 110.713 -179.145 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 41.1 t80 -51.26 -37.83 49.33 Favored 'General case' 0 N--CA 1.461 0.086 0 N-CA-C 110.1 -0.333 . . . . 0.0 110.1 -179.576 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 26.2 m-20 -61.93 -41.65 98.2 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.001 179.552 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.549 HD23 ' O ' ' A' ' 118' ' ' LEU . 1.2 tt -60.1 -41.55 92.78 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-O 120.933 0.397 . . . . 0.0 110.064 -179.636 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' MET . . . . . 0.542 ' SD ' ' SD ' ' A' ' 160' ' ' MET . 14.7 tpt -57.53 -47.69 81.33 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.536 -0.756 . . . . 0.0 109.503 -179.86 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 74.2 t80 -59.63 -43.51 93.8 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.432 -179.514 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 97.6 mt-10 -59.08 -35.74 73.9 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.716 -179.766 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 122' ' ' VAL . . . . . 0.636 ' O ' HD23 ' A' ' 126' ' ' LEU . 87.7 t -82.61 -24.31 8.76 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.662 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.399 -179.855 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 15.6 m -75.53 -27.94 58.9 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-O 121.078 0.466 . . . . 0.0 111.048 -179.324 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . 0.538 ' N ' ' HD2' ' A' ' 125' ' ' PRO . 4.0 mmtm -63.02 -58.04 18.26 Favored Pre-proline 0 C--O 1.213 -0.852 0 C-N-CA 120.563 -0.455 . . . . 0.0 112.185 -179.513 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . 0.538 ' HD2' ' N ' ' A' ' 124' ' ' LYS . 28.5 Cg_endo -59.8 -30.23 91.47 Favored 'Trans proline' 0 C--N 1.302 -1.893 0 C-N-CA 122.647 2.231 . . . . 0.0 112.532 -178.927 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.636 HD23 ' O ' ' A' ' 122' ' ' VAL . 3.2 mm? -60.72 -35.35 76.1 Favored 'General case' 0 C--N 1.312 -1.045 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.783 -179.635 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 127' ' ' GLN . . . . . 0.404 ' CG ' ' N ' ' A' ' 128' ' ' LYS . 8.3 pt20 -51.5 -38.15 52.61 Favored 'General case' 0 C--N 1.311 -1.108 0 O-C-N 123.825 0.703 . . . . 0.0 110.504 -179.257 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . 0.404 ' N ' ' CG ' ' A' ' 127' ' ' GLN . 55.6 mtpt -63.53 -10.4 17.81 Favored 'General case' 0 CA--C 1.514 -0.412 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.922 -178.582 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 15.8 mt -117.61 21.86 12.72 Favored 'General case' 0 CA--C 1.509 -0.625 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.936 179.883 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . 0.517 ' O ' ' C ' ' A' ' 131' ' ' ILE . . . 101.15 -121.76 7.35 Favored Glycine 0 CA--C 1.506 -0.474 0 N-CA-C 110.735 -0.946 . . . . 0.0 110.735 179.589 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 131' ' ' ILE . . . . . 0.81 ' N ' HD12 ' A' ' 131' ' ' ILE . 2.0 mp 21.79 81.78 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 CA-C-N 116.591 0.195 . . . . 0.0 111.131 -179.439 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 69.5 tp60 -106.51 74.88 1.04 Allowed 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 -178.564 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 174.81 -6.81 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 O-C-N 123.452 0.47 . . . . 0.0 110.456 179.847 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 7.5 tpt -51.21 -40.33 58.5 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.493 -179.123 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 24.8 m -73.0 -59.76 2.56 Favored 'General case' 0 C--O 1.214 -0.777 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.048 179.444 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 136' ' ' LYS . . . . . 0.41 ' H ' ' HG2' ' A' ' 136' ' ' LYS . 44.9 mmtm -43.46 -50.8 6.9 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.982 -0.377 . . . . 0.0 109.982 -178.798 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 91.5 m -58.54 -52.11 67.06 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.629 -0.428 . . . . 0.0 110.925 179.621 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 48.7 t -64.03 -44.01 97.69 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.856 179.929 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 73.9 m -64.4 -42.19 96.24 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.495 -179.397 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 19.1 m-20 -67.07 -30.53 70.61 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.46 -179.58 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -71.43 -28.29 63.87 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.826 -179.433 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . 0.455 ' O ' ' O ' ' A' ' 143' ' ' GLU . . . -75.07 -29.97 60.84 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.695 -179.372 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . 0.533 ' O ' ' N ' ' A' ' 145' ' ' ASN . 69.3 tt0 -60.48 -119.47 0.0 OUTLIER 'General case' 0 C--O 1.211 -0.956 0 CA-C-O 119.082 -0.485 . . . . 0.0 109.811 -179.382 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 144' ' ' GLU . . . . . 0.501 ' C ' ' O ' ' A' ' 143' ' ' GLU . 84.0 tt0 18.54 -82.98 0.0 OUTLIER 'General case' 0 CA--C 1.518 -0.263 0 O-C-N 123.696 0.623 . . . . 0.0 111.678 -179.599 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 145' ' ' ASN . . . . . 0.533 ' N ' ' O ' ' A' ' 143' ' ' GLU . 57.7 t30 -127.19 95.58 36.07 Favored Pre-proline 0 CA--C 1.534 0.365 0 CA-C-N 115.467 -0.788 . . . . 0.0 111.24 178.332 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 146' ' ' PRO . . . . . . . . . . . . . 69.8 Cg_exo -50.07 125.16 14.15 Favored 'Trans proline' 0 C--N 1.321 -0.915 0 C-N-CA 122.653 2.235 . . . . 0.0 112.183 179.367 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 147' ' ' PRO . . . . . 0.442 ' C ' ' H ' ' A' ' 149' ' ' THR . 68.2 Cg_endo -75.37 70.52 5.52 Favored 'Trans proline' 0 C--N 1.312 -1.395 0 C-N-CA 122.527 2.151 . . . . 0.0 112.646 -179.402 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 40.2 p -77.88 22.05 0.29 Allowed 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.352 -179.914 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 149' ' ' THR . . . . . 0.478 HG22 ' N ' ' A' ' 150' ' ' ALA . 16.6 m -137.6 163.36 31.41 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.539 179.55 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 150' ' ' ALA . . . . . 0.478 ' N ' HG22 ' A' ' 149' ' ' THR . . . -62.99 -41.39 99.56 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.609 179.432 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 87.9 mt-30 -68.31 -33.68 74.76 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.139 179.804 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . -63.77 -51.42 53.88 Favored Glycine 0 CA--C 1.526 0.724 0 N-CA-C 110.834 -0.906 . . . . 0.0 110.834 -179.843 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 153' ' ' VAL . . . . . . . . . . . . . 69.1 t -60.77 -25.01 34.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 N-CA-C 110.157 -0.312 . . . . 0.0 110.157 -179.589 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . 0.535 ' O ' HD23 ' A' ' 154' ' ' LEU . 1.0 OUTLIER -59.03 -39.74 82.9 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 121.133 0.492 . . . . 0.0 109.776 -179.011 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -59.84 -50.92 71.93 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 179.86 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 20.1 mm -54.31 -56.06 11.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 C-N-CA 120.789 -0.364 . . . . 0.0 110.452 -179.417 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -50.32 -49.03 54.98 Favored 'General case' 0 C--N 1.33 -0.277 0 O-C-N 123.502 0.501 . . . . 0.0 110.339 179.9 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 158' ' ' LYS . . . . . 0.459 ' NZ ' ' OE2' ' A' ' 162' ' ' GLU . 63.6 tttm -64.91 -37.28 87.11 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.445 179.004 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 61.5 tttp -66.87 -31.96 72.91 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.308 -179.82 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 160' ' ' MET . . . . . 0.542 ' SD ' ' SD ' ' A' ' 119' ' ' MET . 3.8 mtm -67.3 -44.73 78.48 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.36 179.475 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 78.1 ttt180 -65.59 -33.23 75.43 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.411 -179.888 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . 0.459 ' OE2' ' NZ ' ' A' ' 158' ' ' LYS . 95.7 mt-10 -71.25 -29.68 65.4 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.152 -0.477 . . . . 0.0 111.0 -179.711 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 163' ' ' LYS . . . . . . . . . . . . . 2.0 tmtm? -83.11 -42.74 17.04 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-O 121.804 0.811 . . . . 0.0 110.94 -179.104 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 6.0 mt -67.82 -30.74 70.23 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.695 -0.684 . . . . 0.0 112.016 -178.607 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 165' ' ' GLN . . . . . 0.401 ' HG3' ' O ' ' A' ' 162' ' ' GLU . 4.5 pp0? -64.28 -31.82 73.17 Favored 'General case' 0 C--N 1.314 -0.963 0 O-C-N 123.776 0.673 . . . . 0.0 110.575 -179.08 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 58.4 ttt85 -65.88 -31.28 72.13 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.049 -179.346 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 167' ' ' VAL . . . . . . . . . . . . . 21.3 t -70.04 -45.22 77.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.066 -179.836 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 14.4 t60 -77.91 -30.03 50.43 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.627 -178.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 169' ' ' THR . . . . . . . . . . . . . 97.0 m -71.39 -46.54 60.03 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.952 -179.697 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 36.2 ttpt -60.76 -44.0 97.3 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.91 -179.286 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 171' ' ' ASN . . . . . . . . . . . . . 10.7 m120 -62.35 -30.88 71.49 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.608 179.725 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 172' ' ' TYR . . . . . . . . . . . . . 43.7 t80 -73.33 -35.29 66.01 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.09 0.472 . . . . 0.0 110.732 -179.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 1.9 t -76.61 -31.52 57.48 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.803 -179.375 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 9.2 p -60.82 -48.89 79.73 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.193 -179.1 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 11.0 mp -69.38 -32.19 71.07 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.338 179.23 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 33.9 ttmt -58.84 -28.52 66.14 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.091 -179.693 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 177' ' ' LYS . . . . . . . . . . . . . 58.9 tttm -55.48 -28.84 56.94 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.426 179.659 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 178' ' ' LYS . . . . . . . . . . . . . 25.2 mmtp -60.73 -44.28 96.85 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.441 -179.119 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 77.3 mt-10 -63.06 -32.66 74.08 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.157 -0.474 . . . . 0.0 109.85 179.376 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 180' ' ' ASN . . . . . . . . . . . . . 6.0 p30 -138.24 94.6 2.89 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-O 121.15 0.5 . . . . 0.0 109.962 179.661 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 11.1 t -52.68 -43.36 65.53 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.513 -179.35 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 182' ' ' THR . . . . . . . . . . . . . 64.3 p -60.44 96.12 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.476 179.379 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 183' ' ' PHE . . . . . 0.602 ' CD1' ' N ' ' A' ' 184' ' ' THR . 13.8 p90 -61.14 -44.84 96.71 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.076 0.465 . . . . 0.0 110.488 -179.971 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 184' ' ' THR . . . . . 0.602 ' N ' ' CD1' ' A' ' 183' ' ' PHE . 23.0 m -51.66 148.78 5.09 Favored 'General case' 0 CA--C 1.519 -0.231 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.526 -177.74 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 185' ' ' ASP . . . . . . . . . . . . . 36.4 t70 58.65 55.31 4.82 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.315 179.354 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 186' ' ' GLU . . . . . . . . . . . . . 80.6 mm-40 -136.63 -49.18 0.64 Allowed 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.185 179.548 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 34.3 tptt 54.84 105.24 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.925 179.947 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 188' ' ' CYS . . . . . . . . . . . . . 84.9 m -70.99 -53.81 13.49 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.591 179.764 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 189' ' ' LYS . . . . . 0.406 ' HZ2' ' ND2' ' A' ' 190' ' ' ASN . 62.9 tttm 46.63 -104.16 0.09 Allowed 'General case' 0 C--N 1.333 -0.121 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.232 -179.524 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 190' ' ' ASN . . . . . 0.473 ' OD1' ' N ' ' A' ' 190' ' ' ASN . 10.8 p-10 -125.23 -69.41 0.79 Allowed 'General case' 0 N--CA 1.455 -0.193 0 N-CA-C 109.955 -0.387 . . . . 0.0 109.955 179.709 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 191' ' ' ASN . . . . . 0.453 ' H ' ' CG ' ' A' ' 190' ' ' ASN . 53.0 p30 . . . . . 0 C--O 1.219 -0.525 0 CA-C-O 117.978 -1.011 . . . . 0.0 110.579 -179.379 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 70.6 m . . . . . 0 N--CA 1.49 1.556 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -166.29 -176.07 3.52 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.454 179.972 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . 0.492 ' O ' ' C ' ' A' ' 27' ' ' LEU . . . -174.86 -42.35 0.05 OUTLIER Glycine 0 CA--C 1.499 -0.906 0 CA-C-O 118.503 -1.165 . . . . 0.0 110.919 -179.94 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.492 ' C ' ' O ' ' A' ' 26' ' ' GLY . 50.7 mt -17.95 136.09 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.816 0 O-C-N 124.695 0.879 . . . . 0.0 111.239 179.532 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.7 t -152.03 45.33 0.75 Allowed 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.073 0.463 . . . . 0.0 109.997 -178.784 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . 0.587 ' O ' ' HB3' ' A' ' 30' ' ' ALA . . . 112.35 24.08 5.2 Favored Glycine 0 N--CA 1.472 1.099 0 N-CA-C 110.601 -1.0 . . . . 0.0 110.601 -179.781 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.587 ' HB3' ' O ' ' A' ' 29' ' ' GLY . . . 77.93 -20.77 0.36 Allowed 'General case' 0 C--O 1.221 -0.426 0 CA-C-O 121.531 0.681 . . . . 0.0 110.822 179.766 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.408 ' H ' ' C ' ' A' ' 29' ' ' GLY . 88.9 m -46.2 -34.31 4.26 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.369 -178.551 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 18.6 mmtp -64.25 -24.01 67.51 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.468 179.811 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 44.2 mm -62.0 -42.53 95.2 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.887 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 -179.073 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 45.0 ttm180 -63.32 -42.77 99.03 Favored 'General case' 0 C--N 1.321 -0.668 0 O-C-N 123.488 0.493 . . . . 0.0 110.141 -179.845 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 41.5 mt -66.66 -37.11 84.13 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.441 -179.765 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 80.4 tt0 -62.58 -45.51 92.6 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.6 -179.381 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -66.59 -40.82 89.09 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.329 179.937 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 83.5 p -73.49 -22.76 60.05 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.449 179.824 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -70.09 -49.54 49.9 Favored 'General case' 0 C--O 1.224 -0.27 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.768 -179.807 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 65.3 tttp -54.78 -42.68 72.05 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.567 -179.86 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . 0.413 ' OD1' ' N ' ' A' ' 41' ' ' ASP . 2.0 m-20 -50.44 -23.51 2.48 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.642 -179.336 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 72.2 mt -63.71 -50.89 75.96 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.094 -179.703 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 76.0 p -76.03 -38.51 57.15 Favored 'General case' 0 C--O 1.223 -0.3 0 CA-C-O 121.406 0.622 . . . . 0.0 110.797 -178.686 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 48.2 t0 -61.86 -35.99 79.93 Favored 'General case' 0 CA--C 1.519 -0.239 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.66 -177.472 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 66.1 mm-40 -71.26 -53.32 14.74 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.24 -179.76 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 9.3 pt -69.34 -31.84 51.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.706 -178.879 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 35.5 t0 -63.76 -29.45 70.66 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.181 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -67.31 -36.03 80.65 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.411 -0.358 . . . . 0.0 110.709 -179.763 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 70.4 mt -59.21 -48.42 86.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.137 -179.07 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 9.4 mtmp? -64.76 -36.4 84.19 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.469 179.707 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -62.74 -44.33 96.5 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.998 -0.547 . . . . 0.0 110.536 -179.688 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 60.1 m-20 -77.14 -35.34 56.23 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 116.511 -0.313 . . . . 0.0 110.896 -179.95 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -70.26 -38.81 75.2 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.799 -179.895 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . 0.528 ' O ' ' N ' ' A' ' 56' ' ' LYS . . . -50.79 -52.67 38.72 Favored 'General case' 0 CA--C 1.501 -0.936 0 CA-C-O 118.832 -0.604 . . . . 0.0 111.093 -178.929 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.554 ' O ' ' C ' ' A' ' 56' ' ' LYS . 4.5 mm? -12.98 80.96 0.0 OUTLIER 'General case' 0 CA--C 1.497 -1.095 0 O-C-N 124.423 1.077 . . . . 0.0 111.469 -179.744 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.554 ' C ' ' O ' ' A' ' 55' ' ' LEU . 1.1 ptmm? 8.77 67.5 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.63 0 O-C-N 124.793 1.308 . . . . 0.0 110.91 -178.256 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . 0.424 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . -156.56 -88.33 0.07 OUTLIER Glycine 0 CA--C 1.519 0.337 0 N-CA-C 110.661 -0.976 . . . . 0.0 110.661 -178.06 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 48.1 t -52.53 132.06 14.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-O 120.954 0.406 . . . . 0.0 110.599 -179.344 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . 0.404 ' O ' ' O ' ' A' ' 60' ' ' PHE . 8.1 m120 -64.65 -49.51 70.72 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.126 -179.188 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . 0.404 ' O ' ' O ' ' A' ' 59' ' ' ASN . 4.0 t80 50.96 176.54 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.768 -179.311 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 84.0 m-20 51.76 55.58 9.11 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.502 179.409 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -155.94 80.95 1.0 Allowed 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.45 -179.865 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 99.2 m-85 -116.23 7.95 14.19 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.345 179.672 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 65.2 mttp -53.7 -58.54 6.85 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.523 -179.785 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 90.9 m-20 -77.14 143.9 38.8 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.319 179.854 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 65.3 mttp -70.7 145.97 50.21 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.42 -179.851 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -75.9 149.94 37.66 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.29 179.914 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 3.5 t -149.23 156.8 42.7 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.496 -179.908 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 71.87 -108.6 2.54 Favored Glycine 0 CA--C 1.524 0.636 0 N-CA-C 110.981 -0.847 . . . . 0.0 110.981 179.924 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 24.2 t -169.51 -133.86 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.651 0.263 . . . . 0.0 110.683 -179.881 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -56.3 -52.8 47.39 Favored Glycine 0 C--N 1.333 0.361 0 N-CA-C 110.494 -1.042 . . . . 0.0 110.494 -179.69 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 27.5 m -39.03 157.77 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.209 0 CA-C-N 116.655 0.228 . . . . 0.0 110.598 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 40.3 t 56.01 -95.84 0.06 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.88 0.372 . . . . 0.0 110.272 -178.729 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . 0.493 ' O ' ' C ' ' A' ' 75' ' ' ASN . 43.8 tp10 -49.98 96.47 0.01 OUTLIER 'General case' 0 CA--C 1.51 -0.584 0 CA-C-O 119.299 -0.382 . . . . 0.0 110.491 -179.839 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . 0.639 ' N ' HD22 ' A' ' 75' ' ' ASN . 0.0 OUTLIER -22.32 111.03 0.15 Allowed Pre-proline 0 CA--C 1.544 0.717 0 O-C-N 124.556 1.16 . . . . 0.0 110.858 -179.969 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -51.14 -1.22 0.05 OUTLIER 'Trans proline' 0 C--N 1.31 -1.454 0 C-N-CA 122.564 2.176 . . . . 0.0 112.2 -179.038 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . 0.557 ' H ' ' C ' ' A' ' 75' ' ' ASN . 20.1 m-85 -66.79 -46.93 73.71 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-O 120.668 0.271 . . . . 0.0 110.662 -179.763 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 77.4 mt -72.17 -32.64 43.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-O 121.127 0.489 . . . . 0.0 110.358 -179.248 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.687 HD22 ' N ' ' A' ' 79' ' ' LEU . 3.2 mm? -66.88 -48.31 69.16 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.801 -178.723 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -69.31 -27.13 65.11 Favored 'General case' 0 C--N 1.317 -0.836 0 O-C-N 123.698 0.624 . . . . 0.0 109.969 179.664 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -79.24 -19.56 50.37 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.086 0.47 . . . . 0.0 110.837 179.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.47 ' NZ ' ' CG2' ' A' ' 167' ' ' VAL . 53.1 tttm -70.5 -46.34 63.88 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.606 -179.499 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 16.4 m -71.59 -38.11 66.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.494 179.807 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -62.6 -38.64 90.95 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.662 -179.754 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -58.97 -42.26 89.5 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.698 -179.811 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 33.3 p -81.33 -20.0 41.65 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.706 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 85.9 m -62.09 -53.11 60.1 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 120.666 -0.413 . . . . 0.0 110.984 -178.471 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 48.9 t -69.37 -41.3 80.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 121.147 0.499 . . . . 0.0 110.639 -179.427 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -62.96 -36.81 84.71 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.769 -178.859 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 79.2 tt0 -54.94 -31.35 60.38 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.637 -179.906 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 63.8 mttp -66.51 -36.2 82.13 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.565 -179.969 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 87.6 t80 -62.35 -60.65 3.25 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.429 -178.624 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 16.5 m -51.65 -40.99 27.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-O 121.093 0.473 . . . . 0.0 110.602 -178.72 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 49.3 mt -57.04 -41.79 78.13 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 N-CA-C 109.783 -0.451 . . . . 0.0 109.783 -179.94 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.99 -36.56 79.76 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.081 -179.77 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 30.5 mm -63.87 -43.94 97.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.535 -179.857 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 75.7 tt0 -58.34 -46.78 85.59 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.358 -179.404 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -70.74 -35.44 72.68 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.97 0.414 . . . . 0.0 110.793 -179.48 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 47.8 tp10 -62.75 -46.67 86.99 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.686 -179.27 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -56.12 -38.62 71.05 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.877 0.37 . . . . 0.0 110.478 -179.17 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 19.5 m -61.64 -41.86 98.09 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.653 -179.652 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -64.38 -40.76 96.45 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.912 -178.826 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.534 ' O ' ' O ' ' A' ' 104' ' ' LYS . 33.9 mt -84.93 -10.3 57.22 Favored 'General case' 0 C--O 1.2 -1.542 0 CA-C-O 116.993 -1.479 . . . . 0.0 111.013 -178.702 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.534 ' O ' ' O ' ' A' ' 103' ' ' LEU . 0.0 OUTLIER 4.4 -124.71 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.062 0 O-C-N 125.243 1.59 . . . . 0.0 111.038 178.951 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . 0.55 ' O ' ' N ' ' A' ' 107' ' ' GLY . 69.7 mm-40 -56.98 -162.31 0.0 OUTLIER 'General case' 0 N--CA 1.437 -1.122 0 N-CA-C 109.986 -0.376 . . . . 0.0 109.986 178.653 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . 0.444 ' CG2' ' HZ2' ' A' ' 104' ' ' LYS . 2.1 t 32.21 31.23 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 120.995 0.426 . . . . 0.0 110.87 -179.52 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . 0.55 ' N ' ' O ' ' A' ' 105' ' ' GLU . . . -89.28 158.66 27.97 Favored Glycine 0 C--N 1.335 0.506 0 N-CA-C 110.053 -1.219 . . . . 0.0 110.053 -179.103 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 55.9 m -114.75 124.43 51.76 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-O 120.919 0.39 . . . . 0.0 110.232 -179.744 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 77.9 p -59.99 -33.52 72.09 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.555 -179.985 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -63.61 -40.69 98.92 Favored Glycine 0 CA--C 1.524 0.62 0 N-CA-C 111.127 -0.789 . . . . 0.0 111.127 -179.548 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -67.58 -41.58 83.92 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.649 0.261 . . . . 0.0 110.586 -179.801 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 40.8 m-85 -63.06 -39.57 95.12 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.35 179.923 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 36.9 t -55.2 -38.21 68.09 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.144 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -69.88 -24.08 63.36 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.624 178.923 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 36.8 tpp -76.68 -45.79 28.29 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.063 -179.841 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 37.3 t80 -64.11 -36.24 83.37 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.877 0.37 . . . . 0.0 110.26 -179.374 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -65.6 -29.34 69.92 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.382 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.572 HD23 ' O ' ' A' ' 118' ' ' LEU . 3.1 tt -64.18 -49.3 72.57 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 122.134 0.969 . . . . 0.0 110.723 -179.564 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 15.8 tpt -50.54 -41.64 54.25 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.146 -179.29 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 51.9 t80 -60.29 -41.97 94.48 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.059 0.457 . . . . 0.0 111.326 -179.83 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 -58.98 -51.95 67.87 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.913 -178.991 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 29.1 m -72.94 -24.0 20.77 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-O 121.096 0.474 . . . . 0.0 110.856 -179.431 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 40.5 t -61.55 -27.18 68.44 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.454 -179.906 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . 0.45 ' CB ' ' CD ' ' A' ' 125' ' ' PRO . 16.2 mmtt -64.47 -59.19 11.29 Favored Pre-proline 0 C--O 1.222 -0.391 0 C-N-CA 120.575 -0.45 . . . . 0.0 111.775 -179.19 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . 0.45 ' CD ' ' CB ' ' A' ' 124' ' ' LYS . 61.1 Cg_exo -41.22 -36.89 2.69 Favored 'Trans proline' 0 C--N 1.306 -1.695 0 C-N-CA 122.537 2.158 . . . . 0.0 112.199 178.039 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 31.7 mt -67.52 -22.86 65.42 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.068 -179.438 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 127' ' ' GLN . . . . . 0.477 ' C ' ' H ' ' A' ' 129' ' ' LEU . 84.3 mt-30 -66.13 -50.93 62.3 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.995 0.426 . . . . 0.0 110.922 -179.621 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 73.8 mmtt -55.01 -6.11 0.12 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.609 179.713 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.477 ' H ' ' C ' ' A' ' 127' ' ' GLN . 12.1 mt -118.08 19.25 13.66 Favored 'General case' 0 N--CA 1.465 0.299 0 O-C-N 123.451 0.47 . . . . 0.0 110.826 179.328 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . 0.544 ' O ' ' HB ' ' A' ' 131' ' ' ILE . . . 73.02 -177.13 42.73 Favored Glycine 0 CA--C 1.493 -1.333 0 N-CA-C 109.608 -1.397 . . . . 0.0 109.608 179.623 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 131' ' ' ILE . . . . . 0.919 ' O ' ' O ' ' A' ' 132' ' ' GLN . 60.9 mt 85.7 -20.91 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.476 -1.893 0 CA-C-O 116.996 -1.478 . . . . 0.0 110.78 178.576 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . 0.919 ' O ' ' O ' ' A' ' 131' ' ' ILE . 67.8 mt-30 -8.19 -145.58 0.0 OUTLIER 'General case' 0 N--CA 1.479 0.976 0 O-C-N 125.544 1.778 . . . . 0.0 112.097 -179.727 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 51.53 4.44 0.02 OUTLIER 'General case' 0 C--N 1.303 -1.417 0 O-C-N 120.032 -1.667 . . . . 0.0 111.409 179.385 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 134' ' ' MET . . . . . 0.58 ' N ' ' O ' ' A' ' 132' ' ' GLN . 0.0 OUTLIER -63.19 -43.35 98.44 Favored 'General case' 0 N--CA 1.444 -0.751 0 N-CA-C 109.926 -0.398 . . . . 0.0 109.926 -179.229 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 38.6 p -71.1 -22.4 62.09 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.737 -0.665 . . . . 0.0 109.97 179.655 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 16.3 ttmm -76.6 -57.05 4.08 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.323 -178.946 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 96.6 m -52.04 -53.17 45.21 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 120.686 -0.406 . . . . 0.0 110.628 -179.296 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 138' ' ' VAL . . . . . 0.472 HG13 ' N ' ' A' ' 139' ' ' SER . 13.8 p -62.4 -39.64 85.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.787 -179.26 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . 0.472 ' N ' HG13 ' A' ' 138' ' ' VAL . 4.5 t -57.25 -33.29 67.44 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.382 -179.345 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -60.53 -39.85 89.34 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.47 -179.775 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -58.27 -51.28 70.42 Favored 'General case' 0 CA--C 1.515 -0.368 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.433 -179.752 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -41.29 -42.08 2.08 Favored 'General case' 0 CA--C 1.533 0.315 0 O-C-N 123.176 0.298 . . . . 0.0 110.482 -179.093 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 94.4 mt-10 -85.78 66.66 9.73 Favored 'General case' 0 C--N 1.322 -0.602 0 O-C-N 123.781 0.676 . . . . 0.0 109.727 177.993 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -179.45 -21.76 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 O-C-N 123.546 0.529 . . . . 0.0 110.606 179.813 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 145' ' ' ASN . . . . . 0.481 HD21 ' CD1' ' A' ' 156' ' ' ILE . 3.0 p-10 -173.04 68.31 0.37 Allowed Pre-proline 0 C--N 1.327 -0.41 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.247 -179.512 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 146' ' ' PRO . . . . . 0.541 ' O ' ' N ' ' A' ' 148' ' ' THR . 94.1 Cg_exo -37.39 118.27 0.24 Allowed 'Trans proline' 0 C--N 1.317 -1.131 0 C-N-CA 123.139 2.559 . . . . 0.0 111.69 -179.845 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 147' ' ' PRO . . . . . 0.419 ' C ' ' H ' ' A' ' 149' ' ' THR . 31.2 Cg_exo -59.98 39.86 0.05 OUTLIER 'Trans proline' 0 N--CA 1.498 1.794 0 C-N-CA 122.826 2.35 . . . . 0.0 112.408 178.931 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 148' ' ' THR . . . . . 0.541 ' N ' ' O ' ' A' ' 146' ' ' PRO . 20.6 p -65.61 0.39 1.65 Allowed 'General case' 0 N--CA 1.448 -0.573 0 N-CA-C 110.031 -0.359 . . . . 0.0 110.031 179.69 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 149' ' ' THR . . . . . 0.419 ' H ' ' C ' ' A' ' 147' ' ' PRO . 24.3 p -141.54 166.33 25.03 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.392 179.693 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -68.42 -41.31 80.59 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.626 179.778 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 99.1 mm-40 -66.76 -25.71 66.62 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.209 -179.63 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . -68.77 -33.71 76.23 Favored Glycine 0 CA--C 1.521 0.444 0 N-CA-C 111.237 -0.745 . . . . 0.0 111.237 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 153' ' ' VAL . . . . . . . . . . . . . 57.5 t -60.5 -26.48 37.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-O 120.921 0.391 . . . . 0.0 110.756 -178.786 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . 0.561 ' N ' HD22 ' A' ' 154' ' ' LEU . 4.0 mm? -62.97 -37.75 88.37 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.315 -179.073 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 42.3 tp10 -64.39 -32.93 74.74 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.064 -179.708 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 156' ' ' ILE . . . . . 0.548 ' N ' HD12 ' A' ' 156' ' ' ILE . 1.6 mp -77.06 -45.1 30.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.659 179.334 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -55.6 -43.2 75.83 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.541 -177.953 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -55.67 -47.28 76.99 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.022 -179.714 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 32.5 mmtp -65.66 -32.6 74.26 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.475 -0.33 . . . . 0.0 110.692 179.812 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 160' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -70.98 -53.23 15.62 Favored 'General case' 0 CA--C 1.515 -0.369 0 C-N-CA 120.505 -0.478 . . . . 0.0 111.309 -179.52 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 60.2 ttp180 -65.77 -42.58 90.65 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.736 -179.524 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 52.6 tp10 -57.8 -53.96 52.29 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.94 -179.061 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 163' ' ' LYS . . . . . . . . . . . . . 52.9 tptt -57.03 -35.26 69.08 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.708 -178.813 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 23.1 mt -69.57 -38.86 77.55 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.244 0.545 . . . . 0.0 111.709 -179.449 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 84.8 mt-30 -72.71 -32.11 65.5 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.648 -178.776 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 75.0 ttt180 -66.66 -40.96 88.84 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-O 121.951 0.882 . . . . 0.0 111.298 -178.622 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 167' ' ' VAL . . . . . 0.47 ' CG2' ' NZ ' ' A' ' 82' ' ' LYS . 7.7 p -75.17 -34.27 30.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 115.723 -0.672 . . . . 0.0 110.965 -179.958 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 168' ' ' HIS . . . . . 0.429 ' C ' ' ND1' ' A' ' 168' ' ' HIS . 14.6 t-80 -76.92 -41.66 42.61 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.935 -179.076 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 169' ' ' THR . . . . . . . . . . . . . 35.3 m -66.88 -43.8 82.52 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.235 -179.928 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 64.6 tttm -59.84 -48.19 82.69 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.842 -178.542 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 171' ' ' ASN . . . . . . . . . . . . . 20.0 t-20 -67.27 -40.72 86.21 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.009 0.433 . . . . 0.0 110.836 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 172' ' ' TYR . . . . . . . . . . . . . 64.1 t80 -68.76 -25.41 64.71 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.549 -179.293 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 17.0 t -78.47 -30.15 47.19 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.822 -179.209 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 22.7 p -73.06 -34.7 66.42 Favored 'General case' 0 C--O 1.222 -0.394 0 CA-C-O 121.333 0.587 . . . . 0.0 110.615 -178.983 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 99.0 mt -64.72 -43.54 93.11 Favored 'General case' 0 C--N 1.317 -0.828 0 C-N-CA 120.667 -0.413 . . . . 0.0 111.793 -178.617 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 17.7 ptpt -73.76 -14.25 61.09 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.009 -179.1 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 177' ' ' LYS . . . . . . . . . . . . . 14.9 pttp -46.93 -30.15 2.4 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.477 -0.329 . . . . 0.0 110.54 -178.98 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 178' ' ' LYS . . . . . . . . . . . . . 9.1 mtmp? -55.31 -34.62 64.32 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.858 -178.111 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 81.2 tt0 -50.64 -37.11 38.84 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.555 179.793 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 180' ' ' ASN . . . . . . . . . . . . . 83.1 m-20 -108.48 64.39 0.62 Allowed 'General case' 0 N--CA 1.47 0.551 0 CA-C-N 116.409 -0.359 . . . . 0.0 110.218 179.817 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 89.3 p -73.28 -10.81 60.15 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.471 179.783 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 182' ' ' THR . . . . . . . . . . . . . 20.8 m -60.14 -47.88 84.05 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.585 -179.638 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 183' ' ' PHE . . . . . . . . . . . . . 18.5 t80 -97.8 119.25 36.06 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.879 0.371 . . . . 0.0 110.211 179.933 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 31.1 m -64.46 119.63 10.77 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.664 -179.818 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 185' ' ' ASP . . . . . . . . . . . . . 55.1 t0 57.82 108.6 0.01 OUTLIER 'General case' 0 CA--C 1.519 -0.229 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.461 179.821 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 186' ' ' GLU . . . . . 0.473 ' N ' ' OE1' ' A' ' 186' ' ' GLU . 13.6 mp0 -114.69 135.47 54.12 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-O 120.995 0.426 . . . . 0.0 110.363 -179.745 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 34.6 ttmt -64.71 132.26 49.14 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.444 179.887 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 188' ' ' CYS . . . . . . . . . . . . . 4.5 m -81.13 -29.81 34.68 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.372 179.308 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 189' ' ' LYS . . . . . 0.462 ' NZ ' ' ND2' ' A' ' 191' ' ' ASN . 63.6 tttm 60.47 151.12 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 O-C-N 123.33 0.394 . . . . 0.0 110.637 -179.552 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 190' ' ' ASN . . . . . . . . . . . . . 58.6 t-20 -61.49 -40.17 93.58 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.5 -179.945 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 191' ' ' ASN . . . . . 0.462 ' ND2' ' NZ ' ' A' ' 189' ' ' LYS . 95.9 m-20 . . . . . 0 C--O 1.222 -0.349 0 CA-C-O 118.134 -0.936 . . . . 0.0 110.402 -179.835 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 33.9 t . . . . . 0 N--CA 1.491 1.58 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.501 ' O ' ' N ' ' A' ' 27' ' ' LEU . . . -66.02 151.24 47.27 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.464 179.904 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 56.76 -81.68 0.01 OUTLIER Glycine 0 C--N 1.333 0.399 0 N-CA-C 110.566 -1.014 . . . . 0.0 110.566 179.836 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.515 ' O ' ' OG1' ' A' ' 28' ' ' THR . 36.2 tp 55.71 106.79 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 110.017 -0.364 . . . . 0.0 110.017 -179.839 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.515 ' OG1' ' O ' ' A' ' 27' ' ' LEU . 6.8 m -171.84 -119.27 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.674 0 O-C-N 123.579 0.55 . . . . 0.0 109.707 179.163 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . 0.5 ' O ' ' HB3' ' A' ' 30' ' ' ALA . . . -134.51 93.84 0.25 Allowed Glycine 0 CA--C 1.526 0.744 0 N-CA-C 110.08 -1.208 . . . . 0.0 110.08 179.527 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.5 ' HB3' ' O ' ' A' ' 29' ' ' GLY . . . 73.16 -30.22 0.21 Allowed 'General case' 0 N--CA 1.466 0.371 0 CA-C-O 121.086 0.47 . . . . 0.0 111.062 -179.874 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.492 ' H ' ' C ' ' A' ' 29' ' ' GLY . 11.1 m -64.04 -32.74 74.39 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.351 -179.924 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.414 ' HG3' ' H ' ' A' ' 27' ' ' LEU . 1.9 tmtp? -61.95 -50.36 72.43 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.785 179.678 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 64.8 mt -64.75 -28.94 45.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.455 -179.558 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 59.9 ttm-85 -69.27 -42.63 75.27 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.628 -179.421 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 79.4 mt -65.72 -35.0 79.49 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.637 -179.589 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 80.2 mm-40 -67.19 -50.24 61.68 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.761 179.879 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 23.3 mmm180 -63.42 -43.75 96.58 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.923 0.392 . . . . 0.0 110.832 -179.234 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 78.7 p -66.86 -38.59 86.63 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.319 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -70.62 -37.08 73.77 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.872 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 33.8 tptt -62.31 -31.92 72.6 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.846 -179.252 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 82.3 m-20 -67.02 -23.6 65.93 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.86 -179.384 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 73.3 mt -62.45 -53.39 47.89 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.365 0 C-N-CA 120.731 -0.388 . . . . 0.0 110.995 -179.391 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 52.6 p -74.1 -39.99 63.03 Favored 'General case' 0 C--O 1.226 -0.183 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.475 -178.583 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -60.26 -39.54 87.16 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.119 -0.491 . . . . 0.0 112.03 -178.435 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 43.2 tp10 -70.33 -53.5 16.47 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.092 0.473 . . . . 0.0 111.385 -178.612 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 6.5 pt -67.27 -27.05 37.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.588 -179.056 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 31.7 t0 -61.82 -40.92 96.95 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 120.576 -0.449 . . . . 0.0 110.388 179.9 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -52.96 -24.85 10.24 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.383 -178.875 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 62.3 mt -64.55 -46.56 92.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.298 179.65 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 49.0 mtmt -56.53 -41.29 76.54 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.28 -178.5 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 71.4 mmtt -65.98 -41.68 90.83 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.192 179.613 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -61.87 -41.48 97.91 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.471 -179.834 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.482 ' O ' ' N ' ' A' ' 57' ' ' GLY . . . -61.34 -31.39 71.26 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.669 -179.953 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -61.89 -34.06 75.34 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.763 -179.759 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 52.3 mt -62.34 -41.97 99.01 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.948 -179.374 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -94.74 -56.26 2.84 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.599 -179.924 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . 0.482 ' N ' ' O ' ' A' ' 53' ' ' ALA . . . 98.07 47.9 1.98 Allowed Glycine 0 N--CA 1.467 0.732 0 N-CA-C 110.722 -0.951 . . . . 0.0 110.722 179.955 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.415 ' O ' ' O ' ' A' ' 59' ' ' ASN . 4.8 t -90.43 55.68 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.336 0 CA-C-O 120.822 0.344 . . . . 0.0 110.151 179.932 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . 0.415 ' O ' ' O ' ' A' ' 58' ' ' VAL . 72.7 m-80 47.38 -175.5 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.85 -179.927 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 28.2 t80 -172.2 -53.68 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.91 0.386 . . . . 0.0 110.64 179.686 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 85.4 m-20 -91.79 -10.79 38.64 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.532 -179.982 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -69.08 68.19 0.17 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.602 -179.855 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 65.6 m-85 -91.32 108.3 19.79 Favored 'General case' 0 N--CA 1.463 0.217 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 179.543 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.479 ' O ' ' N ' ' A' ' 66' ' ' LYS . 56.0 mtpt -96.03 18.25 13.82 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.432 -179.881 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 28.5 t70 61.98 -73.07 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.238 0 O-C-N 123.57 0.544 . . . . 0.0 110.717 179.959 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . 0.479 ' N ' ' O ' ' A' ' 64' ' ' LYS . 65.0 mttp -68.03 98.9 0.81 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.118 179.892 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -81.53 -8.77 59.76 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.485 -179.833 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 29.5 m 44.75 95.71 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.07 179.929 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 78.95 -116.8 4.41 Favored Glycine 0 CA--C 1.524 0.626 0 N-CA-C 110.661 -0.976 . . . . 0.0 110.661 -179.669 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 84.1 p -156.05 -136.3 0.05 Allowed 'General case' 0 N--CA 1.463 0.223 0 CA-C-O 120.697 0.284 . . . . 0.0 110.689 -179.772 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . 0.506 ' O ' ' N ' ' A' ' 73' ' ' SER . . . -52.0 -179.39 0.05 OUTLIER Glycine 0 CA--C 1.523 0.545 0 N-CA-C 110.41 -1.076 . . . . 0.0 110.41 179.529 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 14.8 t 61.56 -69.53 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-O 120.727 0.298 . . . . 0.0 110.827 -179.773 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . 0.506 ' N ' ' O ' ' A' ' 71' ' ' GLY . 67.9 m -48.45 -63.86 0.96 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.704 179.922 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 41.8 tp10 -92.01 -65.86 0.97 Allowed 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 116.464 -0.335 . . . . 0.0 110.433 -179.817 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 6.2 m-20 -176.86 118.19 0.27 Allowed Pre-proline 0 CA--C 1.547 0.858 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.33 178.876 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -75.59 -14.14 20.0 Favored 'Trans proline' 0 N--CA 1.496 1.628 0 C-N-CA 121.709 1.606 . . . . 0.0 112.027 -179.932 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 59.3 t80 -74.31 -51.04 16.4 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-O 120.853 0.359 . . . . 0.0 111.555 -179.611 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 71.8 mt -67.47 -30.45 48.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.691 -179.482 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 8.5 mp -75.93 -48.85 19.61 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 121.097 0.475 . . . . 0.0 110.016 179.337 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -62.14 -28.06 69.38 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.937 -0.574 . . . . 0.0 109.963 179.742 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -66.37 -37.57 85.58 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.663 179.82 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 36.6 ttpt -62.82 -26.64 68.84 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.799 -179.794 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 54.0 t -70.43 -44.96 76.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.398 179.609 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 44.0 ttm180 -64.16 -35.69 81.62 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.089 -179.529 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -63.12 -41.74 99.4 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.949 0.404 . . . . 0.0 111.176 -179.333 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 41.3 p -72.76 -23.72 60.86 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.427 179.719 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 25.2 m -60.71 -51.18 70.47 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 120.787 -0.365 . . . . 0.0 111.0 -179.473 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 21.9 t -78.54 -48.24 22.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-O 121.209 0.528 . . . . 0.0 111.92 179.791 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -54.62 -45.59 73.73 Favored 'General case' 0 C--O 1.223 -0.331 0 CA-C-N 115.397 -0.819 . . . . 0.0 111.62 -177.387 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.423 ' CG ' ' N ' ' A' ' 91' ' ' LYS . 14.3 pt-20 -59.75 -42.57 93.52 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.989 0.424 . . . . 0.0 110.594 -179.569 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . 0.423 ' N ' ' CG ' ' A' ' 90' ' ' GLU . 67.6 mttm -59.09 -38.3 79.17 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.35 -179.221 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.412 ' CE2' HD11 ' A' ' 96' ' ' ILE . 88.2 t80 -60.81 -38.49 85.59 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.654 179.532 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 52.9 t -59.02 -44.65 91.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.247 -178.492 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 71.7 mt -54.69 -37.34 39.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.247 -179.787 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.33 -37.67 81.36 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.577 -179.867 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.412 HD11 ' CE2' ' A' ' 92' ' ' PHE . 38.4 mm -61.94 -43.95 98.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 120.91 0.386 . . . . 0.0 110.031 -179.751 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 81.6 tt0 -65.04 -41.83 94.87 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 120.683 -0.407 . . . . 0.0 110.707 179.489 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 40.9 tp10 -59.77 -46.46 89.11 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.924 0.392 . . . . 0.0 110.563 -178.908 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 80.2 mm-40 -60.96 -37.45 82.46 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.225 -179.743 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -64.82 -38.07 89.74 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.606 179.867 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 18.7 m -64.08 -47.7 79.05 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.062 -179.455 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -75.15 -18.94 60.11 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.3 -179.462 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 39.1 tp -90.48 -7.68 52.4 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-O 121.179 0.514 . . . . 0.0 110.218 -179.766 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 85.6 tttt -71.91 72.37 0.83 Allowed 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 120.527 -0.469 . . . . 0.0 110.825 179.762 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 79.2 tt0 -170.2 -61.02 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.581 179.652 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 59.5 p -69.76 -34.55 73.95 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.385 179.884 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 67.11 168.78 3.62 Favored Glycine 0 CA--C 1.523 0.579 0 N-CA-C 110.747 -0.941 . . . . 0.0 110.747 -179.942 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 24.4 t -172.16 -150.01 0.06 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.683 0.278 . . . . 0.0 110.436 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 39.9 p -163.43 -77.34 0.04 OUTLIER 'General case' 0 C--N 1.333 -0.12 0 CA-C-O 120.857 0.361 . . . . 0.0 110.318 179.844 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -65.59 -30.19 76.87 Favored Glycine 0 CA--C 1.524 0.617 0 N-CA-C 110.881 -0.888 . . . . 0.0 110.881 179.819 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 78.4 tt0 -60.31 -38.13 82.72 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.69 0.281 . . . . 0.0 110.498 -179.601 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 54.7 m-85 -60.6 -44.91 95.74 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.537 -0.301 . . . . 0.0 110.557 -179.829 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 70.0 m -50.78 -30.58 14.51 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.698 -179.52 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -62.13 -32.18 72.74 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.75 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 50.6 mmm -67.76 -40.64 84.06 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-O 121.058 0.456 . . . . 0.0 110.906 -179.744 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 55.8 m-85 -62.74 -30.85 71.74 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.183 -179.938 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -55.91 -37.99 69.65 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.994 0.426 . . . . 0.0 110.618 -179.612 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.512 HD22 ' N ' ' A' ' 118' ' ' LEU . 4.1 mm? -61.42 -40.36 94.14 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.819 -0.628 . . . . 0.0 109.682 -179.178 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' MET . . . . . 0.408 ' C ' ' SD ' ' A' ' 119' ' ' MET . 0.0 OUTLIER -60.46 -53.21 60.28 Favored 'General case' 0 C--N 1.319 -0.727 0 C-N-CA 119.745 -0.782 . . . . 0.0 109.906 -179.632 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 20.1 m-85 -61.52 -46.36 90.3 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.667 -179.717 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 9.7 tm-20 -58.0 -44.87 87.48 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.185 -179.062 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 86.9 t -75.95 -21.47 15.67 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.33 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.078 179.804 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 32.2 t -71.43 -26.85 62.92 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 120.467 -0.493 . . . . 0.0 111.288 179.775 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . 0.428 ' N ' ' HD2' ' A' ' 125' ' ' PRO . 2.4 mptm? -58.8 -59.29 14.19 Favored Pre-proline 0 CA--C 1.542 0.64 0 C-N-CA 120.911 -0.316 . . . . 0.0 110.738 -179.827 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . 0.428 ' HD2' ' N ' ' A' ' 124' ' ' LYS . 37.3 Cg_endo -61.86 -50.04 5.85 Favored 'Trans proline' 0 N--CA 1.494 1.511 0 C-N-CA 122.039 1.826 . . . . 0.0 111.493 179.183 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.583 ' HB3' HD12 ' A' ' 131' ' ' ILE . 8.1 mp -56.71 -43.13 80.28 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.113 -179.16 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 11.9 tm0? -64.15 -49.98 70.01 Favored 'General case' 0 C--N 1.316 -0.849 0 C-N-CA 119.975 -0.69 . . . . 0.0 109.819 179.571 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -56.29 -19.38 14.02 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.188 -179.869 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 1.7 tt -93.72 -65.65 0.98 Allowed 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.742 179.886 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -151.8 -136.85 2.51 Favored Glycine 0 N--CA 1.462 0.374 0 N-CA-C 110.944 -0.862 . . . . 0.0 110.944 -178.955 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 131' ' ' ILE . . . . . 0.65 HG22 ' N ' ' A' ' 132' ' ' GLN . 81.2 mt 52.01 -114.58 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.333 -0.126 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 -178.977 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . 0.65 ' N ' HG22 ' A' ' 131' ' ' ILE . 57.6 tp60 97.15 55.4 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.803 0 O-C-N 124.138 0.899 . . . . 0.0 110.705 179.137 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 25.1 tt0 -170.42 -21.38 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 120.339 -0.544 . . . . 0.0 111.038 179.786 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 134' ' ' MET . . . . . 0.585 ' HG3' HG21 ' A' ' 131' ' ' ILE . 0.3 OUTLIER -52.26 -53.21 46.75 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.191 0.52 . . . . 0.0 110.618 -178.766 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 24.5 m -61.47 -28.54 69.36 Favored 'General case' 0 C--N 1.314 -0.945 0 C-N-CA 120.655 -0.418 . . . . 0.0 110.526 -179.494 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 30.3 ttpt -79.76 -57.05 3.85 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 116.14 -0.482 . . . . 0.0 112.141 -178.505 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 137' ' ' THR . . . . . 0.503 HG23 ' N ' ' A' ' 138' ' ' VAL . 14.1 t -59.71 -43.35 94.15 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.291 -178.298 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 138' ' ' VAL . . . . . 0.503 ' N ' HG23 ' A' ' 137' ' ' THR . 70.3 t -63.78 -44.77 98.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.425 -179.753 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 77.9 p -62.53 -38.25 89.24 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.845 0.355 . . . . 0.0 110.69 -179.593 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 93.8 m-20 -70.78 -30.58 67.1 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.584 179.857 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -65.11 -26.3 68.15 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.991 -179.873 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . 0.473 ' O ' ' O ' ' A' ' 143' ' ' GLU . . . -65.64 -29.01 69.52 Favored 'General case' 0 CA--C 1.51 -0.592 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.646 -179.3 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . 0.577 ' O ' ' N ' ' A' ' 145' ' ' ASN . 14.2 mm-40 -59.39 -123.49 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 -179.878 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 144' ' ' GLU . . . . . 0.406 ' C ' ' O ' ' A' ' 143' ' ' GLU . 72.0 mm-40 26.05 -81.09 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 123.574 0.749 . . . . 0.0 111.844 -179.981 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 145' ' ' ASN . . . . . 0.577 ' N ' ' O ' ' A' ' 143' ' ' GLU . 24.7 t30 -129.67 91.66 39.94 Favored Pre-proline 0 CA--C 1.55 0.964 0 CA-C-N 115.584 -0.735 . . . . 0.0 110.38 178.27 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 146' ' ' PRO . . . . . 0.487 ' O ' ' N ' ' A' ' 148' ' ' THR . 96.1 Cg_exo -43.67 106.73 0.08 OUTLIER 'Trans proline' 0 N--CA 1.501 1.939 0 C-N-CA 122.738 2.292 . . . . 0.0 112.052 -179.796 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 147' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_exo -48.48 81.78 0.02 OUTLIER 'Trans proline' 0 N--CA 1.5 1.87 0 C-N-CA 122.299 1.999 . . . . 0.0 112.661 179.848 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 148' ' ' THR . . . . . 0.487 ' N ' ' O ' ' A' ' 146' ' ' PRO . 1.2 m -97.12 14.42 25.84 Favored 'General case' 0 N--CA 1.47 0.556 0 O-C-N 122.14 -0.35 . . . . 0.0 110.112 179.994 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 149' ' ' THR . . . . . . . . . . . . . 28.4 p -140.82 167.91 21.05 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.518 -179.811 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -62.26 -44.15 97.21 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.503 -179.851 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 151' ' ' GLN . . . . . 0.448 HE21 ' C ' ' A' ' 151' ' ' GLN . 0.0 OUTLIER -66.28 -37.0 84.4 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.756 -179.763 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 152' ' ' GLY . . . . . 0.433 ' N ' HE21 ' A' ' 151' ' ' GLN . . . -55.53 -46.9 79.79 Favored Glycine 0 CA--C 1.523 0.59 0 N-CA-C 110.985 -0.846 . . . . 0.0 110.985 -179.26 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 153' ' ' VAL . . . . . . . . . . . . . 55.0 t -64.14 -24.69 36.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-O 120.828 0.347 . . . . 0.0 110.334 -179.62 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . 0.492 ' O ' HD23 ' A' ' 154' ' ' LEU . 1.1 tt -60.46 -40.44 91.21 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 109.558 -0.534 . . . . 0.0 109.558 -178.887 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -57.54 -46.07 84.31 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.062 179.535 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 156' ' ' ILE . . . . . 0.489 HG22 ' SD ' ' A' ' 160' ' ' MET . 16.0 mm -61.36 -43.63 97.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 -178.521 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -54.51 -50.02 68.83 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.38 179.202 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 158' ' ' LYS . . . . . 0.492 ' NZ ' ' OE2' ' A' ' 162' ' ' GLU . 65.1 tttm -62.72 -40.96 98.81 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.05 179.862 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 65.1 mmtt -65.92 -31.97 73.2 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.217 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 160' ' ' MET . . . . . 0.489 ' SD ' HG22 ' A' ' 156' ' ' ILE . 2.0 mtp -67.71 -47.89 68.1 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.228 0.537 . . . . 0.0 110.334 -179.5 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 62.4 ttp180 -66.44 -34.04 77.05 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.604 -179.716 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . 0.492 ' OE2' ' NZ ' ' A' ' 158' ' ' LYS . 48.5 mt-10 -69.95 -40.0 75.72 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.995 179.927 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 163' ' ' LYS . . . . . . . . . . . . . 17.0 tptp -67.35 -40.85 85.85 Favored 'General case' 0 C--N 1.325 -0.458 0 C-N-CA 120.553 -0.459 . . . . 0.0 111.135 -179.299 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 7.9 mt -69.15 -26.33 64.82 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.269 -179.628 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 50.7 tt0 -59.98 -45.3 93.17 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.728 -179.146 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 84.8 mtp180 -61.8 -29.46 70.17 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.35 0.595 . . . . 0.0 110.889 -179.723 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 167' ' ' VAL . . . . . . . . . . . . . 22.3 t -67.93 -46.85 81.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.491 -179.827 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 168' ' ' HIS . . . . . 0.463 ' O ' ' ND1' ' A' ' 168' ' ' HIS . 29.4 t-80 -79.23 -28.99 42.53 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.28 179.943 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 169' ' ' THR . . . . . . . . . . . . . 27.8 m -72.72 -48.52 38.04 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.781 0.324 . . . . 0.0 111.351 -179.562 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 56.0 mtpt -64.08 -43.39 95.57 Favored 'General case' 0 C--N 1.326 -0.436 0 C-N-CA 120.756 -0.377 . . . . 0.0 110.692 -179.52 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 171' ' ' ASN . . . . . . . . . . . . . 42.8 t-20 -65.79 -35.04 79.59 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.597 -179.866 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 172' ' ' TYR . . . . . . . . . . . . . 89.4 t80 -74.65 -45.06 47.2 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.734 -0.667 . . . . 0.0 110.639 179.699 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 16.8 t -66.82 -44.04 82.19 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.177 -179.381 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 12.6 p -60.92 -46.34 91.06 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.186 -179.648 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 33.8 tp -63.85 -31.98 73.34 Favored 'General case' 0 C--N 1.319 -0.741 0 C-N-CA 120.581 -0.448 . . . . 0.0 110.719 -179.227 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 2.7 tptm -65.04 -2.85 3.0 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.648 -178.729 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 177' ' ' LYS . . . . . . . . . . . . . 20.7 ptmt -61.66 -16.04 45.2 Favored 'General case' 0 C--N 1.318 -0.769 0 C-N-CA 120.651 -0.419 . . . . 0.0 111.183 -178.962 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 178' ' ' LYS . . . . . . . . . . . . . 74.5 mmtt -68.98 -47.1 66.42 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.893 -179.324 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 56.0 mp0 -72.79 -42.64 63.71 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.048 0.451 . . . . 0.0 110.197 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 180' ' ' ASN . . . . . . . . . . . . . 91.7 m-20 -65.67 -31.31 72.26 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.26 179.991 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 2.7 p 74.55 -49.07 0.66 Allowed 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.209 -179.682 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 182' ' ' THR . . . . . . . . . . . . . 81.9 p -75.49 176.19 7.79 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.018 179.496 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 183' ' ' PHE . . . . . 0.503 ' CD2' ' N ' ' A' ' 184' ' ' THR . 32.9 p90 -135.72 -50.99 0.73 Allowed 'General case' 0 N--CA 1.469 0.511 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.57 -179.843 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 184' ' ' THR . . . . . 0.503 ' N ' ' CD2' ' A' ' 183' ' ' PHE . 7.4 t -88.12 160.34 17.82 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-N 116.387 -0.369 . . . . 0.0 110.23 179.68 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 185' ' ' ASP . . . . . . . . . . . . . 11.6 t70 64.22 33.78 11.42 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.844 179.929 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 186' ' ' GLU . . . . . . . . . . . . . 2.2 pp20? -168.48 141.6 3.02 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.402 -179.91 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 22.3 pttp -171.69 149.52 2.58 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.261 179.699 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 188' ' ' CYS . . . . . 0.401 ' O ' ' C ' ' A' ' 189' ' ' LYS . 23.8 m -75.94 -138.66 0.02 OUTLIER 'General case' 0 C--O 1.233 0.203 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 179.43 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 189' ' ' LYS . . . . . 0.401 ' C ' ' O ' ' A' ' 188' ' ' CYS . 20.7 pttm 30.39 55.63 0.18 Allowed 'General case' 0 N--CA 1.475 0.81 0 O-C-N 123.566 0.541 . . . . 0.0 111.224 179.323 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 190' ' ' ASN . . . . . . . . . . . . . 59.1 t30 -153.88 81.59 1.15 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.405 -178.723 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 191' ' ' ASN . . . . . . . . . . . . . 23.6 p30 . . . . . 0 C--O 1.219 -0.503 0 CA-C-O 117.978 -1.01 . . . . 0.0 111.552 179.769 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 16.6 m . . . . . 0 N--CA 1.49 1.526 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -170.91 -28.13 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.636 -179.964 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 43.09 74.05 0.21 Allowed Glycine 0 CA--C 1.524 0.642 0 N-CA-C 111.063 -0.815 . . . . 0.0 111.063 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 5.7 tp -78.34 -50.85 11.03 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.952 0.406 . . . . 0.0 110.829 -179.791 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.515 ' O ' ' C ' ' A' ' 29' ' ' GLY . 72.2 p 44.15 70.97 0.28 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.709 -179.698 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . 0.61 ' O ' ' HB3' ' A' ' 30' ' ' ALA . . . -29.36 146.21 0.01 OUTLIER Glycine 0 CA--C 1.525 0.677 0 N-CA-C 110.988 -0.845 . . . . 0.0 110.988 179.827 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.61 ' HB3' ' O ' ' A' ' 29' ' ' GLY . . . 76.42 -69.36 0.16 Allowed 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.953 0.406 . . . . 0.0 110.554 -179.526 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.419 HG23 HH21 ' A' ' 34' ' ' ARG . 86.0 m -50.47 -39.73 48.95 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.473 -179.953 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 6.2 tmtt? -49.77 -29.35 7.61 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.673 -179.766 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 96.4 mt -52.86 -52.96 23.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.697 -179.19 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.419 HH21 HG23 ' A' ' 31' ' ' THR . 87.9 mtm180 -62.19 -41.31 98.23 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.458 -179.472 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.55 HD22 ' N ' ' A' ' 35' ' ' LEU . 4.2 mm? -64.17 -52.01 61.04 Favored 'General case' 0 N--CA 1.455 -0.22 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.037 -179.705 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 83.7 tt0 -65.27 -46.17 81.55 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.598 -179.401 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 44.7 ttm180 -64.59 -45.43 87.03 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.794 -179.148 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 30.2 t -72.14 -37.11 69.51 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.916 -178.725 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -71.51 -49.69 38.6 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.231 -178.383 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 64.3 mmtt -57.77 -30.64 65.79 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.683 -178.667 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 86.1 m-20 -68.36 -24.43 64.79 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.87 -178.268 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 63.0 mt -63.03 -56.74 15.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.281 -178.278 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 55.8 p -75.78 -38.36 58.34 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.143 -178.455 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 96.3 m-20 -61.5 -38.53 87.69 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.978 -176.99 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 14.3 tm-20 -72.22 -58.5 3.36 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.114 -0.493 . . . . 0.0 111.248 -178.057 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 7.4 pt -61.22 -28.53 44.0 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.188 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.782 -178.539 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -66.51 -38.58 87.52 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.814 179.288 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . 0.414 ' O ' ' OD2' ' A' ' 52' ' ' ASP . . . -55.92 -25.1 41.55 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.485 -179.904 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 66.9 mt -58.39 -43.02 85.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.678 -179.631 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -60.6 -34.21 73.89 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.57 -179.8 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -61.72 -51.75 67.11 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.964 -179.036 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . 0.414 ' OD2' ' O ' ' A' ' 48' ' ' ALA . 0.4 OUTLIER -70.21 -19.8 63.14 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.753 -179.189 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -72.92 -32.92 65.65 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.734 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -58.06 -25.79 61.7 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.63 -179.786 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 79.3 mt -55.67 -43.76 76.63 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.366 -179.346 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 72.7 mmtt -107.11 144.09 34.32 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.935 0.398 . . . . 0.0 110.346 178.986 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -73.86 73.17 1.26 Allowed Glycine 0 CA--C 1.521 0.447 0 N-CA-C 110.946 -0.862 . . . . 0.0 110.946 -179.573 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 39.1 t -116.16 126.84 73.82 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-O 120.852 0.358 . . . . 0.0 110.498 -179.889 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 23.6 m120 -65.16 103.16 0.73 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.482 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 40.3 t80 -59.92 -49.32 78.15 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.618 -179.362 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . 0.538 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 46.1 p-10 -57.74 -161.0 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.353 179.705 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.538 ' HB3' ' O ' ' A' ' 61' ' ' ASP . . . 70.93 -45.85 0.62 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.36 -179.588 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . 0.435 ' CG ' HG21 ' A' ' 78' ' ' ILE . 68.7 t80 -73.18 134.8 44.5 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.434 179.819 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 61.3 tttp -151.46 -70.71 0.17 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.648 -179.554 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 48.4 t0 -161.69 -67.72 0.06 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.62 -179.809 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -60.1 90.4 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.353 179.574 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 1.2 ttmp? -148.51 158.89 44.42 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.622 -179.495 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 22.4 m -57.3 -36.9 71.66 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.571 -179.994 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 74.64 -142.15 29.56 Favored Glycine 0 CA--C 1.525 0.682 0 N-CA-C 110.925 -0.87 . . . . 0.0 110.925 -179.971 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 50.6 m 55.35 165.3 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.826 0.346 . . . . 0.0 110.561 179.796 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -65.38 -30.45 77.65 Favored Glycine 0 CA--C 1.524 0.599 0 N-CA-C 110.954 -0.858 . . . . 0.0 110.954 179.969 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.486 HG22 ' N ' ' A' ' 73' ' ' SER . 7.6 p -73.08 157.96 6.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-O 120.729 0.3 . . . . 0.0 110.558 -179.968 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . 0.61 ' O ' ' O ' ' A' ' 74' ' ' GLU . 10.4 p 58.96 148.85 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.364 -179.349 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . 0.61 ' O ' ' O ' ' A' ' 73' ' ' SER . 22.1 mp0 39.81 105.41 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.342 -179.118 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . 0.496 ' C ' ' O ' ' A' ' 74' ' ' GLU . 33.6 m120 -31.01 140.5 0.15 Allowed Pre-proline 0 C--N 1.328 -0.341 0 CA-C-N 116.506 -0.315 . . . . 0.0 110.91 -179.68 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -71.08 4.4 2.79 Favored 'Trans proline' 0 C--N 1.301 -1.925 0 C-N-CA 122.794 2.329 . . . . 0.0 112.353 -178.968 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 52.5 t80 -63.74 -51.63 64.06 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.774 -179.261 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . 0.435 HG21 ' CG ' ' A' ' 63' ' ' PHE . 76.6 mt -70.08 -48.08 64.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.9 -179.158 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.546 ' N ' HD12 ' A' ' 79' ' ' LEU . 10.0 mp -52.23 -51.42 58.4 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.499 -179.073 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.416 ' O ' ' NH1' ' A' ' 84' ' ' ARG . 96.1 mt-10 -65.52 -31.83 73.11 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.438 -179.982 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -65.25 -38.14 89.4 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.634 -179.684 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -54.58 -24.93 23.23 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.425 -179.618 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 44.2 t -72.5 -43.85 62.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.978 -179.446 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . 0.416 ' NH1' ' O ' ' A' ' 80' ' ' GLU . 12.0 mpt_? -61.8 -29.21 70.0 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.6 -179.101 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -64.08 -44.93 90.86 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.917 -178.725 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 54.9 p -71.18 -20.18 62.31 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.769 -179.216 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 26.0 m -64.33 -53.89 41.6 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.218 -178.642 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 41.3 t -69.27 -46.5 77.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.094 -178.311 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -57.35 -37.44 72.59 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.744 -178.094 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 17.3 mm-40 -55.22 -42.24 73.1 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.701 -179.391 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 14.6 mptt -64.75 -23.37 67.23 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.639 -178.406 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 53.8 t80 -74.1 -59.57 2.66 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.316 -177.924 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 4.5 m -49.92 -38.3 13.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.674 -177.64 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 81.1 mt -58.91 -39.42 77.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.136 179.475 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -51.55 -40.77 60.33 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.569 -179.521 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.563 ' N ' HD12 ' A' ' 96' ' ' ILE . 1.7 mp -61.99 -41.64 91.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.597 -179.809 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 75.6 mt-10 -60.54 -49.43 77.59 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.962 -178.718 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 39.7 tp10 -68.3 -42.51 79.35 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.852 -178.878 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 91.1 mt-10 -69.48 -32.27 71.05 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.762 -178.911 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -57.38 -30.95 65.31 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.566 -179.588 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 21.1 m -63.65 -52.84 59.01 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.738 -179.253 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -66.76 -28.75 68.65 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.351 179.754 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 1.195 ' O ' ' O ' ' A' ' 104' ' ' LYS . 0.1 OUTLIER -71.69 -30.8 66.07 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.836 179.994 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 1.195 ' O ' ' O ' ' A' ' 103' ' ' LEU . 22.2 pttp -5.58 -148.85 0.0 OUTLIER 'General case' 0 C--O 1.235 0.296 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.854 -179.258 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 70.2 mm-40 -71.77 82.35 0.88 Allowed 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 120.904 0.383 . . . . 0.0 110.682 -179.614 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 1.4 t -164.27 8.97 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.407 178.239 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . 0.597 ' O ' ' OG ' ' A' ' 108' ' ' SER . . . -120.62 -56.02 0.24 Allowed Glycine 0 CA--C 1.522 0.511 0 N-CA-C 110.853 -0.899 . . . . 0.0 110.853 179.754 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . 0.597 ' OG ' ' O ' ' A' ' 107' ' ' GLY . 3.4 m 156.32 -103.9 0.0 OUTLIER 'General case' 0 N--CA 1.454 -0.263 0 CA-C-O 120.875 0.369 . . . . 0.0 110.442 -179.959 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 18.9 p -172.19 -56.4 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.386 -179.339 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -75.52 -28.67 61.05 Favored Glycine 0 CA--C 1.525 0.682 0 N-CA-C 111.008 -0.837 . . . . 0.0 111.008 178.896 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . 0.459 ' OE1' ' N ' ' A' ' 111' ' ' GLU . 13.1 mp0 -56.78 -27.53 59.84 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.76 0.314 . . . . 0.0 110.536 -179.354 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 30.6 m-85 -53.28 -26.03 16.9 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.456 179.618 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 66.5 m -50.9 -34.48 28.54 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.538 179.934 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -57.41 -31.52 65.93 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.394 179.175 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' MET . . . . . 0.434 ' SD ' HG23 ' A' ' 96' ' ' ILE . 45.7 ttm -77.99 -40.45 39.1 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.936 179.448 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 30.4 t80 -64.06 -31.69 72.97 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.431 179.606 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 94.2 m-20 -59.92 -35.75 75.56 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.606 -179.409 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 81.5 mt -56.62 -38.61 72.33 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.326 179.743 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' MET . . . . . 0.478 ' C ' ' SD ' ' A' ' 119' ' ' MET . 0.0 OUTLIER -56.4 -50.13 72.48 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.476 179.612 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 68.6 t80 -63.84 -44.3 93.58 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.959 0.409 . . . . 0.0 110.693 -179.735 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . 0.405 ' O ' ' CD ' ' A' ' 125' ' ' PRO . 78.0 tt0 -53.98 -40.11 66.63 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.566 -179.706 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 95.1 t -83.42 -18.97 10.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.746 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 51.4 p -71.31 -30.29 66.06 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.809 -178.874 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . 0.534 ' CB ' ' HD3' ' A' ' 125' ' ' PRO . 5.6 mmtp -69.58 -55.2 9.63 Favored Pre-proline 0 C--N 1.33 -0.241 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.279 -177.509 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . 0.534 ' HD3' ' CB ' ' A' ' 124' ' ' LYS . 68.3 Cg_exo -50.66 -44.45 40.44 Favored 'Trans proline' 0 C--N 1.306 -1.707 0 C-N-CA 122.61 2.207 . . . . 0.0 111.887 179.06 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 75.4 mt -64.01 -21.2 66.4 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.575 -179.479 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 6.4 tm0? -62.91 -49.47 74.67 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.863 -179.627 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 70.7 mmtt -62.11 -6.75 3.23 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.443 -179.718 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.503 HD23 ' O ' ' A' ' 129' ' ' LEU . 1.1 tt -108.2 -50.71 3.0 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.562 179.792 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . 0.593 ' O ' ' C ' ' A' ' 131' ' ' ILE . . . 170.83 -120.97 0.88 Allowed Glycine 0 CA--C 1.52 0.36 0 N-CA-C 110.935 -0.866 . . . . 0.0 110.935 -179.688 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 131' ' ' ILE . . . . . 0.593 ' C ' ' O ' ' A' ' 130' ' ' GLY . 81.1 mt 21.83 94.23 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 120.65 0.262 . . . . 0.0 110.712 179.976 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . 0.474 ' O ' ' HG2' ' A' ' 133' ' ' GLU . 47.0 tt0 -117.59 158.66 24.23 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.542 -179.642 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 133' ' ' GLU . . . . . 0.474 ' HG2' ' O ' ' A' ' 132' ' ' GLN . 0.6 OUTLIER 79.57 -12.17 1.1 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.539 179.173 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 26.4 ttm -58.5 -22.41 55.05 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.508 -179.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 34.9 m -67.79 -65.85 0.64 Allowed 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.689 179.559 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 136' ' ' LYS . . . . . 0.477 ' O ' ' N ' ' A' ' 140' ' ' ASP . 19.4 ttmm -51.4 -33.57 30.79 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.676 -0.491 . . . . 0.0 109.676 179.135 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 99.8 m -54.19 -66.05 0.46 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.654 -179.448 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 7.2 p -62.39 -33.38 58.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.624 -179.127 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 1.2 p -71.31 -31.93 68.02 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.613 -179.881 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 140' ' ' ASP . . . . . 0.477 ' N ' ' O ' ' A' ' 136' ' ' LYS . 49.9 t0 -68.89 -27.6 65.93 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.497 -179.816 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -69.36 -25.97 64.44 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.953 -178.84 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -64.6 -29.12 70.13 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.815 -178.513 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 80.9 mm-40 -67.19 -37.62 83.97 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.678 -179.455 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -65.56 -33.24 75.46 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.599 -179.728 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 145' ' ' ASN . . . . . . . . . . . . . 48.4 t30 -159.75 83.92 2.24 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.529 -179.358 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 146' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_exo -47.13 106.36 0.1 Allowed 'Trans proline' 0 C--N 1.305 -1.739 0 C-N-CA 122.875 2.384 . . . . 0.0 112.098 179.898 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 147' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_exo -48.72 110.57 0.36 Allowed 'Trans proline' 0 C--N 1.304 -1.815 0 C-N-CA 122.774 2.316 . . . . 0.0 112.252 -179.534 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 10.0 t -124.17 1.51 8.51 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.377 179.314 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 149' ' ' THR . . . . . 0.421 HG23 ' H ' ' A' ' 152' ' ' GLY . 5.1 t -162.12 -178.99 6.74 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.636 -179.843 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 150' ' ' ALA . . . . . 0.4 ' N ' ' OG1' ' A' ' 149' ' ' THR . . . -62.79 -34.27 76.93 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.583 -179.59 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 12.6 tt0 -66.21 -45.14 81.79 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.741 -179.707 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 152' ' ' GLY . . . . . 0.421 ' H ' HG23 ' A' ' 149' ' ' THR . . . -61.43 -44.75 97.63 Favored Glycine 0 CA--C 1.524 0.655 0 N-CA-C 110.869 -0.892 . . . . 0.0 110.869 -179.884 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 153' ' ' VAL . . . . . . . . . . . . . 99.4 t -65.77 -42.78 93.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-O 120.836 0.35 . . . . 0.0 110.468 -179.86 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 7.8 mt -51.46 -31.96 25.19 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.36 179.68 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 34.4 tp10 -64.68 -47.3 78.9 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.327 179.056 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 156' ' ' ILE . . . . . 0.57 ' N ' HD12 ' A' ' 156' ' ' ILE . 1.7 mp -64.12 -43.53 97.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.479 179.472 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -49.46 -46.89 48.51 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.358 -179.407 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 63.9 tttp -61.91 -41.91 98.46 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.092 178.89 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -65.42 -31.1 72.02 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.394 179.713 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 160' ' ' MET . . . . . . . . . . . . . 1.6 mtm -67.89 -51.49 47.39 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.869 179.689 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 76.1 ttt180 -67.77 -35.36 78.55 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.455 -179.939 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 81.1 tt0 -62.61 -48.7 78.24 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.89 -178.853 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 163' ' ' LYS . . . . . . . . . . . . . 41.1 tptt -65.42 -33.91 77.06 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.548 -179.43 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 14.2 mt -67.17 -30.45 70.42 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.915 -178.884 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 90.1 mt-30 -66.11 -35.17 79.8 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.741 -179.146 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 92.3 mtt-85 -64.73 -34.08 77.49 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.451 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 167' ' ' VAL . . . . . . . . . . . . . 11.1 t -68.39 -43.31 84.25 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.426 0 CA-C-O 120.893 0.378 . . . . 0.0 110.762 179.992 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 168' ' ' HIS . . . . . 0.402 ' ND1' ' O ' ' A' ' 168' ' ' HIS . 24.9 t-80 -80.01 -33.48 39.21 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.767 -179.546 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 169' ' ' THR . . . . . . . . . . . . . 91.5 m -70.15 -45.29 67.08 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.991 -178.542 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 58.9 mmtt -60.13 -44.27 95.03 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.612 -179.278 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 171' ' ' ASN . . . . . . . . . . . . . 48.6 t-20 -68.76 -33.05 73.25 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.992 0.425 . . . . 0.0 110.597 -179.703 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 172' ' ' TYR . . . . . 0.567 ' CE2' ' NZ ' ' A' ' 176' ' ' LYS . 53.7 t80 -62.93 -47.39 83.45 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.639 -179.442 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 68.7 m -73.75 -37.63 64.98 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.708 -179.332 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 89.5 m -62.03 -48.37 80.56 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.588 -179.315 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 12.3 tp -66.42 -34.32 77.67 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.548 -179.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 176' ' ' LYS . . . . . 0.567 ' NZ ' ' CE2' ' A' ' 172' ' ' TYR . 23.5 mmtp -78.01 -8.0 57.61 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.972 -179.266 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 177' ' ' LYS . . . . . . . . . . . . . 13.7 ptmt -62.5 -22.8 66.55 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.411 -179.696 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 178' ' ' LYS . . . . . . . . . . . . . 31.7 ttmt -70.85 -51.61 25.49 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.836 -179.328 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 94.8 mt-10 -70.71 -41.66 71.63 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.364 179.768 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 180' ' ' ASN . . . . . . . . . . . . . 97.9 m-20 -71.22 -42.18 69.24 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.748 179.554 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 181' ' ' SER . . . . . 0.456 ' O ' ' OG1' ' A' ' 182' ' ' THR . 67.2 p 44.91 -152.19 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.578 -179.9 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 182' ' ' THR . . . . . 0.456 ' OG1' ' O ' ' A' ' 181' ' ' SER . 73.2 p 52.11 176.52 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.664 179.425 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 183' ' ' PHE . . . . . . . . . . . . . 32.2 p90 -120.51 153.99 35.91 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.577 -179.712 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 43.9 p 43.31 34.04 0.67 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.739 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 185' ' ' ASP . . . . . . . . . . . . . 74.5 m-20 -142.8 21.4 1.97 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.623 -179.779 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 186' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -57.92 139.46 54.24 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.409 179.879 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -64.93 -47.1 78.92 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.618 -179.755 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 188' ' ' CYS . . . . . . . . . . . . . 20.6 p -77.48 39.94 0.28 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.53 -179.7 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 189' ' ' LYS . . . . . . . . . . . . . 37.3 ttmt -60.39 -41.09 93.1 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.369 179.951 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 190' ' ' ASN . . . . . . . . . . . . . 15.0 m120 -69.97 140.06 52.93 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.423 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 191' ' ' ASN . . . . . 0.449 ' N ' ' OD1' ' A' ' 191' ' ' ASN . 13.3 p-10 . . . . . 0 C--O 1.22 -0.491 0 CA-C-O 118.0 -1.0 . . . . 0.0 110.624 -179.859 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 51.2 p . . . . . 0 N--CA 1.491 1.59 0 N-CA-C 109.349 -0.611 . . . . 0.0 109.349 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -161.12 67.89 0.31 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.531 179.941 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . 0.468 ' O ' ' N ' ' A' ' 28' ' ' THR . . . -168.79 -99.5 0.13 Allowed Glycine 0 CA--C 1.517 0.168 0 N-CA-C 110.862 -0.895 . . . . 0.0 110.862 179.983 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.631 ' O ' ' O ' ' A' ' 28' ' ' THR . 9.3 mt 35.41 31.77 0.01 OUTLIER 'General case' 0 C--O 1.22 -0.493 0 CA-C-N 116.358 0.079 . . . . 0.0 111.175 -179.526 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.631 ' O ' ' O ' ' A' ' 27' ' ' LEU . 21.7 p -45.95 -119.93 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.415 0 O-C-N 123.995 0.809 . . . . 0.0 110.781 -179.094 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . 0.508 ' N ' ' OG1' ' A' ' 28' ' ' THR . . . -65.85 166.73 35.53 Favored Glycine 0 CA--C 1.523 0.56 0 N-CA-C 111.046 -0.822 . . . . 0.0 111.046 179.774 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -57.49 -4.69 0.27 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.802 0.334 . . . . 0.0 110.492 179.626 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.477 ' H ' ' C ' ' A' ' 29' ' ' GLY . 98.0 m -61.53 -23.53 66.0 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.465 179.725 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 17.2 tptp -68.45 -47.21 67.75 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.245 0.545 . . . . 0.0 110.817 179.606 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.585 ' N ' HD12 ' A' ' 33' ' ' ILE . 1.7 mp -57.17 -45.49 84.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 N-CA-C 109.152 -0.684 . . . . 0.0 109.152 -179.33 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 44.8 ttm180 -69.79 -27.79 65.2 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.047 0.451 . . . . 0.0 109.968 -179.703 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 44.5 tp -68.44 -47.9 65.97 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.066 -179.605 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 22.1 pt-20 -76.83 -39.8 50.04 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.612 -179.731 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 79.5 ttt180 -62.94 -42.71 99.89 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.028 -0.533 . . . . 0.0 109.997 -179.15 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 78.0 p -63.84 -26.45 68.62 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.097 0.475 . . . . 0.0 110.256 -179.755 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -83.16 -32.22 26.73 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.067 0.461 . . . . 0.0 111.105 179.366 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -63.81 -35.18 79.77 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.015 -0.538 . . . . 0.0 111.0 -179.003 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . 0.496 ' OD1' ' N ' ' A' ' 42' ' ' ILE . 15.2 p30 -61.92 -23.62 66.46 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.669 -179.261 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.496 ' N ' ' OD1' ' A' ' 41' ' ' ASP . 75.3 mt -59.84 -49.74 82.73 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.633 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.676 -179.097 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 40.3 p -72.6 -36.73 68.17 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.047 0.451 . . . . 0.0 111.305 -178.76 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 66.4 t0 -63.0 -39.94 96.26 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.96 -178.232 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 68.2 mm-40 -71.16 -55.92 7.16 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 112.233 0.456 . . . . 0.0 112.233 -179.285 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 7.0 pt -62.0 -26.33 39.73 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.107 -178.788 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -65.47 -39.09 91.57 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.91 -0.587 . . . . 0.0 110.687 -179.836 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.16 -24.33 67.12 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-O 121.059 0.457 . . . . 0.0 110.687 -178.89 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 65.2 mt -65.94 -52.82 44.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.007 -0.542 . . . . 0.0 112.365 -178.249 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 38.5 pttt -59.33 -30.19 68.18 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.857 -178.554 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 49.6 mtpt -63.89 -43.98 94.38 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.33 -179.678 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -65.42 -43.47 90.44 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.559 -179.895 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -58.34 -30.45 66.74 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.754 -179.578 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -66.47 -35.61 80.69 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.006 -179.858 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 53.7 mt -61.99 -46.66 88.26 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.31 -178.945 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.503 ' O ' ' N ' ' A' ' 58' ' ' VAL . 55.4 pttt -177.13 -17.93 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.377 0 O-C-N 123.483 0.489 . . . . 0.0 110.811 179.999 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . 0.407 ' O ' ' O ' ' A' ' 58' ' ' VAL . . . -64.26 65.31 0.06 OUTLIER Glycine 0 CA--C 1.526 0.724 0 N-CA-C 110.921 -0.872 . . . . 0.0 110.921 -179.378 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.503 ' N ' ' O ' ' A' ' 56' ' ' LYS . 15.0 t 57.4 155.72 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 120.925 0.393 . . . . 0.0 110.844 179.812 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 83.5 m-20 -71.17 143.89 50.37 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.042 0.448 . . . . 0.0 110.316 179.565 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . 0.408 ' CD2' ' N ' ' A' ' 61' ' ' ASP . 20.5 t80 -85.35 -179.45 6.96 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.419 -179.425 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . 0.408 ' N ' ' CD2' ' A' ' 60' ' ' PHE . 66.4 t0 61.36 -118.0 0.7 Allowed 'General case' 0 C--N 1.33 -0.254 0 O-C-N 123.708 0.63 . . . . 0.0 110.246 179.805 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . 61.2 -121.51 0.82 Allowed 'General case' 0 N--CA 1.452 -0.355 0 CA-C-O 120.77 0.319 . . . . 0.0 110.922 179.866 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 1.7 m-85 58.15 91.18 0.04 OUTLIER 'General case' 0 CA--C 1.516 -0.358 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.159 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.442 ' CG ' ' H ' ' A' ' 65' ' ' ASP . 10.8 tptm -113.03 -149.01 0.44 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.933 0.397 . . . . 0.0 110.787 179.365 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.442 ' H ' ' CG ' ' A' ' 64' ' ' LYS . 75.3 m-20 -74.55 -39.36 62.34 Favored 'General case' 0 N--CA 1.456 -0.142 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.454 179.977 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . 0.465 ' HD2' ' H ' ' A' ' 66' ' ' LYS . 6.3 mptt -62.87 -45.65 91.55 Favored 'General case' 0 CA--C 1.514 -0.437 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.928 -179.432 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -77.0 116.68 17.88 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.401 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 1.5 t -174.61 2.35 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.547 179.859 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -69.45 -20.12 75.12 Favored Glycine 0 CA--C 1.524 0.646 0 N-CA-C 110.919 -0.873 . . . . 0.0 110.919 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 5.6 t 62.23 141.0 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.656 0.265 . . . . 0.0 110.534 -179.759 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . 0.602 ' H ' ' ND2' ' A' ' 171' ' ' ASN . . . 73.2 -77.23 0.86 Allowed Glycine 0 N--CA 1.46 0.245 0 N-CA-C 110.351 -1.1 . . . . 0.0 110.351 179.809 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 1.9 m -122.62 105.02 15.42 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.473 0 CA-C-O 121.278 0.561 . . . . 0.0 110.144 179.723 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 2.5 t -155.06 95.78 1.77 Allowed 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.465 178.972 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 69.96 -67.78 0.22 Allowed 'General case' 0 CA--C 1.513 -0.47 0 O-C-N 123.426 0.454 . . . . 0.0 110.896 179.085 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 17.1 m120 -115.58 94.01 38.78 Favored Pre-proline 0 CA--C 1.532 0.284 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.265 -179.57 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -73.52 -8.23 21.38 Favored 'Trans proline' 0 N--CA 1.489 1.236 0 C-N-CA 122.79 2.327 . . . . 0.0 112.003 -179.343 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 53.4 t80 -76.96 -50.94 12.06 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.04 0.448 . . . . 0.0 110.275 -179.92 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 16.8 tt -75.48 -27.58 19.26 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.144 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.307 -179.883 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 3.1 mp -74.0 -37.96 64.25 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.6 179.776 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 10.5 mm-40 -63.14 -25.19 68.24 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.377 -179.858 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -65.98 -45.21 82.47 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.747 -179.35 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 6.5 ttpm? -55.97 -25.75 45.22 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.627 -179.735 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 26.9 t -74.49 -46.17 43.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.724 179.685 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 91.2 mtm180 -67.25 -28.03 67.71 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.167 0.508 . . . . 0.0 110.377 -179.705 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -58.41 -41.37 84.78 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.012 -179.204 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 68.7 p -76.86 -24.1 52.65 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.716 -179.906 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 86.2 m -60.23 -51.92 67.51 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.805 -178.947 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 56.1 t -67.92 -43.34 85.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.693 -179.396 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -64.13 -31.8 73.13 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.854 -179.065 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -55.43 -41.81 73.31 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.004 -179.579 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -58.09 -34.04 69.75 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.595 -179.325 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.602 ' O ' ' HB3' ' A' ' 95' ' ' ALA . 46.0 t80 -71.29 -45.48 63.0 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.902 -179.91 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 57.3 t -53.18 -56.87 6.14 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.793 -177.627 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.402 HG21 HD13 ' A' ' 94' ' ' ILE . 23.3 pt -54.14 -30.71 20.68 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.661 -179.959 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.602 ' HB3' ' O ' ' A' ' 92' ' ' PHE . . . -52.56 -41.89 63.97 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.351 -179.641 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.54 ' N ' HD12 ' A' ' 96' ' ' ILE . 1.6 mp -63.87 -41.81 93.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 116.073 -0.512 . . . . 0.0 109.945 179.255 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 79.4 tt0 -61.18 -49.89 75.38 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.073 -178.452 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 80.9 mm-40 -68.04 -41.41 82.13 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.42 -179.988 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 48.5 tp10 -62.1 -43.07 99.64 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.284 -179.88 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -62.36 -35.66 79.84 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.877 0.37 . . . . 0.0 110.572 -179.545 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 99.3 m -59.3 -43.4 92.62 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.164 -179.698 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 60.1 mttp -55.69 -36.43 67.13 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.237 -0.438 . . . . 0.0 109.849 -179.459 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.536 HD22 ' N ' ' A' ' 103' ' ' LEU . 4.2 mm? -81.29 -92.39 0.06 Allowed 'General case' 0 CA--C 1.511 -0.556 0 N-CA-C 109.916 -0.402 . . . . 0.0 109.916 179.112 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.419 ' CB ' ' O ' ' A' ' 103' ' ' LEU . 26.6 ttmt 78.92 -38.58 0.21 Allowed 'General case' 0 C--N 1.334 -0.075 0 O-C-N 123.759 0.662 . . . . 0.0 110.784 179.906 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . 0.434 ' O ' ' C ' ' A' ' 106' ' ' THR . 97.5 mt-10 -64.0 150.96 44.12 Favored 'General case' 0 CA--C 1.514 -0.415 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 -179.982 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . 0.44 ' H ' HG23 ' A' ' 106' ' ' THR . 26.1 p -32.81 -42.26 0.08 Allowed 'General case' 0 N--CA 1.471 0.605 0 O-C-N 123.346 0.404 . . . . 0.0 110.763 -179.789 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 70.06 -179.28 28.23 Favored Glycine 0 CA--C 1.521 0.421 0 N-CA-C 110.733 -0.947 . . . . 0.0 110.733 179.101 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 52.3 m -80.32 -1.82 42.66 Favored 'General case' 0 C--N 1.331 -0.229 0 O-C-N 122.832 -0.217 . . . . 0.0 110.479 179.966 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER 70.88 -49.5 0.67 Allowed 'General case' 0 N--CA 1.462 0.166 0 CA-C-O 120.924 0.392 . . . . 0.0 110.449 -179.714 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -66.97 -28.03 73.64 Favored Glycine 0 CA--C 1.523 0.559 0 N-CA-C 110.686 -0.966 . . . . 0.0 110.686 -179.9 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 82.0 tt0 -61.23 -43.29 99.12 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.794 0.33 . . . . 0.0 110.544 -179.312 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 70.2 m-85 -65.43 -40.15 92.98 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.608 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 59.8 p -57.12 -31.91 65.8 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.33 -179.509 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -63.9 -29.58 70.75 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.445 179.592 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 37.3 mtp -74.95 -51.93 12.48 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.485 -179.221 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 41.6 t80 -50.15 -35.88 27.85 Favored 'General case' 0 N--CA 1.463 0.194 0 N-CA-C 110.042 -0.355 . . . . 0.0 110.042 -179.427 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 97.2 m-20 -61.8 -41.89 98.32 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.184 -0.462 . . . . 0.0 109.841 179.352 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.512 HD23 ' O ' ' A' ' 118' ' ' LEU . 1.4 tt -59.66 -40.56 88.16 Favored 'General case' 0 C--O 1.222 -0.343 0 CA-C-O 121.369 0.604 . . . . 0.0 109.685 -179.761 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' MET . . . . . 0.444 ' C ' ' SD ' ' A' ' 119' ' ' MET . 0.1 OUTLIER -53.15 -45.96 68.63 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.187 0.518 . . . . 0.0 109.858 -179.456 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 50.5 t80 -63.43 -41.21 98.69 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.176 0.512 . . . . 0.0 110.652 -179.013 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 14.5 mm-40 -55.48 -48.48 74.48 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.289 -178.903 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 31.1 m -71.27 -16.93 19.58 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.524 0 O-C-N 123.429 0.456 . . . . 0.0 110.819 -179.491 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 9.4 m -72.34 -24.98 61.37 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-O 121.191 0.519 . . . . 0.0 110.748 179.593 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . 0.541 ' N ' ' HD2' ' A' ' 125' ' ' PRO . 2.5 mptp? -65.05 -57.8 14.56 Favored Pre-proline 0 C--N 1.323 -0.578 0 CA-C-N 116.194 -0.457 . . . . 0.0 112.113 -179.376 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . 0.541 ' HD2' ' N ' ' A' ' 124' ' ' LYS . 30.2 Cg_endo -60.32 -30.63 91.48 Favored 'Trans proline' 0 C--N 1.307 -1.644 0 C-N-CA 122.441 2.094 . . . . 0.0 112.453 -179.01 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 92.6 mt -70.69 -24.82 62.74 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.71 179.854 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 55.2 tt0 -65.21 -39.43 92.77 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.148 -179.99 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 17.0 tptm -50.27 -44.37 53.7 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 120.576 -0.449 . . . . 0.0 110.546 -178.249 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 18.5 mt -57.52 -110.37 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.824 178.727 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . 0.42 ' C ' ' NE2' ' A' ' 132' ' ' GLN . . . -147.85 17.25 1.41 Allowed Glycine 0 C--N 1.332 0.356 0 N-CA-C 110.876 -0.889 . . . . 0.0 110.876 -179.489 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 76.3 mt -111.71 115.22 49.26 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.393 0 CA-C-O 120.904 0.383 . . . . 0.0 110.247 179.816 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . 0.478 ' O ' ' HB2' ' A' ' 133' ' ' GLU . 8.1 mp0 -139.93 -178.71 5.56 Favored 'General case' 0 CA--C 1.508 -0.645 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.077 -179.701 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 133' ' ' GLU . . . . . 0.478 ' HB2' ' O ' ' A' ' 132' ' ' GLN . 75.0 mt-10 75.48 -21.91 0.29 Allowed 'General case' 0 CA--C 1.52 -0.195 0 O-C-N 123.895 0.747 . . . . 0.0 110.622 179.497 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 134' ' ' MET . . . . . 0.462 ' H ' ' C ' ' A' ' 132' ' ' GLN . 48.5 mtp -51.27 -23.25 3.34 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.165 179.662 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 34.7 p -63.0 -63.82 1.09 Allowed 'General case' 0 C--O 1.221 -0.411 0 CA-C-O 121.486 0.66 . . . . 0.0 109.251 179.625 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 136' ' ' LYS . . . . . 0.432 ' HG2' ' H ' ' A' ' 136' ' ' LYS . 59.0 mmtt -51.38 -38.3 52.63 Favored 'General case' 0 C--N 1.318 -0.791 0 O-C-N 121.661 -0.649 . . . . 0.0 109.827 179.549 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 46.1 m -54.84 -66.01 0.48 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.548 -179.547 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 14.8 p -63.33 -34.65 68.4 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.146 -178.902 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 5.8 p -73.22 -33.55 65.41 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.758 -178.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 140' ' ' ASP . . . . . 0.403 ' N ' ' O ' ' A' ' 136' ' ' LYS . 8.9 t70 -65.1 -30.73 71.7 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.427 -179.614 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -62.91 -27.22 69.22 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.778 -179.176 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -59.85 -28.91 67.91 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.67 -179.169 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 70.0 mm-40 -81.53 66.16 6.97 Favored 'General case' 0 CA--C 1.517 -0.291 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.543 -179.777 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER 175.78 -37.93 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.783 -179.981 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 145' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -143.62 73.83 17.04 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.138 -179.318 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 146' ' ' PRO . . . . . 0.629 ' C ' ' H ' ' A' ' 148' ' ' THR . 86.8 Cg_exo -38.7 106.47 0.05 OUTLIER 'Trans proline' 0 C--N 1.32 -0.956 0 C-N-CA 122.945 2.43 . . . . 0.0 111.8 179.89 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 147' ' ' PRO . . . . . 0.538 ' C ' ' H ' ' A' ' 149' ' ' THR . 49.6 Cg_exo -55.17 10.27 0.03 OUTLIER 'Trans proline' 0 C--N 1.309 -1.551 0 C-N-CA 122.665 2.243 . . . . 0.0 112.4 179.224 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 148' ' ' THR . . . . . 0.629 ' H ' ' C ' ' A' ' 146' ' ' PRO . 61.8 m -55.38 -2.65 0.05 OUTLIER 'General case' 0 N--CA 1.445 -0.713 0 CA-C-O 120.744 0.307 . . . . 0.0 110.714 179.303 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 149' ' ' THR . . . . . 0.538 ' H ' ' C ' ' A' ' 147' ' ' PRO . 62.5 p -124.28 162.55 23.51 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-O 121.012 0.434 . . . . 0.0 110.223 179.458 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -68.05 -47.53 68.11 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.716 -179.814 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 87.1 mt-30 -66.14 -30.27 70.73 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.621 -179.812 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . -59.98 -34.29 82.67 Favored Glycine 0 CA--C 1.523 0.553 0 N-CA-C 111.085 -0.806 . . . . 0.0 111.085 -179.287 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 153' ' ' VAL . . . . . . . . . . . . . 62.4 t -65.61 -41.68 91.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 120.783 0.325 . . . . 0.0 110.688 -179.798 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 78.9 mt -45.31 -37.58 4.94 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.598 -179.108 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -62.3 -58.82 6.31 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.136 178.989 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 24.0 mm -53.68 -42.63 51.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.735 -179.439 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -56.71 -47.58 79.63 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 123.562 0.539 . . . . 0.0 110.548 178.948 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 34.8 tptt -61.66 -36.61 81.32 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.376 -179.797 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -72.32 -30.19 64.53 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.476 -179.658 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 160' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -66.11 -50.95 62.25 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.266 179.742 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 61.6 ttp180 -65.0 -31.24 72.38 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.099 179.522 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 40.9 tp10 -64.34 -61.31 2.31 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.124 -178.77 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 163' ' ' LYS . . . . . . . . . . . . . 23.9 tptp -60.36 -34.36 73.75 Favored 'General case' 0 N--CA 1.447 -0.605 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.533 -179.981 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 38.3 tp -66.21 -37.84 86.52 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.249 -179.881 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 65.9 mm-40 -70.14 -28.37 65.31 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.909 -179.64 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 166' ' ' ARG . . . . . 0.644 HH21 ' HZ1' ' A' ' 170' ' ' LYS . 76.0 ttt180 -63.76 -34.13 77.21 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.399 -179.91 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 167' ' ' VAL . . . . . . . . . . . . . 70.1 t -67.04 -43.69 88.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.321 -179.667 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 12.6 t60 -78.59 -31.57 47.24 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.816 -179.277 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 169' ' ' THR . . . . . . . . . . . . . 92.6 m -68.5 -47.03 68.07 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.849 -179.49 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 170' ' ' LYS . . . . . 0.644 ' HZ1' HH21 ' A' ' 166' ' ' ARG . 28.1 mmtp -60.74 -45.39 94.48 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.694 -179.539 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 171' ' ' ASN . . . . . 0.602 ' ND2' ' H ' ' A' ' 71' ' ' GLY . 6.8 m120 -66.61 -36.82 83.53 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.51 179.58 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 172' ' ' TYR . . . . . . . . . . . . . 84.4 t80 -66.53 -41.6 88.51 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.67 -179.434 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 41.0 t -67.75 -39.64 84.2 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.685 -179.444 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 174' ' ' THR . . . . . 0.405 HG23 ' O ' ' A' ' 170' ' ' LYS . 31.4 p -66.01 -34.94 79.23 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.794 -179.62 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 6.3 mt -64.17 -38.45 91.11 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.032 179.497 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 66.3 mmtt -62.4 -5.76 2.74 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.527 179.979 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 177' ' ' LYS . . . . . . . . . . . . . 62.9 tttp -63.76 -42.16 97.86 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.823 179.548 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 178' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -66.2 -42.36 88.91 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.649 -179.827 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 67.9 mm-40 -56.83 -47.85 79.35 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.0 -178.973 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 180' ' ' ASN . . . . . 0.552 ' O ' ' N ' ' A' ' 182' ' ' THR . 14.8 m120 -47.64 -62.85 1.25 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.175 179.367 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 44.8 t 49.99 -82.74 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.105 179.037 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 182' ' ' THR . . . . . 0.552 ' N ' ' O ' ' A' ' 180' ' ' ASN . 80.5 p -48.01 -58.76 4.02 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.151 -179.817 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 183' ' ' PHE . . . . . . . . . . . . . 87.9 t80 -174.2 -81.62 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.967 0.413 . . . . 0.0 110.491 179.794 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 184' ' ' THR . . . . . 0.41 HG22 ' H ' ' A' ' 185' ' ' ASP . 0.2 OUTLIER 53.16 -173.69 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.767 -179.595 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 185' ' ' ASP . . . . . 0.41 ' H ' HG22 ' A' ' 184' ' ' THR . 67.5 t0 -84.73 111.92 20.02 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.645 179.659 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 186' ' ' GLU . . . . . . . . . . . . . 94.2 mt-10 -65.69 -45.59 82.24 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.533 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -70.42 132.09 45.08 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.373 -179.8 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 188' ' ' CYS . . . . . . . . . . . . . 5.0 m -79.58 -25.08 41.64 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.351 -179.939 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 189' ' ' LYS . . . . . 0.467 ' O ' ' N ' ' A' ' 191' ' ' ASN . 99.0 mttt 55.92 65.52 1.43 Allowed 'General case' 0 C--N 1.327 -0.38 0 O-C-N 123.457 0.473 . . . . 0.0 110.494 -179.719 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 190' ' ' ASN . . . . . . . . . . . . . 24.2 t-20 -44.77 92.54 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.749 -179.956 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 191' ' ' ASN . . . . . 0.467 ' N ' ' O ' ' A' ' 189' ' ' LYS . 89.3 m-20 . . . . . 0 C--O 1.219 -0.54 0 CA-C-O 118.053 -0.975 . . . . 0.0 110.695 -179.471 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 33.1 t . . . . . 0 N--CA 1.49 1.531 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -171.32 -58.38 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.446 -179.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -48.12 -79.63 0.07 OUTLIER Glycine 0 CA--C 1.527 0.812 0 N-CA-C 111.241 -0.744 . . . . 0.0 111.241 -179.955 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.528 ' N ' HD12 ' A' ' 27' ' ' LEU . 8.2 mp 47.86 -162.25 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.272 0 CA-C-O 120.72 0.295 . . . . 0.0 110.259 179.444 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.548 HG23 ' N ' ' A' ' 29' ' ' GLY . 6.8 t -169.53 -129.47 0.01 OUTLIER 'General case' 0 N--CA 1.445 -0.679 0 CA-C-N 116.287 -0.415 . . . . 0.0 109.976 -179.775 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . 0.548 ' N ' HG23 ' A' ' 28' ' ' THR . . . -108.92 -39.5 1.7 Allowed Glycine 0 N--CA 1.467 0.715 0 N-CA-C 111.08 -0.808 . . . . 0.0 111.08 179.71 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -169.23 -13.24 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.892 0.377 . . . . 0.0 110.648 -179.732 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.535 ' HB ' HG21 ' A' ' 28' ' ' THR . 24.8 m -64.14 -31.18 72.27 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.1 179.568 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.517 ' H ' ' CG2' ' A' ' 28' ' ' THR . 55.7 tptt -63.36 -50.19 70.91 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 120.315 -0.554 . . . . 0.0 110.646 -179.478 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 71.4 mt -63.16 -27.95 44.12 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.003 -178.921 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 41.4 ttm180 -71.41 -39.46 71.11 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.889 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 64.9 mt -68.93 -37.71 79.07 Favored 'General case' 0 CA--C 1.514 -0.415 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.73 -179.583 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 47.0 tp10 -73.21 -43.37 61.41 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.496 -179.741 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 43.7 ttm180 -63.4 -43.75 96.64 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.588 -179.324 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 37.9 m -69.0 -29.68 67.92 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.273 -179.961 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -75.05 -36.27 61.84 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.902 179.855 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -65.42 -31.42 72.51 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.832 -179.556 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 10.9 m-20 -66.93 -24.67 66.11 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.967 -179.635 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 98.3 mt -64.37 -48.42 85.37 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.311 0 C-N-CA 120.678 -0.409 . . . . 0.0 111.088 -179.19 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 77.2 p -73.23 -38.66 65.97 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.102 -178.712 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 65.6 t0 -64.0 -37.89 89.09 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.663 -179.364 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 9.9 tm-20 -67.36 -49.53 63.59 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.922 0.391 . . . . 0.0 111.434 -179.352 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 8.4 pt -72.18 -26.71 25.3 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.732 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.46 -179.614 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -62.33 -42.31 99.28 Favored 'General case' 0 C--N 1.322 -0.609 0 C-N-CA 120.729 -0.389 . . . . 0.0 110.525 179.337 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -53.22 -27.68 23.15 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.215 -178.918 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 66.2 mt -63.11 -45.76 97.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.077 179.62 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 23.3 mmtp -54.57 -41.31 69.7 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.153 -179.17 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 28.3 mmtp -65.51 -43.73 89.18 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.588 179.624 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 47.3 t0 -62.06 -43.86 97.92 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.386 -179.731 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.424 ' O ' ' O ' ' A' ' 56' ' ' LYS . . . -58.99 -30.73 68.19 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.909 -179.809 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -56.09 -37.45 69.38 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.054 -179.392 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.513 ' N ' HD12 ' A' ' 55' ' ' LEU . 10.0 mp -58.75 -42.93 90.01 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.131 -178.487 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.424 ' O ' ' O ' ' A' ' 53' ' ' ALA . 51.5 mtpt -99.84 139.91 34.81 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.906 0.384 . . . . 0.0 110.42 -179.902 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -77.98 68.93 2.76 Favored Glycine 0 CA--C 1.52 0.378 0 N-CA-C 110.695 -0.962 . . . . 0.0 110.695 -179.857 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 40.7 t -104.3 132.77 50.1 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.476 0 CA-C-O 120.805 0.336 . . . . 0.0 110.192 -179.935 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 91.5 m-20 -69.29 78.19 0.37 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.293 -179.645 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 36.9 t80 -63.18 -41.99 99.29 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.026 -0.533 . . . . 0.0 110.589 -179.666 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 40.0 p-10 -60.11 -6.43 1.4 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.295 -179.364 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.495 ' O ' ' CG ' ' A' ' 63' ' ' PHE . . . -64.23 128.4 35.64 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.233 179.882 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . 0.495 ' CG ' ' O ' ' A' ' 62' ' ' ALA . 44.8 m-85 -163.91 102.8 0.89 Allowed 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.515 -179.956 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.413 ' O ' ' N ' ' A' ' 66' ' ' LYS . 68.9 mttm -84.06 138.63 32.97 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 109.727 -0.471 . . . . 0.0 109.727 179.14 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 55.8 t0 -45.67 -19.54 0.06 Allowed 'General case' 0 N--CA 1.465 0.316 0 CA-C-O 121.086 0.47 . . . . 0.0 110.867 -179.859 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . 0.413 ' N ' ' O ' ' A' ' 64' ' ' LYS . 58.7 pttt -140.61 140.7 35.13 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.196 -179.921 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 70.7 mmtt -114.91 105.96 13.6 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.372 -179.773 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 27.4 p -140.54 147.13 39.02 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.09 179.545 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 148.38 -109.38 0.45 Allowed Glycine 0 N--CA 1.464 0.52 0 N-CA-C 110.666 -0.974 . . . . 0.0 110.666 179.946 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 40.0 p -164.82 -149.67 0.13 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.674 0.273 . . . . 0.0 110.608 -179.877 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -56.7 -42.77 91.45 Favored Glycine 0 C--N 1.332 0.33 0 N-CA-C 110.494 -1.042 . . . . 0.0 110.494 -179.819 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.915 HG13 ' H ' ' A' ' 73' ' ' SER . 2.7 p -79.03 -101.18 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.223 -0.33 0 N-CA-C 110.093 -0.336 . . . . 0.0 110.093 179.627 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . 0.915 ' H ' HG13 ' A' ' 72' ' ' VAL . 9.7 p 63.48 -65.97 0.11 Allowed 'General case' 0 N--CA 1.448 -0.556 0 O-C-N 123.893 0.745 . . . . 0.0 109.717 -179.172 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . 0.511 ' N ' ' OG ' ' A' ' 73' ' ' SER . 80.9 mm-40 -126.84 15.36 7.46 Favored 'General case' 0 CA--C 1.499 -1.013 0 CA-C-N 116.053 -0.522 . . . . 0.0 111.004 179.863 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . 0.452 ' N ' ' OD1' ' A' ' 75' ' ' ASN . 1.4 m-20 89.52 137.54 0.04 OUTLIER Pre-proline 0 CA--C 1.535 0.388 0 O-C-N 124.39 1.056 . . . . 0.0 110.664 179.583 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -70.19 6.07 1.6 Allowed 'Trans proline' 0 N--CA 1.494 1.53 0 C-N-CA 122.156 1.904 . . . . 0.0 112.156 -179.26 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 68.0 t80 -77.52 -58.99 2.97 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.948 0.404 . . . . 0.0 111.515 -179.946 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 19.6 tt -75.64 -27.98 19.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.768 -179.643 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 82.9 mt -73.54 -49.95 23.84 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.463 -178.855 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 99.2 mt-10 -64.45 -22.79 67.07 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.298 179.859 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -59.69 -28.44 67.3 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.867 0.365 . . . . 0.0 110.912 -179.862 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -69.44 -20.48 63.77 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.536 -179.921 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 50.3 t -73.66 -45.08 51.75 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-O 120.998 0.428 . . . . 0.0 110.805 179.621 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 84.3 mtp180 -66.95 -35.39 79.87 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.553 -179.799 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -66.15 -39.36 89.77 Favored 'General case' 0 CA--C 1.517 -0.324 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.58 -179.701 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 34.0 p -78.91 -14.5 59.19 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.716 -179.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 33.4 m -62.07 -54.5 40.46 Favored 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 120.417 -0.513 . . . . 0.0 111.456 -179.224 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.517 HG13 ' N ' ' A' ' 89' ' ' ALA . 13.2 p -79.76 -44.55 23.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-O 121.35 0.595 . . . . 0.0 111.491 179.008 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . 0.517 ' N ' HG13 ' A' ' 88' ' ' VAL . . . -53.58 -49.36 67.9 Favored 'General case' 0 CA--C 1.52 -0.208 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.324 -176.672 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.451 ' CG ' ' N ' ' A' ' 91' ' ' LYS . 16.0 pt-20 -58.74 -45.67 89.14 Favored 'General case' 0 C--N 1.315 -0.911 0 C-N-CA 120.793 -0.363 . . . . 0.0 110.807 -179.91 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . 0.451 ' N ' ' CG ' ' A' ' 90' ' ' GLU . 98.3 mttt -58.23 -36.51 73.28 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.064 -0.517 . . . . 0.0 109.856 -179.194 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 56.4 t80 -62.43 -41.6 98.84 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.834 179.612 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 81.0 t -58.27 -45.08 89.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.203 -179.142 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 65.4 mt -53.93 -42.12 52.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-O 120.802 0.334 . . . . 0.0 110.331 -179.818 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -52.47 -36.99 56.06 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.22 -179.679 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 34.9 mm -65.45 -43.54 94.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.301 -179.773 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -64.87 -49.24 71.3 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.752 -179.674 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 80.8 tt0 -63.54 -38.98 93.19 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.011 0.434 . . . . 0.0 110.413 -179.364 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -71.19 -28.98 64.62 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.296 -179.954 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -65.84 -52.38 50.93 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.657 -179.181 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . 0.405 ' H ' HG22 ' A' ' 101' ' ' THR . 1.7 t -58.27 -35.41 71.74 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.812 -179.535 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 47.3 mttp -63.77 -29.06 70.31 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.666 179.806 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 67.1 mt -92.37 2.04 56.88 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.732 0.301 . . . . 0.0 110.691 -179.476 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.4 ' HE3' HE21 ' A' ' 151' ' ' GLN . 86.6 tttt -68.15 73.83 0.21 Allowed 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.045 179.713 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 67.5 tt0 -172.31 48.16 0.02 OUTLIER 'General case' 0 CA--C 1.532 0.253 0 CA-C-O 121.29 0.567 . . . . 0.0 109.697 179.526 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 16.6 p 50.54 20.6 0.73 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.927 0.394 . . . . 0.0 110.973 -179.445 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -49.81 -36.74 26.81 Favored Glycine 0 CA--C 1.525 0.69 0 N-CA-C 110.973 -0.851 . . . . 0.0 110.973 -179.64 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 30.9 p -172.51 -166.82 0.41 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.799 0.333 . . . . 0.0 110.208 179.819 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 69.0 p -147.07 -57.88 0.27 Allowed 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.432 179.878 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -72.25 -28.31 68.35 Favored Glycine 0 CA--C 1.525 0.657 0 N-CA-C 111.341 -0.704 . . . . 0.0 111.341 179.666 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 79.9 tt0 -54.38 -34.29 60.92 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.71 0.291 . . . . 0.0 110.753 -179.129 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 61.4 m-85 -61.25 -39.04 88.84 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.607 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 40.0 t -58.84 -39.9 82.63 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.34 -179.793 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -63.7 -35.71 81.47 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.79 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 96.1 mtp -68.1 -40.35 82.62 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.131 -179.901 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 29.7 t80 -58.67 -28.13 65.45 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.313 179.87 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 66.3 t0 -57.54 -35.26 70.08 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.91 0.386 . . . . 0.0 110.48 -179.112 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 21.3 mt -58.5 -40.48 82.92 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.052 0.453 . . . . 0.0 110.034 -179.62 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.26 -53.6 52.75 Favored 'General case' 0 C--N 1.313 -0.996 0 C-N-CA 120.083 -0.647 . . . . 0.0 110.058 -179.335 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 52.8 t80 -59.36 -47.05 86.91 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.112 -179.316 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 51.3 tp10 -60.16 -35.38 75.19 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.089 -179.496 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 42.8 t -83.45 -19.85 9.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 N-CA-C 110.001 -0.37 . . . . 0.0 110.001 179.841 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 60.0 p -74.88 -27.2 60.15 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.931 0.396 . . . . 0.0 111.213 -179.612 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . 0.501 ' N ' ' HD2' ' A' ' 125' ' ' PRO . 8.0 mmtp -66.29 -57.25 13.28 Favored Pre-proline 0 C--N 1.323 -0.585 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.53 -179.541 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . 0.501 ' HD2' ' N ' ' A' ' 124' ' ' LYS . 23.8 Cg_endo -58.44 -31.66 94.63 Favored 'Trans proline' 0 C--N 1.314 -1.242 0 C-N-CA 122.24 1.96 . . . . 0.0 111.837 -179.358 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 81.2 mt -68.34 -32.53 72.71 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.676 -179.942 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -59.24 -47.05 86.78 Favored 'General case' 0 C--N 1.317 -0.82 0 C-N-CA 120.406 -0.517 . . . . 0.0 110.421 -179.29 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -69.67 -11.74 61.08 Favored 'General case' 0 CA--C 1.509 -0.619 0 CA-C-N 116.041 -0.527 . . . . 0.0 109.799 -179.614 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.422 HD22 ' HA ' ' A' ' 129' ' ' LEU . 0.2 OUTLIER -87.45 -55.93 3.58 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.168 0.509 . . . . 0.0 110.5 -179.741 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -175.67 -137.68 2.62 Favored Glycine 0 N--CA 1.451 -0.353 0 N-CA-C 110.675 -0.97 . . . . 0.0 110.675 -179.084 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 131' ' ' ILE . . . . . 0.687 HG22 ' H ' ' A' ' 132' ' ' GLN . 1.7 mt 54.26 -150.38 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 N-CA-C 109.944 -0.391 . . . . 0.0 109.944 179.309 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . 0.687 ' H ' HG22 ' A' ' 131' ' ' ILE . 4.6 tt0 179.99 138.15 0.12 Allowed 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.424 179.785 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 51.06 24.74 2.0 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.882 0.372 . . . . 0.0 110.848 178.479 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 10.4 tpt -58.95 -40.19 83.94 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.895 -0.593 . . . . 0.0 109.985 -179.605 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 21.7 m -74.19 -61.34 1.89 Allowed 'General case' 0 N--CA 1.467 0.413 0 CA-C-O 121.606 0.717 . . . . 0.0 110.284 -179.996 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 2.2 tppp? -49.31 -42.17 40.58 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-O 121.518 0.675 . . . . 0.0 110.451 -178.354 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 23.0 m -56.11 -68.49 0.2 Allowed 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.298 -0.864 . . . . 0.0 111.194 -179.241 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 14.6 p -55.92 -34.74 38.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 C-N-CA 120.723 -0.391 . . . . 0.0 110.681 -178.629 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 25.0 p -63.91 -36.89 85.44 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.622 -179.863 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 57.0 t0 -66.19 -28.06 68.48 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.594 179.811 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -67.23 -42.34 84.18 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-O 120.837 0.351 . . . . 0.0 111.1 -179.655 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -62.94 -30.13 71.33 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.396 -179.513 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 77.5 tt0 -68.31 -39.98 81.85 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.768 0.318 . . . . 0.0 110.71 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 78.7 tt0 -70.27 -41.32 73.58 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.904 -179.591 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 145' ' ' ASN . . . . . . . . . . . . . 30.0 m120 -135.27 76.57 56.54 Favored Pre-proline 0 N--CA 1.468 0.45 0 CA-C-N 116.607 -0.269 . . . . 0.0 110.556 -179.459 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 146' ' ' PRO . . . . . . . . . . . . . 78.5 Cg_exo -48.72 109.59 0.27 Allowed 'Trans proline' 0 N--CA 1.492 1.4 0 C-N-CA 122.601 2.201 . . . . 0.0 111.45 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 147' ' ' PRO . . . . . . . . . . . . . 85.1 Cg_exo -46.86 116.93 1.87 Allowed 'Trans proline' 0 N--CA 1.494 1.505 0 C-N-CA 121.813 1.675 . . . . 0.0 112.472 -179.759 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 9.1 m -130.7 -7.64 4.06 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.637 179.247 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 149' ' ' THR . . . . . 0.585 HG22 ' N ' ' A' ' 150' ' ' ALA . 85.3 m -159.51 167.34 28.84 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.849 0.357 . . . . 0.0 110.266 179.506 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 150' ' ' ALA . . . . . 0.585 ' N ' HG22 ' A' ' 149' ' ' THR . . . -51.91 -28.91 17.92 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.131 179.769 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 151' ' ' GLN . . . . . 0.4 HE21 ' HE3' ' A' ' 104' ' ' LYS . 84.7 mt-30 -73.07 -40.48 65.0 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.476 179.501 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . -59.53 -46.09 94.53 Favored Glycine 0 C--O 1.223 -0.555 0 N-CA-C 111.015 -0.834 . . . . 0.0 111.015 -179.593 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 153' ' ' VAL . . . . . . . . . . . . . 58.3 t -63.4 -42.25 95.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-O 120.831 0.348 . . . . 0.0 110.459 -179.807 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . 0.406 ' O ' HD23 ' A' ' 154' ' ' LEU . 0.8 OUTLIER -51.28 -36.17 40.92 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.254 -178.881 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 97.3 mt-10 -67.51 -33.79 75.8 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.082 -179.952 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 156' ' ' ILE . . . . . . . . . . . . . 11.6 mm -77.82 -39.08 25.81 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.275 0 CA-C-O 121.028 0.442 . . . . 0.0 111.024 179.496 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -62.4 -40.69 97.31 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.641 -179.127 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -60.11 -45.87 91.51 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.045 0.45 . . . . 0.0 110.041 -179.802 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 61.8 tttm -66.65 -27.56 67.77 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.92 -179.716 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 160' ' ' MET . . . . . . . . . . . . . 22.6 mtp -74.17 -51.63 14.95 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.883 0.373 . . . . 0.0 110.451 -179.492 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 28.7 ttm180 -64.56 -37.47 87.67 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.671 -179.196 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 51.4 mm-40 -62.21 -42.73 99.56 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.854 -179.214 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 163' ' ' LYS . . . . . . . . . . . . . 86.5 tttt -65.44 -55.22 19.17 Favored 'General case' 0 C--N 1.323 -0.547 0 C-N-CA 120.316 -0.553 . . . . 0.0 110.653 -179.191 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 9.1 mp -53.34 -32.45 49.17 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.948 0.404 . . . . 0.0 110.152 -179.333 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 61.2 tp60 -62.09 -45.92 91.39 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.439 -179.412 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 69.2 ttp85 -64.3 -30.76 71.79 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.24 0.543 . . . . 0.0 111.041 -179.845 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 167' ' ' VAL . . . . . . . . . . . . . 56.0 t -69.56 -44.84 79.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 115.41 -0.814 . . . . 0.0 110.511 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 168' ' ' HIS . . . . . 0.423 ' O ' ' ND1' ' A' ' 168' ' ' HIS . 31.0 t-80 -77.7 -30.3 51.76 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.081 179.995 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 169' ' ' THR . . . . . 0.442 ' O ' ' SG ' ' A' ' 173' ' ' CYS . 91.3 m -69.26 -49.84 52.5 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.841 -179.913 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 28.5 mmtp -63.73 -45.05 91.65 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.828 0.346 . . . . 0.0 111.068 -179.263 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 171' ' ' ASN . . . . . . . . . . . . . 97.9 m-20 -65.21 -39.71 93.14 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.121 -179.753 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 172' ' ' TYR . . . . . . . . . . . . . 66.2 t80 -75.04 -34.42 61.86 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.799 179.83 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 173' ' ' CYS . . . . . 0.442 ' SG ' ' O ' ' A' ' 169' ' ' THR . 66.9 m -71.62 -23.05 61.64 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.482 179.95 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 19.3 m -62.25 -42.77 99.62 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.689 -179.815 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 175' ' ' LEU . . . . . 0.498 ' N ' HD12 ' A' ' 175' ' ' LEU . 10.1 mp -65.83 -34.61 78.55 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.575 -179.238 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -55.49 -30.79 61.27 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.322 -179.553 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 177' ' ' LYS . . . . . . . . . . . . . 85.8 tttt -61.08 -33.75 73.83 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.57 179.543 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 178' ' ' LYS . . . . . . . . . . . . . 55.7 mtpt -74.19 -47.96 32.17 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.085 -179.912 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 81.0 mm-40 -66.2 -45.11 81.91 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.301 -179.399 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 180' ' ' ASN . . . . . . . . . . . . . 88.2 m-20 -90.47 51.28 1.98 Allowed 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.345 -0.389 . . . . 0.0 109.998 179.634 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 90.9 p -61.09 -18.54 58.51 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.308 -179.613 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 182' ' ' THR . . . . . . . . . . . . . 36.2 m -61.6 -47.42 85.52 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.684 -179.829 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 183' ' ' PHE . . . . . . . . . . . . . 9.8 m-85 -98.66 123.7 43.02 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-O 121.049 0.452 . . . . 0.0 110.401 179.734 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 15.6 m -62.75 -42.01 99.47 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.461 -0.79 . . . . 0.0 109.966 179.578 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 185' ' ' ASP . . . . . . . . . . . . . 65.8 m-20 -96.62 -123.05 0.12 Allowed 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.477 -179.986 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 186' ' ' GLU . . . . . . . . . . . . . 81.1 mm-40 46.86 64.36 1.57 Allowed 'General case' 0 N--CA 1.456 -0.159 0 CA-C-O 120.891 0.377 . . . . 0.0 110.814 179.823 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 64.9 mttp -66.27 -76.15 0.08 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.271 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 188' ' ' CYS . . . . . . . . . . . . . 2.9 p -177.1 -62.24 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.209 179.881 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 189' ' ' LYS . . . . . . . . . . . . . 64.0 tttm -164.57 116.39 1.26 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.488 -179.732 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 190' ' ' ASN . . . . . . . . . . . . . 30.0 m120 -82.31 103.31 11.79 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.41 179.749 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 191' ' ' ASN . . . . . . . . . . . . . 98.2 m-20 . . . . . 0 C--O 1.22 -0.488 0 CA-C-O 118.026 -0.988 . . . . 0.0 110.312 -179.991 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 59.8 p . . . . . 0 N--CA 1.49 1.542 0 N-CA-C 109.315 -0.624 . . . . 0.0 109.315 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . 51.64 -177.4 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.523 -179.894 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 87.05 -10.05 70.02 Favored Glycine 0 CA--C 1.525 0.665 0 N-CA-C 110.921 -0.872 . . . . 0.0 110.921 -179.916 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.422 ' N ' HD12 ' A' ' 27' ' ' LEU . 9.9 mp -92.76 178.62 5.73 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 120.967 0.413 . . . . 0.0 110.135 179.935 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -176.26 -31.6 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.533 -179.77 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 142.19 -135.14 6.48 Favored Glycine 0 N--CA 1.466 0.673 0 N-CA-C 110.463 -1.055 . . . . 0.0 110.463 -179.284 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.06 -13.03 62.21 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.957 0.408 . . . . 0.0 110.315 -179.828 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 19.6 m -65.4 -35.38 80.76 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.585 179.653 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 64.0 tttp -62.72 -53.14 58.95 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.046 0.45 . . . . 0.0 110.685 -179.57 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 71.1 mt -63.1 -30.23 49.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.093 -179.842 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 40.5 ttm180 -67.23 -41.97 84.82 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.754 -179.85 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 46.8 mt -73.47 -36.37 65.82 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.504 -0.316 . . . . 0.0 111.132 -179.61 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 78.6 tt0 -63.18 -50.77 69.03 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.537 -179.112 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -69.93 -44.61 69.23 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.841 0.353 . . . . 0.0 110.628 -179.671 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 70.3 m -62.68 -35.81 80.87 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.614 -179.974 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -73.69 -39.65 64.23 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.351 -179.913 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 37.4 ttmt -61.44 -31.94 71.9 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.66 -179.051 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -68.18 -23.52 64.86 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.73 -179.437 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 63.5 mt -64.91 -50.38 75.36 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 C-N-CA 120.627 -0.429 . . . . 0.0 111.333 -179.143 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 71.9 p -75.24 -42.28 55.64 Favored 'General case' 0 C--O 1.223 -0.321 0 CA-C-O 121.043 0.449 . . . . 0.0 111.762 -178.662 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 82.2 m-20 -62.11 -34.34 76.15 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.773 -178.322 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 55.5 mm-40 -72.76 -56.1 5.76 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.874 0.369 . . . . 0.0 111.571 -179.529 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.562 ' O ' HG22 ' A' ' 49' ' ' ILE . 9.7 pt -63.81 -27.75 43.52 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.069 -178.838 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 88.4 m-20 -70.72 -35.08 72.54 Favored 'General case' 0 N--CA 1.465 0.275 0 O-C-N 123.342 0.401 . . . . 0.0 110.907 179.841 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -52.66 -21.18 3.69 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.45 -179.501 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.562 HG22 ' O ' ' A' ' 46' ' ' ILE . 16.9 tt -60.61 -40.55 84.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.837 -179.501 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.441 ' N ' HG23 ' A' ' 49' ' ' ILE . 56.0 mtpt -51.6 -34.92 39.43 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.505 -178.744 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 34.4 mmtp -66.87 -39.5 87.55 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.61 179.865 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 50.5 t0 -70.35 -51.82 27.15 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.776 0.322 . . . . 0.0 110.844 -179.756 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.467 ' O ' ' O ' ' A' ' 56' ' ' LYS . . . -55.07 -34.34 63.51 Favored 'General case' 0 C--O 1.222 -0.351 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.445 -179.5 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -58.66 -31.69 68.41 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.887 0.375 . . . . 0.0 110.819 179.956 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 61.0 mt -60.94 -43.91 98.0 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.937 -179.268 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.467 ' O ' ' O ' ' A' ' 53' ' ' ALA . 52.2 mtpt -110.7 141.7 43.63 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-O 121.141 0.496 . . . . 0.0 110.638 -179.852 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -76.8 90.68 0.97 Allowed Glycine 0 CA--C 1.522 0.519 0 N-CA-C 110.674 -0.97 . . . . 0.0 110.674 -179.926 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 27.7 m -136.77 161.15 36.67 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.508 0 CA-C-O 120.914 0.388 . . . . 0.0 110.525 -179.79 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 71.5 m-80 -70.67 165.31 23.2 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.944 -0.571 . . . . 0.0 109.943 -179.915 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 67.7 t80 -142.44 -59.11 0.45 Allowed 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.785 -179.877 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 54.1 t0 -112.1 100.89 9.21 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.595 179.805 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -132.77 -95.14 0.33 Allowed 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.295 179.954 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 93.4 m-85 52.35 99.09 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.773 0.321 . . . . 0.0 110.653 -179.721 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 25.2 pttm -153.3 145.78 24.09 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.359 -179.896 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 84.9 m-20 53.4 36.1 22.15 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.668 179.668 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 66.0 tttm 57.27 114.28 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.119 0.485 . . . . 0.0 110.502 -179.872 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 6.7 tppt? -57.02 123.77 16.36 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.48 -179.655 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 44.6 m -90.39 126.08 35.76 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-O 120.991 0.424 . . . . 0.0 110.56 179.619 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 68.1 178.63 15.01 Favored Glycine 0 CA--C 1.522 0.476 0 N-CA-C 110.637 -0.985 . . . . 0.0 110.637 179.769 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 95.9 p -160.05 156.24 26.62 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-O 120.82 0.343 . . . . 0.0 110.414 179.75 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . 0.619 ' H ' ' CD1' ' A' ' 79' ' ' LEU . . . 64.09 -92.65 0.12 Allowed Glycine 0 CA--C 1.528 0.899 0 N-CA-C 110.985 -0.846 . . . . 0.0 110.985 179.895 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.441 ' O ' ' O ' ' A' ' 73' ' ' SER . 27.9 m -56.08 130.0 18.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 C-N-CA 121.129 -0.229 . . . . 0.0 110.854 -179.867 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . 0.463 ' O ' ' CB ' ' A' ' 74' ' ' GLU . 65.1 m 50.9 101.9 0.01 OUTLIER 'General case' 0 CA--C 1.507 -0.695 0 CA-C-O 118.7 -0.667 . . . . 0.0 109.782 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . 0.463 ' CB ' ' O ' ' A' ' 73' ' ' SER . 59.5 tt0 152.34 -22.28 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.714 0 O-C-N 124.696 1.247 . . . . 0.0 110.761 179.553 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . 0.577 ' C ' ' H ' ' A' ' 77' ' ' PHE . 8.0 m120 88.03 85.39 0.04 OUTLIER Pre-proline 0 N--CA 1.472 0.653 0 O-C-N 124.112 0.882 . . . . 0.0 109.465 -177.96 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_exo -59.3 18.62 0.03 OUTLIER 'Trans proline' 0 N--CA 1.498 1.789 0 C-N-CA 122.642 2.228 . . . . 0.0 112.401 179.656 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . 0.577 ' H ' ' C ' ' A' ' 75' ' ' ASN . 75.3 t80 -75.06 -52.75 10.28 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.017 0.437 . . . . 0.0 110.925 179.803 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 15.1 tt -76.33 -27.57 17.66 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.244 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.319 -179.879 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.619 ' CD1' ' H ' ' A' ' 71' ' ' GLY . 56.6 mt -72.99 -43.69 61.92 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.032 0.444 . . . . 0.0 111.377 -179.684 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 92.0 mt-10 -67.6 -24.17 65.45 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.54 179.477 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -64.92 -34.33 78.16 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.878 0.37 . . . . 0.0 111.004 -179.9 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 48.7 mtmt -72.89 -20.64 61.05 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.698 -179.663 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 48.3 t -72.81 -44.89 57.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 121.016 0.436 . . . . 0.0 110.61 179.865 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 91.4 mtt-85 -71.14 -30.03 65.98 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.361 -179.874 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -65.07 -46.4 81.31 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.047 0.451 . . . . 0.0 111.568 -179.146 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 5.7 t -75.43 -20.87 58.6 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.288 179.966 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 96.3 m -62.05 -53.54 54.13 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.528 -0.469 . . . . 0.0 111.244 -179.218 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 35.4 t -70.41 -44.32 77.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-O 121.092 0.473 . . . . 0.0 110.829 -179.591 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -59.17 -36.7 75.78 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.971 -0.558 . . . . 0.0 110.601 -179.052 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 84.3 tt0 -56.68 -44.93 81.93 Favored 'General case' 0 C--N 1.323 -0.577 0 C-N-CA 120.565 -0.454 . . . . 0.0 110.515 -179.933 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 9.7 mtpm? -56.66 -39.18 73.29 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.371 -179.3 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 76.9 t80 -59.3 -45.97 89.84 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.806 -179.855 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 65.2 t -56.03 -44.86 79.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-O 120.83 0.348 . . . . 0.0 110.401 -178.817 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 96.7 mt -58.94 -41.17 82.26 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 -179.335 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -56.1 -44.7 79.32 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.464 -0.334 . . . . 0.0 110.751 -179.452 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 44.4 mm -61.42 -41.78 91.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.177 -179.682 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 83.7 tt0 -60.61 -48.57 81.2 Favored 'General case' 0 C--N 1.323 -0.58 0 C-N-CA 120.651 -0.42 . . . . 0.0 110.586 -179.825 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 14.8 mm-40 -66.22 -32.22 73.52 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.561 -179.55 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -59.7 -39.65 85.32 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.417 -179.152 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -59.28 -27.59 65.96 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.037 -0.528 . . . . 0.0 110.302 -179.416 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 8.5 m -60.65 -43.33 97.71 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.504 -179.48 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -71.22 -16.57 62.51 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.472 -179.603 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.491 ' O ' ' N ' ' A' ' 105' ' ' GLU . 77.8 mt -101.77 -6.63 23.41 Favored 'General case' 0 CA--C 1.5 -0.966 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.406 -179.341 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.485 ' O ' ' O ' ' A' ' 105' ' ' GLU . 0.1 OUTLIER -24.33 -44.13 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.772 0 O-C-N 124.528 1.142 . . . . 0.0 110.798 -179.169 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . 0.491 ' N ' ' O ' ' A' ' 103' ' ' LEU . 77.5 mm-40 -56.75 -148.11 0.0 OUTLIER 'General case' 0 N--CA 1.448 -0.575 0 CA-C-N 115.187 -0.915 . . . . 0.0 109.343 178.514 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . 0.715 HG23 ' H ' ' A' ' 107' ' ' GLY . 4.7 t -48.57 -59.17 3.73 Favored 'General case' 0 C--N 1.318 -0.772 0 O-C-N 121.992 -0.443 . . . . 0.0 111.114 178.997 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . 0.715 ' H ' HG23 ' A' ' 106' ' ' THR . . . 70.94 -43.84 0.64 Allowed Glycine 0 CA--C 1.526 0.762 0 N-CA-C 111.044 -0.822 . . . . 0.0 111.044 -179.445 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 1.4 t 72.89 129.83 0.04 OUTLIER 'General case' 0 CA--C 1.53 0.184 0 CA-C-O 120.767 0.317 . . . . 0.0 110.482 -179.792 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 15.0 m -64.01 -36.73 84.94 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.449 179.912 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -59.04 -33.36 73.99 Favored Glycine 0 CA--C 1.522 0.487 0 N-CA-C 110.792 -0.923 . . . . 0.0 110.792 -179.658 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 42.7 tp10 -66.73 -43.34 84.5 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 120.77 -0.372 . . . . 0.0 110.3 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' PHE . . . . . 0.436 ' O ' ' N ' ' A' ' 115' ' ' MET . 48.3 m-85 -67.62 -37.57 82.68 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.625 -179.956 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 59.9 p -47.31 -34.71 7.08 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.967 0.413 . . . . 0.0 110.67 -179.039 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -76.44 -28.85 56.74 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.778 178.854 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' MET . . . . . 0.436 ' N ' ' O ' ' A' ' 112' ' ' PHE . 60.9 mmm -73.38 -44.71 58.0 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.234 -179.844 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 7.4 m-85 -60.24 -49.43 77.64 Favored 'General case' 0 CA--C 1.513 -0.445 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 -179.388 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 66.8 t0 -47.75 -32.15 5.58 Favored 'General case' 0 N--CA 1.453 -0.28 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 -179.084 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.515 ' O ' HD13 ' A' ' 118' ' ' LEU . 0.2 OUTLIER -62.23 -44.81 95.72 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.73 -179.992 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' MET . . . . . 0.415 ' C ' ' SD ' ' A' ' 119' ' ' MET . 0.0 OUTLIER -52.16 -42.91 63.79 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.238 -0.892 . . . . 0.0 109.724 -178.988 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 85.4 m-85 -68.06 -39.61 82.97 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.06 -179.828 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 87.7 mt-10 -59.61 -45.76 90.96 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.779 -179.344 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 122' ' ' VAL . . . . . 0.552 ' O ' HD23 ' A' ' 126' ' ' LEU . 7.7 p -75.08 -24.66 17.88 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.822 0 O-C-N 123.314 0.384 . . . . 0.0 110.042 179.344 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 23.0 t -75.5 -25.75 57.55 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.832 0.348 . . . . 0.0 111.037 179.862 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . 0.481 ' N ' ' HD2' ' A' ' 125' ' ' PRO . 43.6 tptt -59.55 -57.25 28.32 Favored Pre-proline 0 CA--C 1.549 0.92 0 C-N-CA 120.557 -0.457 . . . . 0.0 110.777 179.797 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . 0.481 ' HD2' ' N ' ' A' ' 124' ' ' LYS . 31.8 Cg_endo -60.28 -25.78 81.02 Favored 'Trans proline' 0 N--CA 1.489 1.208 0 C-N-CA 122.597 2.198 . . . . 0.0 111.783 -178.387 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.552 HD23 ' O ' ' A' ' 122' ' ' VAL . 2.5 mm? -64.65 -32.77 74.57 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.69 -179.211 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 78.6 mt-30 -57.28 -38.22 73.58 Favored 'General case' 0 C--N 1.31 -1.129 0 C-N-CA 120.403 -0.519 . . . . 0.0 110.306 -179.859 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 32.4 mmtp -61.61 -10.98 9.45 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.752 -179.614 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 15.4 mt -114.47 -2.52 13.18 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.973 179.743 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . 0.525 ' O ' ' C ' ' A' ' 131' ' ' ILE . . . 114.43 -94.78 0.7 Allowed Glycine 0 CA--C 1.503 -0.687 0 N-CA-C 109.82 -1.312 . . . . 0.0 109.82 179.942 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 131' ' ' ILE . . . . . 0.525 ' C ' ' O ' ' A' ' 130' ' ' GLY . 4.8 mp -3.46 88.46 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.084 0 O-C-N 124.902 1.001 . . . . 0.0 110.703 179.837 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . 0.489 ' O ' ' HB2' ' A' ' 133' ' ' GLU . 19.4 tt0 -123.51 162.62 22.54 Favored 'General case' 0 CA--C 1.486 -1.514 0 N-CA-C 107.294 -1.372 . . . . 0.0 107.294 -178.583 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 133' ' ' GLU . . . . . 0.489 ' HB2' ' O ' ' A' ' 132' ' ' GLN . 92.4 mt-10 106.22 -19.4 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.972 0 O-C-N 125.785 1.928 . . . . 0.0 109.757 179.536 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 5.0 mtp -52.85 -48.2 67.22 Favored 'General case' 0 C--N 1.319 -0.735 0 C-N-CA 120.36 -0.536 . . . . 0.0 110.899 -179.277 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 65.7 p -52.58 -21.62 4.07 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.57 178.796 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 70.3 mmtt -83.31 -48.09 10.8 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 115.626 -0.715 . . . . 0.0 111.304 -179.651 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 46.5 p -54.05 -50.22 67.2 Favored 'General case' 0 C--N 1.324 -0.505 0 C-N-CA 120.827 -0.349 . . . . 0.0 110.745 -178.983 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 58.3 t -68.72 -44.35 82.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.088 -179.881 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 47.6 t -65.34 -41.29 94.07 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.954 0.407 . . . . 0.0 111.14 -179.846 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -64.21 -42.1 96.76 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.665 -179.539 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -63.54 -47.59 80.96 Favored 'General case' 0 CA--C 1.519 -0.248 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.998 -179.626 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -46.54 -35.46 5.8 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.944 -179.292 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -90.61 77.15 6.43 Favored 'General case' 0 CA--C 1.517 -0.301 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 179.509 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 79.2 tt0 -177.64 -61.23 0.01 OUTLIER 'General case' 0 C--N 1.334 -0.077 0 O-C-N 123.593 0.558 . . . . 0.0 110.434 179.644 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 145' ' ' ASN . . . . . . . . . . . . . 7.2 p-10 -143.01 64.63 14.71 Favored Pre-proline 0 N--CA 1.467 0.402 0 CA-C-N 116.196 -0.457 . . . . 0.0 109.897 -179.575 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 146' ' ' PRO . . . . . 0.547 ' O ' ' N ' ' A' ' 148' ' ' THR . 80.7 Cg_exo -34.24 98.78 0.02 OUTLIER 'Trans proline' 0 N--CA 1.491 1.329 0 C-N-CA 123.304 2.669 . . . . 0.0 111.722 -179.503 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 147' ' ' PRO . . . . . 0.526 ' C ' ' H ' ' A' ' 149' ' ' THR . 59.6 Cg_exo -51.48 74.2 0.02 OUTLIER 'Trans proline' 0 N--CA 1.496 1.671 0 C-N-CA 122.354 2.036 . . . . 0.0 113.14 -179.294 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 148' ' ' THR . . . . . 0.547 ' N ' ' O ' ' A' ' 146' ' ' PRO . 8.1 p -73.17 21.43 0.08 Allowed 'General case' 0 C--N 1.329 -0.309 0 O-C-N 121.997 -0.439 . . . . 0.0 109.981 179.883 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 149' ' ' THR . . . . . 0.656 HG23 ' H ' ' A' ' 152' ' ' GLY . 1.2 t -148.52 156.36 42.34 Favored 'General case' 0 CA--C 1.52 -0.176 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.161 -179.881 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -64.75 -33.78 76.78 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.958 -179.784 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 7.2 tt0 -68.74 -44.41 73.85 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.881 0.372 . . . . 0.0 110.753 -179.784 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 152' ' ' GLY . . . . . 0.656 ' H ' HG23 ' A' ' 149' ' ' THR . . . -56.53 -38.3 79.97 Favored Glycine 0 CA--C 1.52 0.366 0 N-CA-C 110.871 -0.892 . . . . 0.0 110.871 -179.198 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 153' ' ' VAL . . . . . . . . . . . . . 75.9 t -53.51 -32.53 20.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 C-N-CA 120.923 -0.311 . . . . 0.0 110.503 -179.392 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 72.5 mt -56.85 -27.47 60.37 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.94 0.4 . . . . 0.0 110.112 -179.505 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 67.3 mm-40 -66.92 -32.82 74.33 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.258 179.583 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 156' ' ' ILE . . . . . 0.428 HG22 ' SD ' ' A' ' 160' ' ' MET . 14.7 mm -75.23 -41.53 44.07 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.182 0 CA-C-O 120.931 0.396 . . . . 0.0 110.88 179.605 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -50.8 -39.22 52.3 Favored 'General case' 0 CA--C 1.516 -0.341 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.379 -179.646 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 158' ' ' LYS . . . . . 0.436 ' O ' ' CB ' ' A' ' 162' ' ' GLU . 99.6 mttt -56.38 -56.63 18.76 Favored 'General case' 0 C--O 1.216 -0.664 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.447 179.787 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 42.7 mmtm -57.96 -36.49 72.66 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.757 0.313 . . . . 0.0 111.007 -179.375 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 160' ' ' MET . . . . . 0.428 ' SD ' HG22 ' A' ' 156' ' ' ILE . 6.2 mtp -67.44 -57.4 6.61 Favored 'General case' 0 C--N 1.322 -0.588 0 C-N-CA 120.398 -0.521 . . . . 0.0 110.826 -179.526 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 61.4 ttp180 -68.71 -35.86 77.71 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.881 -179.483 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . 0.436 ' CB ' ' O ' ' A' ' 158' ' ' LYS . 81.2 tt0 -65.14 -35.54 81.42 Favored 'General case' 0 CA--C 1.512 -0.495 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.536 -179.275 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 163' ' ' LYS . . . . . . . . . . . . . 23.3 tptm -70.58 -56.5 6.37 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 119.992 -0.683 . . . . 0.0 110.845 -179.131 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 4.8 mt -55.17 -28.96 56.67 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.187 0.518 . . . . 0.0 110.081 -178.519 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 54.3 tt0 -61.71 -47.82 83.56 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.718 -0.673 . . . . 0.0 110.388 -179.71 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -62.09 -30.52 71.06 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.4 0.619 . . . . 0.0 110.731 -179.595 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 167' ' ' VAL . . . . . . . . . . . . . 51.8 t -67.2 -46.57 83.89 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-N 115.038 -0.983 . . . . 0.0 110.693 -179.694 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 168' ' ' HIS . . . . . 0.469 ' O ' ' ND1' ' A' ' 168' ' ' HIS . 23.6 t-80 -79.68 -30.52 41.15 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.193 -179.791 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 169' ' ' THR . . . . . . . . . . . . . 27.5 m -72.99 -45.35 58.41 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.409 -179.904 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 64.7 tttm -61.9 -42.26 98.87 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.663 -179.047 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 171' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -69.84 -31.47 69.35 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.609 179.829 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 172' ' ' TYR . . . . . . . . . . . . . 74.2 t80 -70.05 -32.26 70.29 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.887 -179.833 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 86.5 m -76.24 -32.93 59.15 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.734 -179.822 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 21.4 p -63.62 -37.17 86.33 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.842 0.353 . . . . 0.0 110.477 -179.856 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 94.9 mt -65.49 -34.78 79.07 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.39 -179.928 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 72.6 mmtt -63.44 -8.63 9.64 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.477 -179.818 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 177' ' ' LYS . . . . . . . . . . . . . 62.7 tttm -63.42 -35.86 81.84 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.658 179.124 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 178' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -67.75 -38.87 84.06 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.863 179.897 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 52.3 tp10 -51.04 -46.12 61.53 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.301 -178.936 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 180' ' ' ASN . . . . . 0.404 ' O ' ' CB ' ' A' ' 181' ' ' SER . 16.8 m120 -96.09 -90.1 0.25 Allowed 'General case' 0 N--CA 1.464 0.244 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 179.481 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 181' ' ' SER . . . . . 0.404 ' CB ' ' O ' ' A' ' 180' ' ' ASN . 1.0 OUTLIER 166.16 -67.05 0.0 OUTLIER 'General case' 0 N--CA 1.462 0.169 0 CA-C-O 120.874 0.369 . . . . 0.0 110.167 179.727 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 182' ' ' THR . . . . . . . . . . . . . 28.8 m -159.15 111.72 2.21 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.521 -179.655 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 183' ' ' PHE . . . . . . . . . . . . . 30.5 m-85 -141.54 153.4 44.84 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.356 179.983 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 2.9 m -145.4 45.49 1.31 Allowed 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.418 179.758 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 185' ' ' ASP . . . . . . . . . . . . . 49.6 p-10 -163.46 42.05 0.1 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.704 179.876 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 186' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -155.13 152.3 29.3 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.151 0.5 . . . . 0.0 109.957 -179.081 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 58.4 mtpt -88.73 148.17 24.11 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.309 179.598 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 188' ' ' CYS . . . . . . . . . . . . . 45.1 t -54.11 -34.25 59.8 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.523 179.713 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 189' ' ' LYS . . . . . . . . . . . . . 34.9 mmtp -69.47 -59.62 2.86 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.528 -179.849 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 190' ' ' ASN . . . . . . . . . . . . . 20.6 t-20 -71.88 102.55 2.92 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.01 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 191' ' ' ASN . . . . . . . . . . . . . 86.9 m-20 . . . . . 0 C--O 1.219 -0.538 0 CA-C-O 118.137 -0.935 . . . . 0.0 110.544 -179.82 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 35.3 m . . . . . 0 N--CA 1.491 1.596 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . 52.27 -104.31 0.18 Allowed 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.489 -179.944 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -157.52 -36.5 0.02 OUTLIER Glycine 0 CA--C 1.523 0.577 0 N-CA-C 110.824 -0.91 . . . . 0.0 110.824 -179.882 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 52.1 mt -78.16 149.14 33.82 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.028 0.442 . . . . 0.0 110.082 -179.895 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.669 HG23 ' O ' ' A' ' 28' ' ' THR . 7.1 t -59.88 98.64 0.06 Allowed 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.786 -0.643 . . . . 0.0 109.852 179.719 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . 0.555 ' O ' ' HB2' ' A' ' 30' ' ' ALA . . . -20.89 84.72 0.0 OUTLIER Glycine 0 N--CA 1.48 1.619 0 O-C-N 123.7 0.625 . . . . 0.0 112.322 -179.347 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.555 ' HB2' ' O ' ' A' ' 29' ' ' GLY . . . 164.5 -69.65 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 120.988 0.423 . . . . 0.0 109.963 -178.363 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 25.4 m -49.18 -29.32 5.36 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.55 -178.86 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 21.0 pttp -61.94 -26.3 68.11 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.5 179.596 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 96.6 mt -59.07 -45.12 92.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 -178.549 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 10.1 tpt180 -65.61 -53.07 46.73 Favored 'General case' 0 C--N 1.324 -0.506 0 C-N-CA 120.158 -0.617 . . . . 0.0 110.365 -179.69 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.441 ' N ' HD12 ' A' ' 35' ' ' LEU . 11.0 mp -59.87 -44.9 93.92 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.054 -0.521 . . . . 0.0 109.696 -178.635 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 80.9 tt0 -58.94 -51.01 71.89 Favored 'General case' 0 C--N 1.32 -0.717 0 C-N-CA 120.479 -0.488 . . . . 0.0 110.234 -179.505 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 16.5 mmm180 -68.69 -42.43 77.8 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.962 0.411 . . . . 0.0 110.968 -179.766 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 52.0 m -67.52 -40.08 85.08 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.609 -179.89 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -61.01 -49.49 77.23 Favored 'General case' 0 C--O 1.219 -0.51 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.491 -179.536 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -54.4 -42.75 70.79 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 120.683 -0.407 . . . . 0.0 110.25 -179.09 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 23.9 m-20 -52.93 -22.87 6.11 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.713 179.594 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 81.1 mt -65.81 -59.01 4.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 C-N-CA 120.184 -0.606 . . . . 0.0 110.98 -179.819 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 82.8 p -76.71 -37.22 56.47 Favored 'General case' 0 C--O 1.225 -0.188 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.657 -179.009 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 52.6 t0 -61.94 -41.04 97.5 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.836 -0.62 . . . . 0.0 112.427 -178.088 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 64.8 mm-40 -69.1 -51.76 35.28 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.873 0.368 . . . . 0.0 111.419 -179.194 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 10.2 pt -66.91 -28.59 43.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.531 -179.333 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -61.43 -40.47 94.56 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 110.036 -0.357 . . . . 0.0 110.036 -179.785 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -53.41 -30.07 38.29 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.331 -179.15 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 62.8 mt -67.6 -43.42 86.96 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.333 179.454 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 69.0 mttm -58.21 -46.28 86.12 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.159 -179.087 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 52.1 mtmt -65.62 -41.07 93.11 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.662 179.401 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 96.6 m-20 -61.59 -39.37 90.93 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.029 -179.377 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.441 ' O ' ' O ' ' A' ' 56' ' ' LYS . . . -60.86 -31.97 71.4 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.596 -179.992 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -59.35 -30.82 68.67 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.892 0.377 . . . . 0.0 110.921 -179.701 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 57.3 mt -59.1 -34.3 71.84 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.609 -179.349 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.441 ' O ' ' O ' ' A' ' 53' ' ' ALA . 68.9 mttm -119.19 147.45 44.21 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-O 121.249 0.547 . . . . 0.0 110.551 -179.851 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -77.27 95.51 1.19 Allowed Glycine 0 CA--C 1.521 0.441 0 N-CA-C 110.496 -1.041 . . . . 0.0 110.496 -179.895 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 27.4 m -133.55 152.21 34.71 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.512 0 CA-C-O 120.853 0.358 . . . . 0.0 110.098 179.99 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . 0.578 ' N ' HD22 ' A' ' 59' ' ' ASN . 0.0 OUTLIER -84.33 63.58 7.85 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.277 -179.948 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 81.3 t80 -62.08 -53.57 53.67 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.687 -179.744 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 36.1 p-10 -91.41 78.15 5.72 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.573 -179.746 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -143.42 -82.19 0.18 Allowed 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.269 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . 0.502 ' C ' ' H ' ' A' ' 65' ' ' ASP . 64.4 m-85 56.58 39.43 29.84 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.451 -179.596 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 72.7 tttt -72.02 19.9 0.07 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.48 -179.838 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.502 ' H ' ' C ' ' A' ' 63' ' ' PHE . 37.4 t70 -167.06 160.3 13.9 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.81 0.338 . . . . 0.0 110.166 -179.998 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 22.5 pttp -65.29 140.43 58.7 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.251 179.84 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.569 ' C ' ' H ' ' A' ' 69' ' ' GLY . 46.9 mmtm -119.85 -84.44 0.66 Allowed 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.338 -179.952 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 3.5 m 66.39 -15.42 0.13 Allowed 'General case' 0 C--N 1.326 -0.452 0 O-C-N 123.24 0.338 . . . . 0.0 110.633 -179.499 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . 0.569 ' H ' ' C ' ' A' ' 67' ' ' LYS . . . 160.19 -136.09 4.38 Favored Glycine 0 C--N 1.333 0.416 0 N-CA-C 110.397 -1.081 . . . . 0.0 110.397 -179.665 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 5.2 t 64.25 88.06 0.11 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.757 0.313 . . . . 0.0 110.16 -179.742 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -79.1 23.35 3.24 Favored Glycine 0 CA--C 1.524 0.596 0 N-CA-C 111.055 -0.818 . . . . 0.0 111.055 -179.792 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 10.9 p -130.82 -31.94 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.708 0 CA-C-O 120.791 0.329 . . . . 0.0 110.765 -179.908 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 67.5 m -58.33 -40.91 83.37 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.389 -179.447 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 11.4 tp10 -135.29 -145.05 0.22 Allowed 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.468 -179.708 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 69.8 m-20 -90.19 140.24 27.24 Favored Pre-proline 0 CA--C 1.534 0.347 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.321 -179.5 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -74.53 -5.67 17.21 Favored 'Trans proline' 0 N--CA 1.495 1.58 0 C-N-CA 122.443 2.095 . . . . 0.0 111.971 179.903 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 53.5 t80 -72.36 -50.95 22.92 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.907 0.384 . . . . 0.0 111.513 -179.413 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 64.7 mt -69.74 -29.0 39.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.935 -179.296 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.421 ' N ' HD12 ' A' ' 79' ' ' LEU . 8.1 mp -77.01 -48.71 17.18 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 120.862 0.363 . . . . 0.0 110.174 179.778 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -65.44 -29.33 69.99 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.095 -0.502 . . . . 0.0 109.922 179.937 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -66.78 -37.28 84.27 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.706 179.662 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 37.0 ttpt -63.78 -24.2 67.67 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.744 -179.596 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 32.3 t -70.69 -46.6 68.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.668 179.859 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 57.8 ttt85 -62.28 -33.18 74.14 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.32 -179.642 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -59.28 -37.6 78.08 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.121 0.486 . . . . 0.0 110.895 -179.427 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 61.3 p -72.11 -27.7 62.8 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.36 179.638 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 25.0 m -57.61 -53.77 54.4 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 120.443 -0.503 . . . . 0.0 111.252 -178.778 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.565 HG23 ' N ' ' A' ' 89' ' ' ALA . 26.8 m -72.46 -50.8 32.57 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-O 120.92 0.39 . . . . 0.0 111.338 179.668 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . 0.565 ' N ' HG23 ' A' ' 88' ' ' VAL . . . -55.57 -44.25 76.71 Favored 'General case' 0 C--O 1.222 -0.376 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.341 -178.323 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 77.8 tt0 -58.2 -45.45 87.57 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.193 0.52 . . . . 0.0 110.584 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 57.3 mtpt -60.87 -29.65 69.67 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.63 -179.206 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.455 ' CZ ' HD12 ' A' ' 118' ' ' LEU . 82.7 t80 -71.05 -59.38 2.81 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.987 -178.859 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 8.4 m -49.4 -40.29 14.23 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.448 0 N-CA-C 109.921 -0.4 . . . . 0.0 109.921 -178.801 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 88.9 mt -61.94 -43.06 96.97 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 N-CA-C 109.888 -0.412 . . . . 0.0 109.888 179.52 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -57.52 -30.98 65.6 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 120.876 -0.33 . . . . 0.0 110.801 -179.112 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 40.7 mm -59.87 -36.51 67.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.44 -179.512 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -65.78 -34.41 78.12 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.938 179.907 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -65.05 -39.53 93.43 Favored 'General case' 0 C--N 1.326 -0.45 0 C-N-CA 120.851 -0.34 . . . . 0.0 110.358 -179.469 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 80.7 mm-40 -67.38 -39.0 85.59 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.908 0.385 . . . . 0.0 110.744 -179.832 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -53.27 -48.34 68.39 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.956 0.408 . . . . 0.0 110.81 -179.634 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 11.9 m -60.1 -48.24 82.57 Favored 'General case' 0 C--N 1.321 -0.652 0 C-N-CA 120.472 -0.491 . . . . 0.0 110.847 -179.392 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 5.8 mptp? -67.21 -31.57 72.03 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.802 0.334 . . . . 0.0 111.009 179.935 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 27.1 mt -67.11 -7.1 20.62 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 120.869 0.366 . . . . 0.0 110.679 -178.803 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.405 ' O ' HG22 ' A' ' 106' ' ' THR . 22.4 pttp -57.83 142.51 45.53 Favored 'General case' 0 C--N 1.316 -0.863 0 C-N-CA 120.508 -0.477 . . . . 0.0 109.788 179.547 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 70.3 mm-40 66.96 20.87 10.44 Favored 'General case' 0 C--N 1.33 -0.253 0 O-C-N 123.609 0.568 . . . . 0.0 111.133 178.753 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . 0.409 ' O ' ' OG1' ' A' ' 106' ' ' THR . 0.9 OUTLIER 178.0 31.32 0.0 OUTLIER 'General case' 0 CA--C 1.53 0.188 0 CA-C-O 121.126 0.488 . . . . 0.0 110.081 179.694 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -82.83 -63.79 1.72 Allowed Glycine 0 N--CA 1.464 0.508 0 N-CA-C 110.871 -0.892 . . . . 0.0 110.871 -179.719 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . 0.464 ' O ' ' CE1' ' A' ' 112' ' ' PHE . 1.0 OUTLIER 70.5 -171.48 0.17 Allowed 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 109.735 -0.468 . . . . 0.0 109.735 -179.74 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 91.4 p -113.99 -10.79 12.85 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.366 179.638 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -71.76 -52.79 10.97 Favored Glycine 0 CA--C 1.526 0.754 0 N-CA-C 111.355 -0.698 . . . . 0.0 111.355 179.89 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . 0.505 ' CD ' ' H ' ' A' ' 111' ' ' GLU . 2.5 mp0 -68.31 -22.62 64.7 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.916 0.389 . . . . 0.0 110.876 -179.491 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' PHE . . . . . 0.464 ' CE1' ' O ' ' A' ' 108' ' ' SER . 3.3 m-85 -59.42 -43.79 92.98 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.24 -178.987 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 43.8 t -60.1 -43.44 95.56 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.212 -179.891 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -65.11 -28.89 69.75 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.733 179.642 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 50.1 tpp -76.11 -52.54 9.92 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.245 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 36.9 t80 -62.08 -50.18 72.97 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 109.777 -0.453 . . . . 0.0 109.777 -179.685 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 52.2 t0 -48.58 -27.73 2.97 Favored 'General case' 0 CA--C 1.517 -0.29 0 N-CA-C 109.652 -0.499 . . . . 0.0 109.652 -179.073 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.49 ' O ' HD13 ' A' ' 118' ' ' LEU . 0.2 OUTLIER -64.68 -46.14 83.7 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.498 0.666 . . . . 0.0 109.893 -179.926 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 14.4 tpt -57.96 -34.26 69.74 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 114.987 -1.006 . . . . 0.0 109.638 -179.305 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 68.1 t80 -71.0 -41.1 71.38 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.317 -0.401 . . . . 0.0 112.046 -179.41 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 65.5 mm-40 -63.45 -44.87 93.24 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.87 -178.937 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 28.9 m -75.22 -23.97 17.37 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.405 0 O-C-N 123.326 0.391 . . . . 0.0 110.749 -179.898 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 21.2 t -68.0 -33.16 74.08 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.631 179.69 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 17.1 mttp -60.24 -56.68 33.06 Favored Pre-proline 0 CA--C 1.541 0.626 0 C-N-CA 121.05 -0.26 . . . . 0.0 110.833 -179.421 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 75.8 Cg_exo -43.58 -36.5 7.18 Favored 'Trans proline' 0 C--N 1.317 -1.113 0 C-N-CA 122.14 1.893 . . . . 0.0 112.442 178.402 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.51 ' HB3' HD13 ' A' ' 131' ' ' ILE . 10.1 mp -70.29 -35.13 73.51 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.981 -179.862 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 40.9 mm-40 -61.51 -52.41 64.6 Favored 'General case' 0 C--N 1.32 -0.683 0 C-N-CA 120.248 -0.581 . . . . 0.0 110.728 -179.427 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 50.1 mtmt -63.78 -10.98 22.82 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.18 -179.57 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.412 HD23 ' C ' ' A' ' 129' ' ' LEU . 2.5 tt -97.86 -67.62 0.84 Allowed 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.278 -179.778 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . 0.66 ' C ' HD12 ' A' ' 131' ' ' ILE . . . -155.51 -138.51 2.58 Favored Glycine 0 CA--C 1.518 0.259 0 N-CA-C 110.688 -0.965 . . . . 0.0 110.688 -179.231 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 131' ' ' ILE . . . . . 1.042 HG22 ' H ' ' A' ' 132' ' ' GLN . 3.3 mp 53.28 -158.41 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.517 -0.298 0 N-CA-C 109.654 -0.499 . . . . 0.0 109.654 -179.771 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . 1.042 ' H ' HG22 ' A' ' 131' ' ' ILE . 6.0 tp60 177.43 139.52 0.08 Allowed 'General case' 0 N--CA 1.446 -0.654 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 179.866 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 94.1 mt-10 59.28 26.12 14.88 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-O 120.966 0.412 . . . . 0.0 111.455 178.135 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 9.3 tpt -57.79 -39.93 78.69 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.087 -179.798 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 56.8 p -75.22 -61.72 1.8 Allowed 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 121.363 0.602 . . . . 0.0 110.696 -179.699 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 17.7 ttmm -49.24 -44.27 43.41 Favored 'General case' 0 C--N 1.32 -0.679 0 C-N-CA 120.455 -0.498 . . . . 0.0 110.524 -178.327 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 76.8 m -55.52 -68.44 0.2 Allowed 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.323 -179.299 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 138' ' ' VAL . . . . . 0.41 HG13 ' N ' ' A' ' 139' ' ' SER . 11.7 p -59.86 -38.89 78.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.993 0.425 . . . . 0.0 110.469 -178.891 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . 0.41 ' N ' HG13 ' A' ' 138' ' ' VAL . 15.9 m -63.23 -38.5 91.4 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.753 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -63.09 -31.42 72.56 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.009 -0.542 . . . . 0.0 110.522 -179.859 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -64.43 -46.03 84.93 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.86 0.362 . . . . 0.0 111.119 -179.598 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -57.75 -31.18 66.24 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.713 -179.207 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 14.3 mm-40 -75.13 -44.59 46.18 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.861 0.362 . . . . 0.0 111.117 -179.99 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 46.3 tp10 -72.12 -45.79 59.17 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.022 -179.106 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 145' ' ' ASN . . . . . 0.537 HD21 ' CD1' ' A' ' 156' ' ' ILE . 3.5 p-10 -128.54 68.98 78.81 Favored Pre-proline 0 N--CA 1.469 0.513 0 CA-C-N 116.376 -0.374 . . . . 0.0 110.09 -179.045 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 146' ' ' PRO . . . . . . . . . . . . . 23.2 Cg_endo -60.28 112.69 1.39 Allowed 'Trans proline' 0 N--CA 1.492 1.418 0 C-N-CA 122.38 2.053 . . . . 0.0 111.303 -179.7 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 147' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -79.3 136.36 12.62 Favored 'Trans proline' 0 N--CA 1.491 1.378 0 C-N-CA 122.115 1.876 . . . . 0.0 111.768 -179.902 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 36.5 p -129.53 18.96 5.76 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.236 179.327 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 149' ' ' THR . . . . . . . . . . . . . 8.5 m -151.96 152.46 32.52 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 120.661 0.267 . . . . 0.0 110.354 179.578 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -49.47 -36.11 21.71 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.795 0.331 . . . . 0.0 110.559 -179.077 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 14.9 pt20 -77.74 -40.64 40.41 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.649 179.216 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . -56.4 -36.97 71.92 Favored Glycine 0 CA--C 1.519 0.302 0 N-CA-C 110.887 -0.885 . . . . 0.0 110.887 -178.839 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 153' ' ' VAL . . . . . 0.44 ' O ' ' N ' ' A' ' 156' ' ' ILE . 86.1 t -60.88 -42.07 91.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 C-N-CA 121.21 -0.196 . . . . 0.0 110.508 -179.839 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 79.3 mt -43.56 -23.42 0.07 Allowed 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 120.912 0.387 . . . . 0.0 110.86 -179.295 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 155' ' ' GLU . . . . . 0.411 ' N ' ' C ' ' A' ' 153' ' ' VAL . 95.2 mt-10 -64.86 -40.4 95.08 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.004 179.268 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 156' ' ' ILE . . . . . 0.651 HG22 ' SD ' ' A' ' 160' ' ' MET . 10.2 mm -71.48 -35.74 57.94 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.154 -179.709 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -60.13 -41.75 93.34 Favored 'General case' 0 N--CA 1.453 -0.278 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.864 -179.686 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 17.3 ttmm -60.74 -44.68 96.37 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.496 -179.405 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 53.6 tttm -73.77 -30.09 62.57 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.83 -179.371 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 160' ' ' MET . . . . . 0.651 ' SD ' HG22 ' A' ' 156' ' ' ILE . 12.0 mtp -67.49 -54.05 23.48 Favored 'General case' 0 C--O 1.221 -0.436 0 C-N-CA 120.508 -0.477 . . . . 0.0 110.174 -178.976 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 80.8 mtp180 -61.99 -31.75 72.15 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.394 179.922 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -58.4 -46.34 86.59 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.222 -179.269 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 163' ' ' LYS . . . . . . . . . . . . . 54.0 tttp -65.08 -52.28 56.52 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 120.357 -0.537 . . . . 0.0 110.78 -179.064 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -51.98 -36.08 48.54 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.998 0.427 . . . . 0.0 110.285 -179.071 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 57.6 tt0 -62.09 -40.04 94.48 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.325 179.896 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 20.3 mmt85 -65.89 -34.66 78.65 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.453 0.644 . . . . 0.0 111.434 -179.585 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 167' ' ' VAL . . . . . . . . . . . . . 38.6 t -66.76 -47.44 82.93 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.769 0 CA-C-N 115.139 -0.937 . . . . 0.0 110.284 -179.53 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 42.8 t-80 -79.44 -31.11 42.5 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.519 -179.471 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 169' ' ' THR . . . . . . . . . . . . . 90.2 m -71.64 -44.43 64.35 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.126 -179.828 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 59.8 mmtt -62.01 -41.76 98.43 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.99 0.424 . . . . 0.0 110.733 -179.021 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 171' ' ' ASN . . . . . . . . . . . . . 10.3 m120 -68.63 -34.92 76.57 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.628 179.473 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 172' ' ' TYR . . . . . 0.414 ' CZ ' ' NZ ' ' A' ' 176' ' ' LYS . 86.8 t80 -63.85 -40.46 96.64 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.115 -179.524 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 7.2 t -76.11 -46.85 26.83 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.783 -178.679 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 24.5 p -58.2 -47.83 82.23 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.078 -178.808 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -64.1 -35.14 79.78 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-O 120.808 0.337 . . . . 0.0 110.721 -179.911 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 176' ' ' LYS . . . . . 0.414 ' NZ ' ' CZ ' ' A' ' 172' ' ' TYR . 14.2 tptt -54.71 -19.3 5.93 Favored 'General case' 0 C--N 1.313 -1.003 0 C-N-CA 120.274 -0.57 . . . . 0.0 110.461 -179.158 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 177' ' ' LYS . . . . . . . . . . . . . 61.0 tttm -68.98 -39.77 79.21 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 121.712 0.768 . . . . 0.0 111.368 179.846 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 178' ' ' LYS . . . . . . . . . . . . . 20.0 mtpp -80.7 -23.34 39.61 Favored 'General case' 0 C--N 1.31 -1.138 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.024 -178.721 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 80.7 mm-40 -59.7 -50.97 71.77 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 120.181 -0.608 . . . . 0.0 110.502 -178.753 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 180' ' ' ASN . . . . . 0.504 ' C ' ' H ' ' A' ' 182' ' ' THR . 54.1 p30 -147.16 -13.13 0.41 Allowed 'General case' 0 CA--C 1.516 -0.362 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.281 -179.872 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 3.6 p 70.35 -16.39 0.31 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.839 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 182' ' ' THR . . . . . 0.504 ' H ' ' C ' ' A' ' 180' ' ' ASN . 71.5 p -83.01 86.46 6.99 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-O 120.877 0.37 . . . . 0.0 110.27 -179.856 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 183' ' ' PHE . . . . . 0.411 ' CZ ' ' OE1' ' A' ' 186' ' ' GLU . 72.0 t80 -167.41 -16.57 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.52 -179.874 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 184' ' ' THR . . . . . . . . . . . . . 1.5 t -49.91 -16.63 0.29 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.989 0.423 . . . . 0.0 110.686 -179.933 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 185' ' ' ASP . . . . . . . . . . . . . 89.5 m-20 -60.8 -43.74 97.75 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.314 -179.915 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 186' ' ' GLU . . . . . 0.411 ' OE1' ' CZ ' ' A' ' 183' ' ' PHE . 70.7 mt-10 -79.08 147.8 32.65 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.32 -179.739 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 16.9 mmmt -66.68 116.91 8.12 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.575 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 188' ' ' CYS . . . . . 0.41 ' H ' ' H ' ' A' ' 189' ' ' LYS . 12.9 t -171.13 -5.34 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.573 179.868 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 189' ' ' LYS . . . . . 0.41 ' H ' ' H ' ' A' ' 188' ' ' CYS . 88.4 tttt -66.96 -34.41 77.7 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.627 -179.956 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 190' ' ' ASN . . . . . . . . . . . . . 36.1 m120 53.86 -108.31 0.42 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.495 -179.471 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 191' ' ' ASN . . . . . . . . . . . . . 21.2 m120 . . . . . 0 C--O 1.221 -0.43 0 CA-C-O 117.932 -1.032 . . . . 0.0 110.772 179.971 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 33.5 t . . . . . 0 N--CA 1.49 1.531 0 N-CA-C 109.368 -0.604 . . . . 0.0 109.368 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -65.98 -36.15 82.52 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.689 179.872 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -65.16 174.69 15.76 Favored Glycine 0 CA--C 1.525 0.661 0 N-CA-C 110.906 -0.878 . . . . 0.0 110.906 -179.767 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.423 ' H ' HD12 ' A' ' 27' ' ' LEU . 2.2 mp -70.71 165.21 23.48 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.82 0.343 . . . . 0.0 110.855 -179.711 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.523 ' OG1' ' N ' ' A' ' 29' ' ' GLY . 1.4 t -174.34 -173.33 0.76 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.432 -179.589 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . 0.583 ' C ' ' H ' ' A' ' 31' ' ' THR . . . 74.22 40.69 40.92 Favored Glycine 0 CA--C 1.519 0.319 0 N-CA-C 110.833 -0.907 . . . . 0.0 110.833 179.715 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.448 ' HB3' ' O ' ' A' ' 29' ' ' GLY . . . 68.48 -20.3 0.15 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.796 0.331 . . . . 0.0 110.583 -179.495 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.583 ' H ' ' C ' ' A' ' 29' ' ' GLY . 24.7 m -64.63 -30.29 71.3 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.351 -179.969 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 63.9 tttp -68.48 -50.7 50.44 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.807 179.973 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 65.0 mt -60.38 -42.48 91.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.361 -179.196 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 -56.35 -42.64 78.08 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.75 -179.517 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 26.8 mt -68.97 -34.18 74.9 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.55 0.214 . . . . 0.0 111.319 -179.147 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -64.93 -52.76 54.61 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.868 -179.43 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 50.3 ptt85 -71.81 -39.71 69.65 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.882 0.372 . . . . 0.0 110.799 -179.625 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 39.4 t -64.85 -39.25 93.27 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.965 -179.595 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -76.53 -34.0 58.56 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.1 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 64.8 tttm -66.36 -33.01 74.77 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.905 -179.623 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 39.7 m-20 -67.35 -27.04 66.8 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.821 -179.307 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 52.8 mt -61.47 -50.19 81.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 C-N-CA 120.885 -0.326 . . . . 0.0 110.846 -179.08 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 68.4 p -73.73 -36.5 65.2 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.801 0.334 . . . . 0.0 111.46 -178.294 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 85.7 m-20 -66.2 -35.09 79.54 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.561 -178.306 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 68.8 mm-40 -74.4 -57.77 3.73 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.933 0.397 . . . . 0.0 111.513 -178.935 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 6.7 pt -58.56 -23.14 22.12 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.637 -178.92 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -62.94 -39.24 94.01 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.072 0.463 . . . . 0.0 110.502 179.459 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -55.24 -22.5 18.33 Favored 'General case' 0 C--N 1.319 -0.728 0 C-N-CA 120.669 -0.412 . . . . 0.0 110.676 -179.924 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 81.4 mt -60.25 -52.72 58.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.462 -178.549 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 5.1 ptmm? -65.85 -30.92 71.61 Favored 'General case' 0 C--N 1.324 -0.542 0 C-N-CA 120.693 -0.403 . . . . 0.0 110.366 -179.167 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 37.7 ttmt -63.83 -47.72 79.69 Favored 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 120.756 -0.378 . . . . 0.0 110.227 179.859 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 95.1 m-20 -65.47 -33.3 75.6 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.17 179.816 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.427 ' O ' ' O ' ' A' ' 56' ' ' LYS . . . -64.01 -28.39 69.77 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.835 179.957 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -60.05 -32.51 70.99 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.891 -179.673 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 55.0 mt -56.84 -44.5 82.18 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.438 -179.216 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.427 ' O ' ' O ' ' A' ' 53' ' ' ALA . 74.2 mmtt -109.42 143.16 39.38 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-O 121.041 0.448 . . . . 0.0 110.501 -179.83 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -74.91 90.73 0.78 Allowed Glycine 0 CA--C 1.519 0.338 0 N-CA-C 110.447 -1.061 . . . . 0.0 110.447 -179.637 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 51.1 t -133.58 135.68 55.43 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.448 0 CA-C-O 120.823 0.344 . . . . 0.0 110.551 -179.861 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 19.9 p-10 -71.2 84.36 0.75 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.134 179.741 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 76.8 t80 -60.88 -47.92 84.17 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.741 -179.561 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 66.5 t0 -100.48 99.21 9.79 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.625 -179.839 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.5 ' O ' ' C ' ' A' ' 63' ' ' PHE . . . -150.37 -15.07 0.24 Allowed 'General case' 0 CA--C 1.512 -0.515 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.665 179.986 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . 0.5 ' C ' ' O ' ' A' ' 62' ' ' ALA . 89.3 m-85 -18.99 95.05 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.827 0 O-C-N 124.169 0.918 . . . . 0.0 111.158 -179.792 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 53.2 tptt -65.55 -81.84 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.739 -178.161 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 65.0 m-20 -156.05 -99.38 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.465 -179.583 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 13.9 mptt -68.36 135.95 52.61 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.899 0.381 . . . . 0.0 110.07 -179.447 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.452 ' O ' ' C ' ' A' ' 68' ' ' THR . 19.2 mmtp -91.79 -18.05 24.43 Favored 'General case' 0 CA--C 1.507 -0.695 0 CA-C-N 115.833 -0.622 . . . . 0.0 110.836 -179.85 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . 0.452 ' C ' ' O ' ' A' ' 67' ' ' LYS . 0.8 OUTLIER 28.11 58.86 0.11 Allowed 'General case' 0 N--CA 1.469 0.488 0 O-C-N 123.943 0.777 . . . . 0.0 110.91 179.819 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 108.71 176.65 21.73 Favored Glycine 0 N--CA 1.467 0.728 0 N-CA-C 110.342 -1.103 . . . . 0.0 110.342 -178.557 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 91.9 p -160.05 90.01 0.89 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.726 0.298 . . . . 0.0 110.509 -179.941 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -172.34 -55.51 0.04 OUTLIER Glycine 0 CA--C 1.522 0.496 0 N-CA-C 110.655 -0.978 . . . . 0.0 110.655 179.466 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.414 ' O ' ' OG ' ' A' ' 73' ' ' SER . 6.4 m -145.6 109.74 0.96 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.44 0 CA-C-O 121.029 0.442 . . . . 0.0 110.625 -179.533 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . 0.414 ' OG ' ' O ' ' A' ' 72' ' ' VAL . 1.9 m 172.88 -57.32 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.151 0.5 . . . . 0.0 110.085 179.553 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 99.6 mt-10 -88.37 -51.18 5.88 Favored 'General case' 0 CA--C 1.508 -0.651 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.244 -179.197 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . 0.469 ' ND2' HD12 ' A' ' 78' ' ' ILE . 2.0 p30 163.54 98.38 0.01 OUTLIER Pre-proline 0 CA--C 1.541 0.623 0 N-CA-C 109.41 -0.589 . . . . 0.0 109.41 -179.506 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 77.0 Cg_exo -43.79 -19.94 0.23 Allowed 'Trans proline' 0 N--CA 1.496 1.659 0 C-N-CA 122.505 2.137 . . . . 0.0 112.226 -179.46 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . 0.428 ' N ' ' O ' ' A' ' 75' ' ' ASN . 58.0 t80 -62.26 -52.78 62.36 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.632 -0.427 . . . . 0.0 110.711 -179.872 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . 0.469 HD12 ' ND2' ' A' ' 75' ' ' ASN . 94.4 mt -69.35 -46.16 77.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.427 179.819 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.479 ' O ' ' ND2' ' A' ' 171' ' ' ASN . 39.9 mt -55.57 -51.63 66.45 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.095 -178.442 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 95.6 mt-10 -63.49 -36.0 82.32 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.191 179.475 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -64.46 -40.43 95.7 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.499 179.967 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 33.9 ttmt -54.88 -19.37 6.45 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.088 0.471 . . . . 0.0 110.528 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 5.6 t -79.43 -44.65 23.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.818 179.943 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 84.7 mtp180 -62.96 -31.4 72.49 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.413 -179.672 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -67.32 -42.77 83.07 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.91 0.386 . . . . 0.0 111.274 -179.341 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 38.3 p -67.77 -21.51 65.25 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.245 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 24.5 m -59.0 -54.03 51.75 Favored 'General case' 0 C--N 1.323 -0.571 0 C-N-CA 120.506 -0.478 . . . . 0.0 111.027 -179.051 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 45.2 t -73.13 -49.18 40.12 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-O 121.057 0.456 . . . . 0.0 111.3 -179.445 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -57.18 -43.15 82.37 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.672 -178.896 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 7.1 tm-20 -56.28 -47.83 77.83 Favored 'General case' 0 C--N 1.317 -0.84 0 C-N-CA 120.404 -0.518 . . . . 0.0 110.718 -179.613 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 70.0 mmtt -59.0 -36.75 75.43 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.895 -178.97 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 87.7 t80 -56.99 -38.88 73.67 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.506 -179.926 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 49.0 t -58.03 -41.93 81.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-O 120.926 0.393 . . . . 0.0 110.173 -179.02 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 64.3 mt -54.51 -39.91 47.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.327 179.944 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -53.3 -45.32 68.93 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.631 -179.762 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.52 ' N ' HD12 ' A' ' 96' ' ' ILE . 1.6 mp -60.63 -44.37 96.76 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 116.311 -0.404 . . . . 0.0 109.986 -179.586 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 14.1 tm-20 -64.43 -49.36 71.81 Favored 'General case' 0 C--N 1.32 -0.71 0 C-N-CA 120.576 -0.45 . . . . 0.0 110.649 -178.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 83.0 tt0 -63.15 -46.48 86.99 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.58 -179.166 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 79.3 mm-40 -65.86 -35.13 79.81 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.743 -179.794 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -60.68 -41.63 95.49 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.57 -179.853 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 33.0 m -63.32 -49.07 75.43 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.643 -179.996 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 35.3 ttmt -69.32 -19.67 63.88 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.508 -179.924 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.481 ' O ' ' N ' ' A' ' 105' ' ' GLU . 41.1 tp -81.91 -16.72 49.62 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.433 -179.402 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 15.3 ttmm -66.25 62.7 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.815 0.34 . . . . 0.0 110.912 -179.088 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . 0.481 ' N ' ' O ' ' A' ' 103' ' ' LEU . 80.0 tt0 -113.12 -70.12 0.82 Allowed 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.676 -0.49 . . . . 0.0 109.676 179.926 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -89.88 -33.84 16.3 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.126 179.594 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 59.66 50.2 70.31 Favored Glycine 0 CA--C 1.526 0.764 0 N-CA-C 111.12 -0.792 . . . . 0.0 111.12 179.918 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . 0.432 ' OG ' ' N ' ' A' ' 109' ' ' SER . 95.5 p -56.63 -109.07 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.818 0.342 . . . . 0.0 110.516 -179.912 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . 0.432 ' N ' ' OG ' ' A' ' 108' ' ' SER . 54.4 p -171.39 -60.06 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.816 0.341 . . . . 0.0 110.507 179.839 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -62.55 -31.38 79.58 Favored Glycine 0 CA--C 1.521 0.425 0 N-CA-C 110.876 -0.89 . . . . 0.0 110.876 -179.961 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 44.9 tp10 -53.72 -45.61 70.52 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.864 0.364 . . . . 0.0 110.368 -179.544 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 65.1 m-85 -65.23 -41.17 94.65 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.575 -179.869 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 6.1 t -57.17 -33.28 67.27 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.499 -179.725 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -61.9 -35.89 79.69 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.452 -179.92 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 28.9 tpp -66.4 -47.65 72.61 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.958 0.409 . . . . 0.0 110.91 -179.871 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 37.1 t80 -51.12 -32.17 21.82 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.548 -179.542 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 63.6 t0 -60.05 -44.71 94.5 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.756 -179.889 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.472 ' N ' HD12 ' A' ' 118' ' ' LEU . 10.8 mp -58.33 -39.21 78.84 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.289 -0.414 . . . . 0.0 109.922 -179.222 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 13.4 tpt -61.84 -32.29 72.61 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.365 179.941 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . 0.566 ' CZ ' ' NZ ' ' A' ' 124' ' ' LYS . 14.6 t80 -77.42 -46.01 24.01 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.353 0.597 . . . . 0.0 111.035 -179.851 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -59.91 -42.46 93.92 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.699 -178.424 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 122' ' ' VAL . . . . . 0.432 ' O ' HD13 ' A' ' 126' ' ' LEU . 11.1 p -74.53 -25.86 19.62 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.385 0 CA-C-O 120.942 0.401 . . . . 0.0 110.687 -179.785 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 11.5 t -65.47 -21.08 66.6 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 116.611 -0.268 . . . . 0.0 111.193 179.912 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . 0.566 ' NZ ' ' CZ ' ' A' ' 120' ' ' PHE . 5.1 mptt -71.3 -59.31 3.33 Favored Pre-proline 0 C--N 1.324 -0.511 0 N-CA-C 112.139 0.422 . . . . 0.0 112.139 -178.906 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . 0.481 ' HD2' ' N ' ' A' ' 124' ' ' LYS . 18.6 Cg_endo -56.6 -32.01 88.84 Favored 'Trans proline' 0 C--N 1.309 -1.506 0 C-N-CA 122.204 1.936 . . . . 0.0 112.106 -178.036 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.432 HD13 ' O ' ' A' ' 122' ' ' VAL . 7.4 mp -60.98 -39.61 90.28 Favored 'General case' 0 CA--C 1.51 -0.57 0 CA-C-N 116.431 -0.349 . . . . 0.0 110.552 -179.839 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -44.69 -28.71 0.65 Allowed 'General case' 0 C--N 1.318 -0.791 0 CA-C-O 120.922 0.391 . . . . 0.0 110.923 179.858 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . 0.484 ' C ' HD22 ' A' ' 129' ' ' LEU . 97.9 mttt -64.99 -8.55 16.35 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.83 -179.399 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.49 ' N ' HD22 ' A' ' 129' ' ' LEU . 4.2 mm? -102.75 -10.35 19.24 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.604 -179.663 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 83.65 17.61 65.64 Favored Glycine 0 CA--C 1.52 0.381 0 N-CA-C 110.438 -1.065 . . . . 0.0 110.438 179.684 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 131' ' ' ILE . . . . . 0.72 ' O ' HG22 ' A' ' 131' ' ' ILE . 81.4 mt -77.82 15.36 0.25 Allowed 'Isoleucine or valine' 0 CA--C 1.518 -0.27 0 N-CA-C 110.038 -0.356 . . . . 0.0 110.038 -179.835 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . 0.531 ' C ' ' O ' ' A' ' 131' ' ' ILE . 59.1 tt0 -25.84 122.9 0.07 Allowed 'General case' 0 CA--C 1.507 -0.694 0 CA-C-O 118.941 -0.552 . . . . 0.0 109.666 179.968 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 133' ' ' GLU . . . . . 0.503 ' CB ' ' O ' ' A' ' 132' ' ' GLN . 8.6 mm-40 148.22 -21.95 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.201 0 O-C-N 124.677 1.236 . . . . 0.0 110.343 -178.858 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 134' ' ' MET . . . . . 0.502 ' O ' HG12 ' A' ' 138' ' ' VAL . 24.6 mmt -62.01 -61.92 2.15 Favored 'General case' 0 C--N 1.319 -0.724 0 C-N-CA 120.849 -0.341 . . . . 0.0 111.138 -178.378 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 71.4 p -56.96 -30.38 64.02 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.834 -178.799 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 50.8 mtmt -82.69 -52.81 6.44 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.347 -179.745 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 137' ' ' THR . . . . . 0.42 ' CG2' ' NZ ' ' A' ' 159' ' ' LYS . 30.2 m -60.57 -46.12 91.41 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.857 -179.023 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 138' ' ' VAL . . . . . 0.502 HG12 ' O ' ' A' ' 134' ' ' MET . 9.0 p -61.4 -40.61 86.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-O 121.051 0.453 . . . . 0.0 110.68 -178.92 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . 0.45 ' N ' HG13 ' A' ' 138' ' ' VAL . 23.7 t -72.5 -36.37 68.36 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.648 -179.841 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 84.7 m-20 -64.74 -30.18 71.18 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.64 -179.589 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -74.97 -28.23 60.49 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.81 -179.924 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -64.57 -34.09 77.44 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.114 -179.283 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 94.9 mt-10 -70.8 -36.91 73.22 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.743 0.306 . . . . 0.0 110.834 -179.422 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 47.6 tp10 -74.05 -43.49 57.64 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.012 -179.475 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 145' ' ' ASN . . . . . . . . . . . . . 70.3 m-80 -144.28 82.68 10.53 Favored Pre-proline 0 N--CA 1.466 0.349 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.197 -179.53 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 146' ' ' PRO . . . . . 0.456 ' O ' ' N ' ' A' ' 148' ' ' THR . 24.4 Cg_endo -61.02 113.05 1.56 Allowed 'Trans proline' 0 N--CA 1.493 1.446 0 C-N-CA 122.394 2.063 . . . . 0.0 111.694 -178.846 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 147' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_exo -45.79 87.61 0.02 OUTLIER 'Trans proline' 0 N--CA 1.493 1.489 0 C-N-CA 122.397 2.065 . . . . 0.0 112.786 -179.364 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 148' ' ' THR . . . . . 0.456 ' N ' ' O ' ' A' ' 146' ' ' PRO . 31.2 m -111.56 -15.43 13.5 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.335 179.284 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 149' ' ' THR . . . . . 0.634 HG22 ' N ' ' A' ' 150' ' ' ALA . 30.8 m -138.8 172.27 13.11 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.639 179.845 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 150' ' ' ALA . . . . . 0.634 ' N ' HG22 ' A' ' 149' ' ' THR . . . -58.88 -47.72 83.95 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.304 179.986 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 76.4 mt-30 -62.76 -29.61 70.82 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.021 0.439 . . . . 0.0 110.394 -179.851 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . -58.38 -42.28 95.59 Favored Glycine 0 CA--C 1.524 0.6 0 N-CA-C 110.691 -0.964 . . . . 0.0 110.691 179.792 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 153' ' ' VAL . . . . . . . . . . . . . 47.3 t -67.67 -41.48 85.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-O 120.834 0.349 . . . . 0.0 110.505 -179.986 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 8.4 mp -50.95 -38.51 51.02 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.256 -179.374 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -60.96 -47.57 85.83 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 179.12 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 156' ' ' ILE . . . . . 0.809 HG22 ' SD ' ' A' ' 160' ' ' MET . 15.3 mm -65.36 -43.57 94.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.034 -179.777 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -53.03 -51.46 61.66 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.247 179.923 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -62.58 -43.99 97.42 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.164 179.495 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 159' ' ' LYS . . . . . 0.42 ' NZ ' ' CG2' ' A' ' 137' ' ' THR . 63.2 tttm -65.11 -29.77 70.66 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.371 179.945 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 160' ' ' MET . . . . . 0.809 ' SD ' HG22 ' A' ' 156' ' ' ILE . 5.4 mtp -71.01 -53.27 15.36 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.48 -179.49 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 73.5 ttt-85 -67.8 -35.65 79.03 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.473 179.847 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 80.1 tt0 -66.97 -47.87 70.25 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.817 -179.08 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 163' ' ' LYS . . . . . 0.42 ' HZ1' ' HB3' ' A' ' 133' ' ' GLU . 1.2 tmtp? -65.97 -33.97 77.02 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.18 -179.394 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 5.8 mt -70.28 -26.61 63.89 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.657 179.942 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 46.5 tp60 -67.21 -35.73 80.22 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.472 -179.155 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 166' ' ' ARG . . . . . 0.535 HH22 ' ND2' ' A' ' 190' ' ' ASN . 10.7 tpt180 -62.49 -28.49 69.86 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.37 0.605 . . . . 0.0 110.575 -179.187 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 167' ' ' VAL . . . . . . . . . . . . . 48.3 t -68.18 -44.01 84.52 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 CA-C-N 115.242 -0.89 . . . . 0.0 110.39 -179.708 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 168' ' ' HIS . . . . . 0.503 ' O ' ' ND1' ' A' ' 168' ' ' HIS . 20.6 t-80 -78.15 -28.83 48.44 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.636 -179.967 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 169' ' ' THR . . . . . . . . . . . . . 23.7 m -73.2 -46.68 49.06 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.301 -0.408 . . . . 0.0 111.156 -179.697 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -58.83 -43.86 90.79 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.555 -179.077 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 171' ' ' ASN . . . . . 0.479 ' ND2' ' O ' ' A' ' 79' ' ' LEU . 20.1 t-20 -72.03 -33.11 67.76 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.62 179.916 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 172' ' ' TYR . . . . . . . . . . . . . 80.7 t80 -75.18 -29.33 60.36 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.786 -179.629 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 173' ' ' CYS . . . . . . . . . . . . . 11.5 t -74.35 -34.55 63.42 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.046 -179.511 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 26.2 p -73.04 -35.68 66.77 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.967 -179.268 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 87.0 mt -77.72 -53.1 7.93 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.521 -178.843 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 16.2 ptmt -56.24 -21.72 25.28 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 121.183 0.516 . . . . 0.0 110.37 -179.265 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 177' ' ' LYS . . . . . . . . . . . . . 56.2 tttp -66.38 -13.67 60.98 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.236 -179.966 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 178' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -81.23 -15.31 56.0 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.857 -179.922 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -55.37 -44.36 75.95 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.505 -179.89 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 180' ' ' ASN . . . . . . . . . . . . . 13.4 m120 -99.18 -84.64 0.4 Allowed 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.095 179.373 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 181' ' ' SER . . . . . 0.524 ' OG ' ' N ' ' A' ' 182' ' ' THR . 2.4 t 171.9 -101.55 0.0 OUTLIER 'General case' 0 C--N 1.333 -0.132 0 N-CA-C 109.974 -0.38 . . . . 0.0 109.974 179.846 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 182' ' ' THR . . . . . 0.524 ' N ' ' OG ' ' A' ' 181' ' ' SER . 68.2 p -150.03 39.43 0.77 Allowed 'General case' 0 N--CA 1.462 0.159 0 CA-C-O 120.868 0.366 . . . . 0.0 110.399 -179.486 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 183' ' ' PHE . . . . . 0.485 ' CD1' ' N ' ' A' ' 184' ' ' THR . 23.0 t80 -55.32 152.99 7.66 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.285 -179.746 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 184' ' ' THR . . . . . 0.485 ' N ' ' CD1' ' A' ' 183' ' ' PHE . 5.6 m -70.46 60.48 0.21 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.713 -179.8 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 185' ' ' ASP . . . . . . . . . . . . . 59.2 m-20 -159.21 -66.21 0.08 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.943 0.401 . . . . 0.0 110.394 179.985 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 186' ' ' GLU . . . . . 0.402 ' HG2' ' H ' ' A' ' 186' ' ' GLU . 5.3 pt-20 -65.14 122.48 17.18 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.59 -179.716 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 7.0 mtpm? -144.91 11.62 1.4 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.497 179.877 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 188' ' ' CYS . . . . . . . . . . . . . 12.0 t 56.05 37.3 28.7 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.567 179.793 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 189' ' ' LYS . . . . . . . . . . . . . 63.5 tttm -69.08 136.31 52.11 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.405 -179.843 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 190' ' ' ASN . . . . . 0.535 ' ND2' HH22 ' A' ' 166' ' ' ARG . 22.1 t-20 -68.07 140.88 56.27 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.553 179.899 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 191' ' ' ASN . . . . . . . . . . . . . 90.5 m-20 . . . . . 0 C--O 1.22 -0.471 0 CA-C-O 117.979 -1.01 . . . . 0.0 110.512 -179.973 . . . . . . . . 0 0 . 1 stop_ save_