data_2n3h_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 2n3h _Structure_validation_residue.Date_analyzed 2016-10-08 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . 0.503 ' C ' ' H ' ' A' ' 84' ' ' LYS . . . . . . . . 0 N--CA 1.453 -0.296 0 CA-C-O 120.795 0.331 . . . . 0.0 110.548 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 1.9 m-85 -45.41 -16.37 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.336 179.887 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . 0.503 ' H ' ' C ' ' A' ' 82' ' ' ALA . 67.8 mttm -64.41 -40.13 95.18 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.11 179.677 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 13.6 m120 -66.08 -47.47 74.13 Favored 'General case' 0 N--CA 1.457 -0.098 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.485 -179.658 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 6.5 tt -60.95 -42.06 97.49 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.549 -179.319 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 34.7 mt -55.78 -37.32 68.42 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.062 -179.576 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 86.6 mt-30 -71.32 -36.69 71.68 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.981 0.419 . . . . 0.0 110.511 179.577 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 70.6 mm-40 -59.63 -49.26 78.44 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.994 -179.222 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 30.3 pt -64.29 -32.3 56.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.637 179.576 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -55.85 -49.3 73.69 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.178 -179.404 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 59.4 tt0 -67.14 -49.76 63.71 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.914 -179.683 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 65.4 tttm -58.95 -50.78 72.78 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.534 -179.335 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . 0.467 ' O ' ' CB ' ' A' ' 95' ' ' SER . 97.6 mt-10 -69.95 -15.76 63.1 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.6 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' SER . . . . . 0.467 ' CB ' ' O ' ' A' ' 94' ' ' GLU . 0.7 OUTLIER 79.17 9.91 1.64 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.433 -179.731 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 20.7 m -77.61 162.86 26.74 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.531 -179.793 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . 0.473 ' N ' ' CD1' ' A' ' 97' ' ' LEU . 9.7 mp -70.22 127.49 32.97 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.683 -179.959 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . 0.441 ' H ' ' CD1' ' A' ' 98' ' ' LEU . 10.1 mp -45.31 120.58 4.7 Favored Pre-proline 0 N--CA 1.452 -0.358 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.488 179.756 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -49.34 149.02 9.81 Favored 'Trans proline' 0 C--N 1.308 -1.563 0 C-N-CA 122.941 2.428 . . . . 0.0 112.866 179.404 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 85.1 t80 -130.73 133.48 46.08 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-O 121.119 0.485 . . . . 0.0 110.598 -179.32 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 88.2 m-85 -96.41 143.74 27.17 Favored 'General case' 0 N--CA 1.463 0.182 0 C-N-CA 120.745 -0.382 . . . . 0.0 111.251 -179.346 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -146.41 147.58 31.42 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.999 0.428 . . . . 0.0 110.93 -179.698 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -133.55 143.31 48.63 Favored 'General case' 0 CA--C 1.516 -0.348 0 CA-C-O 120.82 0.343 . . . . 0.0 110.463 179.594 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -120.68 146.83 46.03 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 120.882 0.373 . . . . 0.0 110.342 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 21.1 p -115.4 126.96 55.03 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.51 179.767 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 47.6 t -165.46 156.2 13.71 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.58 179.879 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 127.83 166.06 11.98 Favored Glycine 0 CA--C 1.524 0.602 0 N-CA-C 111.208 -0.757 . . . . 0.0 111.208 179.678 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 29.1 Cg_endo -61.46 152.45 72.95 Favored 'Trans proline' 0 C--N 1.301 -1.957 0 C-N-CA 122.736 2.29 . . . . 0.0 112.467 179.67 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 78.1 p -64.27 -19.65 65.54 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.279 179.509 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 70.0 m80 -90.03 -38.73 13.39 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.298 179.699 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -125.21 79.0 66.61 Favored Pre-proline 0 C--O 1.234 0.268 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.216 179.581 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -76.33 158.11 37.04 Favored 'Trans proline' 0 C--N 1.3 -2.007 0 C-N-CA 122.883 2.388 . . . . 0.0 112.111 179.657 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 25.2 p -156.48 150.96 25.57 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.612 179.648 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -133.91 147.34 51.09 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.375 179.941 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 92.3 m -129.79 124.72 34.05 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.368 179.567 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 11.2 t -99.57 125.93 45.46 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.246 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 81.2 m -122.95 136.21 54.78 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.661 -179.527 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 12.3 p -114.83 147.89 17.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 120.962 0.41 . . . . 0.0 110.322 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 85.2 tt0 -127.23 134.32 50.11 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.415 -179.9 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . 0.623 ' CZ ' ' CE1' ' A' ' 125' ' ' PHE . 49.6 p90 -167.84 159.95 12.0 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.336 179.431 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 54.25 20.7 2.74 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.485 179.462 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 75.62 22.37 75.27 Favored Glycine 0 CA--C 1.522 0.526 0 N-CA-C 110.767 -0.933 . . . . 0.0 110.767 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -131.94 152.5 51.04 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-O 120.876 0.369 . . . . 0.0 110.567 179.839 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 7.4 p -120.35 126.61 75.45 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.289 0 CA-C-O 120.916 0.388 . . . . 0.0 110.532 -179.907 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 125' ' ' PHE . . . . . 0.623 ' CE1' ' CZ ' ' A' ' 120' ' ' PHE . 35.6 m-85 -111.42 120.01 40.73 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.294 -0.412 . . . . 0.0 109.913 179.623 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 5.2 p -83.35 137.75 33.82 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.498 -179.777 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -84.71 -168.87 45.06 Favored Glycine 0 CA--C 1.521 0.423 0 N-CA-C 110.618 -0.993 . . . . 0.0 110.618 179.908 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . 0.542 ' H ' ' CB ' ' A' ' 139' ' ' SER . 8.4 pt-20 -98.68 132.97 43.65 Favored 'General case' 0 C--N 1.33 -0.266 0 O-C-N 122.701 -0.293 . . . . 0.0 110.699 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -54.13 144.71 18.96 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.224 179.258 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -169.76 159.92 8.36 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.319 -179.729 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 25.7 pttm -90.9 33.65 0.93 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.527 179.702 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 3.4 t -158.05 149.35 21.24 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.586 -179.612 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -79.65 -32.76 41.63 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.213 179.579 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -59.17 -52.97 63.43 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.005 -178.893 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 4.0 tp -65.32 -40.2 93.43 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.292 -179.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 136' ' ' ALA . . . . . 0.455 ' O ' ' OG ' ' A' ' 139' ' ' SER . . . -56.35 -54.91 39.97 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.357 -179.597 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -57.92 -39.93 79.18 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.515 -179.83 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 50.7 ttp -63.47 -41.52 98.6 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.767 -179.753 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 139' ' ' SER . . . . . 0.542 ' CB ' ' H ' ' A' ' 128' ' ' GLU . 78.0 p -63.95 -35.73 81.66 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.777 -179.53 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . 0.416 ' N ' ' HG ' ' A' ' 139' ' ' SER . . . -67.64 -47.03 70.73 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.785 -179.991 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -71.24 -25.47 62.5 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.93 179.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -70.94 -49.36 46.44 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.184 179.832 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 8.3 p -68.39 -40.05 81.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.885 -179.8 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -62.21 -46.3 89.48 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.941 -179.471 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 145' ' ' PHE . . . . . . . . . . . . . 74.9 t80 -60.26 -42.08 94.58 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.925 0.393 . . . . 0.0 110.621 179.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 146' ' ' MET . . . . . . . . . . . . . 33.5 ttm -62.37 -39.58 93.65 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.044 -179.829 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 35.9 t -68.66 -43.45 76.16 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.99 -179.783 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 148' ' ' ILE . . . . . . . . . . . . . 85.4 mt -56.98 -29.94 32.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.796 -179.598 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 25.0 mtpp . . . . . 0 C--N 1.325 -0.483 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.766 -179.944 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . 0.522 ' C ' ' H ' ' A' ' 84' ' ' LYS . . . . . . . . 0 N--CA 1.451 -0.422 0 CA-C-O 121.166 0.508 . . . . 0.0 110.332 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 3.0 m-85 -47.43 -15.5 0.05 OUTLIER 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.788 -0.642 . . . . 0.0 109.766 179.452 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . 0.522 ' H ' ' C ' ' A' ' 82' ' ' ALA . 99.4 mttt -63.74 -39.95 95.52 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.05 179.795 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . 0.416 ' OD1' ' OE2' ' A' ' 89' ' ' GLU . 24.6 t-20 -66.19 -46.5 77.1 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.675 -0.693 . . . . 0.0 111.049 -179.689 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 6.0 tt -60.54 -42.64 96.94 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.677 -179.547 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 56.9 mt -56.22 -35.06 66.91 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.117 179.794 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 88.6 mt-30 -74.68 -37.46 62.67 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.08 179.26 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . 0.416 ' OE2' ' OD1' ' A' ' 85' ' ' ASN . 97.6 mt-10 -63.32 -50.34 70.43 Favored 'General case' 0 C--O 1.232 0.142 0 C-N-CA 120.776 -0.369 . . . . 0.0 111.415 -179.173 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 2.2 pp -66.21 -41.73 89.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.304 179.78 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -57.18 -48.7 78.07 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.527 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 88.6 mt-30 -71.8 -41.33 68.4 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.802 179.779 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . 0.4 ' C ' ' H ' ' A' ' 95' ' ' SER . 88.9 tttt -60.88 -49.27 78.13 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.551 -179.576 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . 0.464 ' C ' ' H ' ' A' ' 96' ' ' SER . 98.0 mt-10 -75.95 9.21 2.55 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.379 179.947 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' SER . . . . . 0.436 ' O ' ' O ' ' A' ' 96' ' ' SER . 13.9 t 55.06 9.03 0.28 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.571 179.955 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' SER . . . . . 0.464 ' H ' ' C ' ' A' ' 94' ' ' GLU . 5.4 t -59.89 -130.82 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.226 179.724 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 92.3 mt -134.85 124.73 25.51 Favored 'General case' 0 CA--C 1.515 -0.388 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.588 179.895 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . 0.445 ' H ' ' CD1' ' A' ' 98' ' ' LEU . 10.7 mp -44.94 151.29 0.65 Allowed Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.439 -179.385 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_endo -66.88 170.88 11.96 Favored 'Trans proline' 0 C--N 1.308 -1.559 0 C-N-CA 122.836 2.357 . . . . 0.0 111.931 -179.896 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 32.8 t80 -143.82 114.76 7.79 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.178 179.246 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 97.7 m-85 -96.2 129.93 43.39 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.933 0.397 . . . . 0.0 110.253 -179.948 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -147.44 147.86 30.66 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.427 -179.81 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 1.5 t -136.3 146.16 46.31 Favored 'General case' 0 CA--C 1.518 -0.252 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.563 179.866 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -121.35 146.17 47.13 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.156 179.935 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 12.1 p -114.64 126.2 54.62 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-O 120.978 0.418 . . . . 0.0 110.39 179.839 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 52.8 p -160.72 164.17 31.83 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.275 179.817 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 119.64 163.8 12.41 Favored Glycine 0 CA--C 1.525 0.698 0 N-CA-C 111.005 -0.838 . . . . 0.0 111.005 179.681 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 22.4 Cg_endo -61.15 151.75 76.6 Favored 'Trans proline' 0 C--N 1.304 -1.811 0 C-N-CA 122.938 2.425 . . . . 0.0 112.127 179.537 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 38.8 t -62.94 -19.35 64.17 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.209 179.193 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 58.3 m170 -89.39 -44.09 10.43 Favored 'General case' 0 CA--C 1.517 -0.301 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.499 179.91 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -124.56 77.56 63.21 Favored Pre-proline 0 N--CA 1.467 0.387 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.156 179.244 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -77.33 165.09 28.15 Favored 'Trans proline' 0 C--N 1.306 -1.672 0 C-N-CA 122.661 2.24 . . . . 0.0 112.367 -179.694 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 38.8 p -156.17 151.4 26.6 Favored 'General case' 0 CA--C 1.516 -0.352 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.314 179.929 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -132.49 145.79 51.44 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.442 -179.853 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 88.7 m -133.45 128.15 34.84 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.184 -0.462 . . . . 0.0 109.991 179.63 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 27.6 t -102.19 129.76 48.66 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.471 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 65.4 m -119.09 132.63 56.03 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.032 -179.908 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 12.8 p -113.64 146.15 18.6 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.214 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.104 -179.597 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 81.2 tt0 -131.07 139.2 49.86 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.724 179.929 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . 0.626 ' CZ ' ' CE1' ' A' ' 125' ' ' PHE . 52.4 p90 -168.89 160.26 10.09 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.576 179.739 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 51.87 22.42 1.74 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.992 0.425 . . . . 0.0 110.683 179.697 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 75.88 22.74 73.82 Favored Glycine 0 CA--C 1.524 0.65 0 N-CA-C 111.132 -0.787 . . . . 0.0 111.132 179.825 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -132.19 151.02 52.02 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 110.089 -0.337 . . . . 0.0 110.089 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 6.5 p -118.23 125.06 73.99 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.225 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.93 -179.644 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 125' ' ' PHE . . . . . 0.626 ' CE1' ' CZ ' ' A' ' 120' ' ' PHE . 63.0 m-85 -110.14 117.53 33.96 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 116.185 -0.461 . . . . 0.0 109.888 179.903 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 6.0 p -80.6 132.12 35.59 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.503 -179.909 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -84.69 -167.64 43.24 Favored Glycine 0 CA--C 1.52 0.391 0 N-CA-C 110.614 -0.995 . . . . 0.0 110.614 179.689 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 4.6 pt-20 -90.77 -178.6 5.3 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.835 0.35 . . . . 0.0 110.182 -179.905 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 129' ' ' GLU . . . . . 0.539 ' N ' ' OE1' ' A' ' 129' ' ' GLU . 55.1 mp0 -110.8 145.7 37.69 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.235 178.995 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -170.24 163.35 8.91 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.689 -179.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 62.1 mttp -85.83 35.31 0.62 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.37 179.354 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 7.5 t -157.54 150.54 23.32 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.676 179.887 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 63.2 mttp -82.06 -34.73 29.3 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.824 179.398 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . 0.405 ' N ' ' CD ' ' A' ' 134' ' ' LYS . 13.6 mptt -56.66 -54.34 47.18 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.84 -178.789 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 11.6 tp -63.34 -38.43 91.12 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.559 -179.696 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -58.13 -54.48 46.51 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.808 -179.574 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 81.1 mm-40 -58.75 -42.74 89.59 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.797 0.332 . . . . 0.0 110.403 -179.674 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 26.1 ttm -61.48 -41.41 97.21 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.664 179.882 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 15.7 m -58.81 -39.93 82.6 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.786 -179.699 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -64.88 -42.23 95.0 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.93 0.395 . . . . 0.0 111.046 -179.897 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -69.66 -28.81 66.2 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.95 179.97 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 85.5 mttt -71.73 -49.79 36.09 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.79 179.694 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 7.3 p -67.34 -42.52 87.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.737 -179.581 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -63.16 -46.47 87.04 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.901 -179.81 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 145' ' ' PHE . . . . . . . . . . . . . 69.6 t80 -60.21 -42.69 95.68 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.534 -179.757 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 146' ' ' MET . . . . . . . . . . . . . 54.6 ttp -61.43 -37.57 84.01 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.631 -179.487 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 37.6 t -71.29 -44.28 65.48 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.962 0.41 . . . . 0.0 111.133 179.858 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 148' ' ' ILE . . . . . . . . . . . . . 90.6 mt -55.95 -30.44 28.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.525 -179.752 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 53.3 mtpt . . . . . 0 C--N 1.323 -0.55 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.789 179.888 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . 0.512 ' C ' ' H ' ' A' ' 84' ' ' LYS . . . . . . . . 0 N--CA 1.447 -0.589 0 CA-C-O 121.253 0.549 . . . . 0.0 110.187 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 2.2 m-85 -46.46 -16.09 0.03 OUTLIER 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 115.845 -0.616 . . . . 0.0 109.929 179.633 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . 0.512 ' H ' ' C ' ' A' ' 82' ' ' ALA . 68.4 mttm -63.9 -39.74 94.89 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.089 179.67 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 45.2 t30 -66.58 -47.07 73.92 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.679 -179.838 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 7.0 tt -61.76 -41.34 97.56 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.812 -179.905 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 32.3 mt -55.79 -36.24 67.18 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.139 -0.482 . . . . 0.0 109.856 -179.527 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 90.5 mt-30 -72.29 -36.05 68.85 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.294 179.29 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 70.3 mm-40 -60.34 -47.3 86.64 Favored 'General case' 0 C--O 1.233 0.216 0 C-N-CA 120.779 -0.368 . . . . 0.0 111.043 -179.131 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 28.0 pt -65.08 -32.89 60.23 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.499 179.869 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -55.49 -49.28 72.95 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.541 -179.604 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 90.4 mm-40 -67.92 -49.46 61.74 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.301 -0.408 . . . . 0.0 111.116 179.798 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -58.88 -51.25 70.85 Favored 'General case' 0 C--N 1.331 -0.203 0 C-N-CA 120.702 -0.399 . . . . 0.0 110.786 -179.379 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . 0.406 ' O ' ' CB ' ' A' ' 95' ' ' SER . 80.4 mm-40 -68.97 -13.75 62.64 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.666 179.748 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' SER . . . . . 0.406 ' CB ' ' O ' ' A' ' 94' ' ' GLU . 1.0 OUTLIER 75.45 10.37 3.52 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.287 -179.861 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 8.6 p -79.71 166.2 22.04 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.659 -179.518 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 70.3 mt -72.7 133.8 44.76 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.932 0.396 . . . . 0.0 110.739 -179.706 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 11.0 mp -44.81 152.92 0.51 Allowed Pre-proline 0 C--N 1.327 -0.405 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.71 -179.651 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_endo -61.17 170.0 5.55 Favored 'Trans proline' 0 N--CA 1.496 1.654 0 C-N-CA 122.847 2.365 . . . . 0.0 111.889 179.964 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 42.6 t80 -145.9 117.92 8.28 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.454 179.172 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' TYR . . . . . 0.471 ' CE2' ' NZ ' ' A' ' 84' ' ' LYS . 96.9 m-85 -102.79 136.62 42.28 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.898 0.38 . . . . 0.0 110.349 179.949 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -145.98 146.68 31.1 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.455 -179.803 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 92.2 m -124.31 130.86 53.25 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.314 179.926 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -111.35 139.8 46.45 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.529 -0.305 . . . . 0.0 110.224 179.825 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 22.7 p -117.22 122.71 44.76 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-O 121.019 0.438 . . . . 0.0 110.803 179.499 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 51.8 p -162.52 162.6 27.45 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.325 179.893 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 126.4 165.45 11.99 Favored Glycine 0 CA--C 1.523 0.54 0 N-CA-C 111.118 -0.793 . . . . 0.0 111.118 179.511 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -60.54 150.9 79.1 Favored 'Trans proline' 0 C--N 1.304 -1.796 0 C-N-CA 122.787 2.325 . . . . 0.0 112.036 179.378 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 99.0 p -63.2 -16.74 61.1 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.416 179.379 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 84.6 t60 -92.66 -43.4 9.11 Favored 'General case' 0 CA--C 1.519 -0.23 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.627 179.759 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -124.24 78.16 60.45 Favored Pre-proline 0 CA--C 1.531 0.219 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.527 179.807 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 70.2 Cg_endo -76.43 163.22 32.49 Favored 'Trans proline' 0 C--N 1.305 -1.718 0 C-N-CA 122.669 2.246 . . . . 0.0 112.192 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 31.0 p -156.61 151.32 25.81 Favored 'General case' 0 CA--C 1.514 -0.431 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.132 179.375 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -131.27 144.52 51.35 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.022 -0.535 . . . . 0.0 109.734 -179.801 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 115' ' ' THR . . . . . 0.424 ' OG1' ' OE1' ' A' ' 129' ' ' GLU . 72.4 m -130.33 125.5 34.84 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.932 0.396 . . . . 0.0 110.16 179.822 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 11.7 t -96.94 122.4 39.88 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.018 179.779 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 52.2 m -114.24 130.62 56.64 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.131 179.911 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 10.8 p -113.33 143.51 22.88 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.234 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.908 -179.953 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 80.9 tt0 -128.05 135.32 49.7 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.64 179.957 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . 0.622 ' CZ ' ' CE1' ' A' ' 125' ' ' PHE . 52.6 p90 -167.26 158.5 11.93 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.5 179.709 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 54.64 21.56 3.51 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.857 0.361 . . . . 0.0 110.594 179.587 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 76.0 22.59 73.81 Favored Glycine 0 CA--C 1.521 0.468 0 N-CA-C 110.869 -0.893 . . . . 0.0 110.869 179.927 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -132.34 151.99 51.61 Favored 'General case' 0 C--N 1.328 -0.338 0 O-C-N 122.768 -0.254 . . . . 0.0 110.413 -179.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 7.1 p -121.34 127.77 75.8 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.555 -179.782 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 125' ' ' PHE . . . . . 0.622 ' CE1' ' CZ ' ' A' ' 120' ' ' PHE . 24.1 m-85 -113.11 120.3 40.81 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.163 179.782 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 84.4 p -81.21 136.07 35.81 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.544 179.895 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -83.82 -169.89 45.79 Favored Glycine 0 CA--C 1.524 0.629 0 N-CA-C 110.689 -0.964 . . . . 0.0 110.689 179.806 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . 0.431 ' H ' ' CB ' ' A' ' 139' ' ' SER . 12.2 tt0 -99.1 134.18 42.31 Favored 'General case' 0 N--CA 1.448 -0.525 0 CA-C-O 121.014 0.435 . . . . 0.0 110.715 179.596 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 129' ' ' GLU . . . . . 0.424 ' OE1' ' OG1' ' A' ' 115' ' ' THR . 70.4 mm-40 -56.06 146.05 23.9 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.385 179.109 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -169.5 159.95 8.82 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.517 -179.936 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 52.4 mtpt -88.97 33.07 0.79 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.63 179.462 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 132' ' ' THR . . . . . 0.544 ' HG1' ' H ' ' A' ' 134' ' ' LYS . 3.6 t -158.49 150.17 21.18 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.688 179.835 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 55.8 mtmt -82.58 -21.44 35.24 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.785 179.364 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . 0.544 ' H ' ' HG1' ' A' ' 132' ' ' THR . 59.5 mttp -69.59 -53.95 16.39 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.788 -179.447 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 4.1 tp -64.3 -40.24 95.54 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-O 120.789 0.328 . . . . 0.0 111.002 -179.796 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -57.29 -54.29 48.41 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.355 -179.111 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 75.8 mm-40 -56.51 -40.87 75.73 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.854 0.359 . . . . 0.0 110.512 -179.869 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 51.8 mtt -62.99 -41.39 99.55 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.967 -179.616 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 139' ' ' SER . . . . . 0.431 ' CB ' ' H ' ' A' ' 128' ' ' GLU . 68.7 m -62.92 -40.74 98.51 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 121.04 -0.264 . . . . 0.0 111.19 -179.95 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -62.37 -45.82 91.44 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.102 0.477 . . . . 0.0 110.59 -179.583 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -69.83 -25.49 63.77 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.936 179.991 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 142' ' ' LYS . . . . . 0.513 ' O ' ' SD ' ' A' ' 146' ' ' MET . 37.5 ttpt -71.43 -49.72 38.88 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.042 0.449 . . . . 0.0 111.597 -179.992 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 7.6 p -67.33 -39.62 83.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.067 -179.693 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 144' ' ' ALA . . . . . 0.436 ' O ' ' OG ' ' A' ' 147' ' ' SER . . . -63.28 -46.48 86.62 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-N 116.339 -0.392 . . . . 0.0 111.079 -179.098 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 145' ' ' PHE . . . . . . . . . . . . . 65.6 t80 -59.84 -42.28 93.24 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.484 -0.325 . . . . 0.0 110.573 -179.71 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 146' ' ' MET . . . . . 0.581 ' SD ' ' N ' ' A' ' 146' ' ' MET . 0.0 OUTLIER -63.07 -39.34 94.44 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.764 -179.601 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 147' ' ' SER . . . . . 0.487 ' HG ' ' N ' ' A' ' 148' ' ' ILE . 72.8 p -67.76 -42.1 82.29 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.989 -179.858 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 148' ' ' ILE . . . . . 0.487 ' N ' ' HG ' ' A' ' 147' ' ' SER . 93.3 mt -59.05 -30.85 44.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.78 -179.675 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 54.9 mtpt . . . . . 0 C--N 1.328 -0.344 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.802 -179.996 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . 0.501 ' C ' ' H ' ' A' ' 84' ' ' LYS . . . . . . . . 0 N--CA 1.45 -0.44 0 CA-C-O 121.118 0.485 . . . . 0.0 109.723 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -47.58 -16.35 0.06 Allowed 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.526 -0.761 . . . . 0.0 109.761 179.792 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . 0.501 ' H ' ' C ' ' A' ' 82' ' ' ALA . 51.9 mtmt -63.73 -41.08 98.11 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.027 179.843 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 34.1 t30 -64.68 -47.91 76.65 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.934 -179.517 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 6.3 tt -61.92 -39.69 92.93 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.885 -179.684 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 29.9 mt -56.75 -38.71 72.8 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 -179.628 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 84.5 mt-30 -68.96 -36.2 77.64 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.682 179.214 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 80.7 mm-40 -61.74 -48.14 82.04 Favored 'General case' 0 C--O 1.232 0.154 0 C-N-CA 120.67 -0.412 . . . . 0.0 111.355 -179.066 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 27.2 pt -65.0 -35.15 74.79 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.501 179.804 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -58.83 -49.88 76.07 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.687 -179.516 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 68.4 tp60 -66.77 -47.33 72.51 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.992 -179.738 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -61.48 -47.83 83.85 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.607 -179.31 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . 0.432 ' O ' ' CB ' ' A' ' 95' ' ' SER . 80.3 mm-40 -71.68 -14.42 62.03 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.575 179.806 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' SER . . . . . 0.432 ' CB ' ' O ' ' A' ' 94' ' ' GLU . 0.7 OUTLIER 78.94 9.11 1.85 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.383 -179.996 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 17.5 m -77.81 164.39 25.25 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.504 179.918 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 69.2 mt -69.68 129.24 39.07 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.495 -179.654 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . 0.425 ' N ' ' CD1' ' A' ' 98' ' ' LEU . 10.3 mp -45.63 147.93 1.4 Allowed Pre-proline 0 CA--C 1.533 0.321 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.54 -179.491 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -69.77 140.76 43.45 Favored 'Trans proline' 0 N--CA 1.494 1.513 0 C-N-CA 122.74 2.293 . . . . 0.0 111.767 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 88.9 t80 -125.95 128.77 48.03 Favored 'General case' 0 CA--C 1.511 -0.529 0 N-CA-C 108.542 -0.91 . . . . 0.0 108.542 -179.966 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 88.5 m-85 -97.51 145.32 26.34 Favored 'General case' 0 C--N 1.324 -0.53 0 C-N-CA 120.706 -0.398 . . . . 0.0 110.321 -179.07 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -144.19 145.67 32.23 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 110.174 -0.306 . . . . 0.0 110.174 179.651 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 96.8 m -125.97 132.11 52.12 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.499 179.927 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -125.45 151.85 45.69 Favored 'General case' 0 N--CA 1.467 0.391 0 N-CA-C 109.999 -0.371 . . . . 0.0 109.999 179.798 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 22.1 p -110.4 135.38 51.19 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-O 120.834 0.349 . . . . 0.0 110.258 179.85 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 30.3 p -161.33 163.06 31.02 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.26 179.903 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 120.07 -176.09 16.08 Favored Glycine 0 CA--C 1.527 0.836 0 N-CA-C 111.328 -0.709 . . . . 0.0 111.328 179.556 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -61.75 153.44 67.63 Favored 'Trans proline' 0 N--CA 1.495 1.59 0 C-N-CA 122.655 2.236 . . . . 0.0 112.276 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 6.5 m -68.3 -16.26 63.88 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.735 -0.666 . . . . 0.0 109.97 179.156 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 55.4 t-80 -90.81 -43.63 9.94 Favored 'General case' 0 CA--C 1.518 -0.253 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.442 179.774 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -124.4 78.52 61.52 Favored Pre-proline 0 CA--C 1.533 0.303 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.413 179.271 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -81.08 129.74 7.02 Favored 'Trans proline' 0 C--N 1.313 -1.31 0 C-N-CA 122.464 2.109 . . . . 0.0 112.466 179.835 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 72.2 p -111.2 173.44 6.34 Favored 'General case' 0 CA--C 1.515 -0.388 0 CA-C-N 115.885 -0.598 . . . . 0.0 109.895 179.926 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -130.81 145.19 51.91 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.444 -179.768 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 88.4 m -125.25 120.36 31.02 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.198 -0.455 . . . . 0.0 109.821 179.493 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 35.9 t -95.66 122.77 38.78 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.36 -179.837 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 117' ' ' THR . . . . . 0.418 ' CG2' ' N ' ' A' ' 118' ' ' VAL . 54.0 m -107.17 159.89 15.99 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.029 179.937 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 118' ' ' VAL . . . . . 0.418 ' N ' ' CG2' ' A' ' 117' ' ' THR . 14.7 p -141.25 137.94 33.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.187 -0.46 . . . . 0.0 109.965 179.664 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 81.2 tt0 -121.82 127.15 50.23 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.634 179.848 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . 0.403 ' CZ ' ' CE1' ' A' ' 125' ' ' PHE . 42.1 p90 -159.6 154.57 24.82 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.519 179.225 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 52.18 25.66 3.44 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.888 0.375 . . . . 0.0 110.902 179.557 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 72.75 23.68 77.46 Favored Glycine 0 CA--C 1.522 0.501 0 N-CA-C 111.002 -0.839 . . . . 0.0 111.002 179.849 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 45.7 mmtt -130.93 150.57 52.03 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 110.224 -0.288 . . . . 0.0 110.224 -179.78 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 6.2 p -120.59 125.74 74.45 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.627 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 125' ' ' PHE . . . . . 0.403 ' CE1' ' CZ ' ' A' ' 120' ' ' PHE . 41.9 m-85 -112.05 120.6 42.4 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.262 179.774 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 43.1 t -82.29 137.11 34.91 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.515 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -84.76 -169.63 46.07 Favored Glycine 0 CA--C 1.521 0.466 0 N-CA-C 110.559 -1.017 . . . . 0.0 110.559 179.802 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -99.28 136.06 39.78 Favored 'General case' 0 CA--C 1.532 0.264 0 O-C-N 122.769 -0.254 . . . . 0.0 111.068 -179.577 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 18.4 pt-20 -54.29 142.59 25.9 Favored 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 120.403 -0.519 . . . . 0.0 110.138 179.589 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -162.94 155.74 19.1 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.602 179.835 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 51.2 tttm -90.49 31.09 1.05 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.302 179.918 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 7.4 t -159.06 149.53 19.57 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.765 179.798 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -73.7 -40.61 63.48 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.188 179.388 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -53.36 -55.17 27.07 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.949 -178.75 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 12.1 tp -64.32 -39.44 93.92 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.785 0.326 . . . . 0.0 110.845 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -57.08 -55.18 38.1 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.678 -179.305 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -59.86 -42.12 92.96 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.841 0.353 . . . . 0.0 110.46 -179.54 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 41.5 tpp -60.19 -46.32 90.13 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.371 -179.606 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 37.1 m -61.3 -37.04 81.78 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.009 -179.812 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -63.97 -47.57 79.86 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.936 0.398 . . . . 0.0 110.725 179.781 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -73.2 -23.48 60.4 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.742 179.901 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -70.81 -49.58 44.82 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.227 179.968 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 7.1 p -68.87 -41.49 82.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.786 -179.767 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -63.72 -46.09 86.99 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.698 -179.857 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 145' ' ' PHE . . . . . . . . . . . . . 84.7 t80 -60.56 -43.41 97.3 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.809 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 146' ' ' MET . . . . . . . . . . . . . 79.8 mmm -63.02 -37.56 87.69 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.476 -179.773 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 37.8 m -72.29 -43.14 64.67 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 120.784 -0.366 . . . . 0.0 111.044 179.569 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 148' ' ' ILE . . . . . . . . . . . . . 71.5 mt -55.87 -27.3 22.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 C-N-CA 120.956 -0.298 . . . . 0.0 110.78 -179.559 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 41.6 mttt . . . . . 0 C--N 1.325 -0.488 0 C-N-CA 120.653 -0.419 . . . . 0.0 111.242 179.662 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . 0.509 ' C ' ' H ' ' A' ' 84' ' ' LYS . . . . . . . . 0 N--CA 1.452 -0.35 0 CA-C-O 121.143 0.497 . . . . 0.0 110.019 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -47.07 -15.75 0.04 OUTLIER 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.689 -0.687 . . . . 0.0 109.885 179.551 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . 0.509 ' H ' ' C ' ' A' ' 82' ' ' ALA . 99.4 mttt -64.44 -40.51 95.87 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.08 179.759 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . 0.414 ' O ' ' OE2' ' A' ' 89' ' ' GLU . 94.5 m-20 -65.12 -47.82 75.81 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.843 -179.769 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 6.3 tt -60.68 -40.54 92.53 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.908 -179.631 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 38.2 mt -56.6 -37.68 70.98 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.269 -0.423 . . . . 0.0 109.995 -179.779 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 87.4 mt-30 -69.83 -36.97 76.03 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.429 179.526 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . 0.521 ' OE1' ' N ' ' A' ' 89' ' ' GLU . 0.3 OUTLIER -61.63 -48.85 79.01 Favored 'General case' 0 C--O 1.233 0.22 0 C-N-CA 120.774 -0.37 . . . . 0.0 111.037 -178.932 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 19.2 pt -63.74 -40.47 89.17 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.663 -179.693 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -59.57 -48.88 79.93 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.657 -179.78 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 58.6 tt0 -68.71 -41.98 78.35 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.722 179.717 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 65.1 tttm -61.7 -49.5 76.2 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.693 -179.73 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . 0.419 ' O ' ' CB ' ' A' ' 95' ' ' SER . 98.1 mt-10 -66.6 -19.58 65.8 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.456 179.627 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' SER . . . . . 0.419 ' CB ' ' O ' ' A' ' 94' ' ' GLU . 1.1 t 76.02 21.21 1.58 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.013 -179.654 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' SER . . . . . 0.458 ' HG ' ' H ' ' A' ' 97' ' ' LEU . 12.8 p -79.56 -114.73 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.283 -179.874 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . 0.458 ' H ' ' HG ' ' A' ' 96' ' ' SER . 54.4 tp -141.03 126.55 18.83 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.398 179.747 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . 0.429 ' N ' ' CD1' ' A' ' 98' ' ' LEU . 10.4 mp -44.91 143.94 2.1 Favored Pre-proline 0 C--N 1.327 -0.375 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.704 -179.503 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -70.26 139.35 38.31 Favored 'Trans proline' 0 N--CA 1.495 1.601 0 C-N-CA 122.508 2.139 . . . . 0.0 111.899 -179.897 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 86.8 t80 -128.05 129.08 46.09 Favored 'General case' 0 CA--C 1.514 -0.422 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 -179.527 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 81.6 m-85 -96.53 146.14 25.07 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.588 -179.126 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -147.35 148.14 31.04 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.242 179.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 1.2 t -130.67 138.22 49.94 Favored 'General case' 0 CA--C 1.519 -0.217 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.666 179.75 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -123.02 150.77 42.62 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.289 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 30.1 p -108.79 136.5 48.26 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-O 120.863 0.363 . . . . 0.0 110.152 179.757 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' SER . . . . . 0.514 ' HG ' ' N ' ' A' ' 107' ' ' GLY . 38.6 t -164.01 160.97 22.4 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.22 -179.812 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . 0.514 ' N ' ' HG ' ' A' ' 106' ' ' SER . . . 119.43 -179.13 16.67 Favored Glycine 0 CA--C 1.522 0.521 0 N-CA-C 111.21 -0.756 . . . . 0.0 111.21 179.908 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_endo -61.07 148.57 92.44 Favored 'Trans proline' 0 C--N 1.308 -1.57 0 C-N-CA 122.828 2.352 . . . . 0.0 112.139 -179.881 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 32.7 t -63.5 -16.63 61.26 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.819 -0.628 . . . . 0.0 109.872 179.124 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 61.3 t-80 -89.22 -44.0 10.59 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.396 179.872 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -125.58 77.81 68.97 Favored Pre-proline 0 N--CA 1.465 0.286 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.38 179.124 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -81.42 128.97 6.41 Favored 'Trans proline' 0 C--N 1.306 -1.677 0 C-N-CA 122.467 2.111 . . . . 0.0 112.253 179.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 4.4 p -108.77 173.07 6.48 Favored 'General case' 0 CA--C 1.515 -0.38 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.049 179.712 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -133.62 147.42 51.48 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.493 -179.455 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 85.6 m -129.11 123.1 31.32 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.137 179.602 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 35.0 t -96.74 125.17 41.01 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.25 -179.861 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 98.2 m -121.86 133.8 54.88 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.289 -179.74 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 13.8 p -118.51 152.3 20.66 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.208 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.255 -179.622 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -131.01 139.15 49.94 Favored 'General case' 0 CA--C 1.52 -0.185 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.592 -179.803 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . 0.626 ' CZ ' ' CE1' ' A' ' 125' ' ' PHE . 54.1 p90 -166.71 159.04 13.57 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.718 179.964 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 51.72 24.28 2.35 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.873 0.368 . . . . 0.0 110.519 179.701 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 73.21 23.02 78.37 Favored Glycine 0 CA--C 1.524 0.613 0 N-CA-C 111.009 -0.836 . . . . 0.0 111.009 179.829 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -131.22 150.41 52.16 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.885 0.374 . . . . 0.0 110.322 -179.893 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . 0.478 ' O ' ' CD1' ' A' ' 125' ' ' PHE . 14.9 p -104.73 160.38 5.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.792 -179.461 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 125' ' ' PHE . . . . . 0.626 ' CE1' ' CZ ' ' A' ' 120' ' ' PHE . 85.8 m-85 -153.4 108.92 3.24 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.413 179.908 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 69.1 m -84.29 142.24 30.37 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.799 -179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -85.85 -167.3 43.29 Favored Glycine 0 CA--C 1.519 0.317 0 N-CA-C 110.536 -1.026 . . . . 0.0 110.536 179.783 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -99.38 134.52 42.14 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-O 120.803 0.335 . . . . 0.0 110.902 -179.676 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 97.3 mt-10 -51.2 138.63 20.12 Favored 'General case' 0 C--N 1.322 -0.599 0 C-N-CA 120.489 -0.485 . . . . 0.0 110.296 179.642 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -160.53 155.03 23.61 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.661 -179.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 40.9 tttp -88.19 32.33 0.77 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.987 0.422 . . . . 0.0 110.334 179.867 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 4.9 t -160.57 153.95 22.0 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.531 179.875 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -79.68 -37.35 36.01 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.019 179.854 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -56.63 -54.41 46.35 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.991 -178.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 4.9 tp -63.99 -39.17 93.52 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-O 120.654 0.264 . . . . 0.0 110.76 -179.807 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -59.25 -54.44 46.82 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.712 -179.502 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 99.1 mt-10 -57.15 -44.98 83.94 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.714 0.293 . . . . 0.0 110.677 -179.535 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 72.3 mtm -62.78 -41.04 99.07 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.528 -179.75 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 20.4 m -60.0 -39.26 85.15 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 120.999 -0.281 . . . . 0.0 110.585 -179.938 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -64.43 -42.29 96.1 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.962 0.41 . . . . 0.0 110.672 -179.842 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -69.49 -27.52 65.28 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.684 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 65.7 mttm -71.63 -49.85 36.17 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.379 179.83 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 7.5 p -67.56 -41.11 85.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.622 -179.763 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -64.01 -45.97 86.61 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.804 0.335 . . . . 0.0 110.473 -179.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 145' ' ' PHE . . . . . . . . . . . . . 70.9 t80 -60.89 -43.98 97.76 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.606 -179.737 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 146' ' ' MET . . . . . . . . . . . . . 48.8 ttp -60.96 -38.78 87.11 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.688 -179.653 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 37.7 t -67.61 -42.27 82.65 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.927 0.394 . . . . 0.0 111.193 -179.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 148' ' ' ILE . . . . . . . . . . . . . 93.7 mt -60.85 -29.16 44.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.076 -179.386 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 53.6 mtpt . . . . . 0 C--N 1.324 -0.525 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.139 179.973 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . 0.525 ' C ' ' H ' ' A' ' 84' ' ' LYS . . . . . . . . 0 N--CA 1.45 -0.44 0 CA-C-O 121.135 0.493 . . . . 0.0 110.344 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 -46.55 -15.29 0.03 OUTLIER 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.109 179.302 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . 0.525 ' H ' ' C ' ' A' ' 82' ' ' ALA . 99.4 mttt -64.87 -40.63 95.44 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.118 179.342 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 66.3 t30 -66.11 -48.24 71.52 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.549 -0.751 . . . . 0.0 110.803 -179.632 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 6.5 tt -60.21 -42.37 94.98 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.809 -179.33 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 38.1 mt -55.7 -35.96 66.64 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.118 -179.561 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 88.7 mt-30 -71.59 -36.12 70.75 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.401 179.328 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 81.1 mm-40 -61.11 -48.96 79.25 Favored 'General case' 0 N--CA 1.462 0.146 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.793 -179.041 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 26.8 pt -66.11 -35.87 76.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.584 179.802 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -59.43 -50.34 74.31 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.518 -179.511 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 87.8 mt-30 -70.65 -43.76 68.52 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.804 179.845 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -60.32 -50.91 71.73 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.67 -179.595 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 -69.35 -2.61 11.33 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.29 179.848 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 1.5 m 62.3 16.67 8.68 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.367 -179.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' SER . . . . . 0.468 ' OG ' ' N ' ' A' ' 97' ' ' LEU . 66.7 p -73.08 -124.82 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.25 -179.72 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . 0.468 ' N ' ' OG ' ' A' ' 96' ' ' SER . 89.6 mt -137.62 128.35 26.98 Favored 'General case' 0 CA--C 1.52 -0.197 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.701 -179.831 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 11.1 mp -44.77 152.25 0.56 Allowed Pre-proline 0 N--CA 1.452 -0.332 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.714 -179.734 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -64.69 169.7 11.07 Favored 'Trans proline' 0 C--N 1.308 -1.579 0 C-N-CA 122.879 2.386 . . . . 0.0 112.194 -179.917 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 55.5 t80 -145.05 114.53 7.16 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.417 179.236 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 93.2 m-85 -99.33 133.64 43.33 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.306 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -145.5 146.51 31.49 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.405 -179.694 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 88.9 m -126.36 132.19 51.62 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.235 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -117.13 145.23 43.93 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.247 -0.433 . . . . 0.0 109.888 179.651 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 17.6 p -114.42 125.48 53.89 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-O 120.813 0.34 . . . . 0.0 110.605 179.761 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' SER . . . . . 0.464 ' O ' ' O ' ' A' ' 113' ' ' THR . 34.6 p -164.04 160.77 22.09 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.553 179.974 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 130.4 170.57 12.73 Favored Glycine 0 CA--C 1.52 0.372 0 N-CA-C 110.814 -0.915 . . . . 0.0 110.814 179.533 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 27.2 Cg_endo -63.31 149.1 92.16 Favored 'Trans proline' 0 C--N 1.302 -1.877 0 C-N-CA 122.772 2.314 . . . . 0.0 111.905 179.471 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 50.2 m -65.16 -16.32 63.38 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.059 -0.518 . . . . 0.0 110.07 178.965 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 52.6 t-80 -88.96 -41.94 12.08 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.354 179.366 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -126.93 78.82 73.52 Favored Pre-proline 0 N--CA 1.464 0.251 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.557 178.711 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 24.4 Cg_exo -62.43 158.24 41.82 Favored 'Trans proline' 0 C--N 1.301 -1.958 0 C-N-CA 122.723 2.282 . . . . 0.0 112.363 -180.0 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 113' ' ' THR . . . . . 0.464 ' O ' ' O ' ' A' ' 106' ' ' SER . 23.7 p -155.83 150.97 26.6 Favored 'General case' 0 CA--C 1.517 -0.29 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.864 179.719 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -131.59 145.51 51.74 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.304 -179.955 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 99.3 m -126.11 119.72 28.3 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.561 179.338 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 59.8 p -94.23 122.0 36.32 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.351 -179.894 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 91.5 m -105.88 157.03 17.77 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.195 179.808 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 9.9 p -140.45 138.13 36.36 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.459 179.566 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . 0.428 ' OE2' ' N ' ' A' ' 123' ' ' LYS . 5.2 tm-20 -124.58 130.84 53.2 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.735 179.73 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . 0.622 ' CZ ' ' CE1' ' A' ' 125' ' ' PHE . 49.8 p90 -164.84 156.76 15.62 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.52 179.225 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 53.45 21.23 2.34 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.767 0.318 . . . . 0.0 110.609 179.565 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 76.56 22.32 72.92 Favored Glycine 0 CA--C 1.523 0.534 0 N-CA-C 110.983 -0.847 . . . . 0.0 110.983 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . 0.428 ' N ' ' OE2' ' A' ' 119' ' ' GLU . 51.8 mtpt -132.67 151.81 51.86 Favored 'General case' 0 CA--C 1.517 -0.293 0 O-C-N 122.75 -0.265 . . . . 0.0 110.487 179.832 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 12.7 p -122.13 128.7 75.63 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.159 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.872 -179.669 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 125' ' ' PHE . . . . . 0.622 ' CE1' ' CZ ' ' A' ' 120' ' ' PHE . 22.2 m-85 -116.05 123.27 47.51 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.3 179.707 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 66.1 m -81.99 136.11 35.3 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.486 179.893 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -80.46 -171.37 43.51 Favored Glycine 0 CA--C 1.522 0.485 0 N-CA-C 110.665 -0.974 . . . . 0.0 110.665 179.834 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . 0.62 ' H ' ' CB ' ' A' ' 139' ' ' SER . 13.6 tt0 -94.89 130.16 41.6 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-O 120.931 0.396 . . . . 0.0 110.668 179.643 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 129' ' ' GLU . . . . . 0.43 ' OE1' ' N ' ' A' ' 129' ' ' GLU . 56.4 mp0 -56.22 144.18 30.83 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 116.04 -0.527 . . . . 0.0 109.978 179.087 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -172.96 166.78 5.09 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.78 -179.661 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 22.6 pttp -93.3 33.38 1.22 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.567 179.022 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 132' ' ' THR . . . . . 0.711 ' HG1' ' HZ2' ' A' ' 134' ' ' LYS . 0.3 OUTLIER -153.66 142.82 21.39 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.512 -179.826 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 58.1 mttp -79.27 -45.03 20.54 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.195 0.522 . . . . 0.0 110.729 179.779 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . 0.711 ' HZ2' ' HG1' ' A' ' 132' ' ' THR . 16.3 pttp -53.63 -46.5 70.52 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.932 -179.4 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 4.4 tp -66.33 -41.84 89.02 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.677 179.871 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 136' ' ' ALA . . . . . 0.529 ' O ' ' OG ' ' A' ' 139' ' ' SER . . . -60.21 -53.07 62.04 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 -179.451 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 96.1 mt-10 -54.19 -40.67 67.78 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 -179.727 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 50.1 mtt -61.34 -42.47 98.74 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.217 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 139' ' ' SER . . . . . 0.62 ' CB ' ' H ' ' A' ' 128' ' ' GLU . 90.9 p -60.09 -38.75 83.86 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.658 -179.316 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -65.54 -44.24 87.47 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.999 0.428 . . . . 0.0 110.818 -179.619 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -69.31 -30.16 68.16 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.719 -179.462 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 57.5 mttp -71.94 -51.15 23.47 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.905 0.383 . . . . 0.0 111.56 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 11.3 p -66.15 -43.32 92.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.555 -179.207 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -61.67 -46.15 90.96 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.625 -179.584 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 145' ' ' PHE . . . . . . . . . . . . . 64.6 t80 -60.67 -42.27 96.72 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.528 -179.598 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 146' ' ' MET . . . . . . . . . . . . . 59.6 mtt -62.8 -39.16 93.4 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.816 -179.638 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 78.1 p -69.21 -42.1 76.2 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.847 0.356 . . . . 0.0 110.904 -179.709 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 148' ' ' ILE . . . . . . . . . . . . . 87.2 mt -59.05 -29.23 40.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.769 -179.646 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 55.2 mtpt . . . . . 0 C--N 1.325 -0.457 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.669 179.688 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . 0.488 ' C ' ' H ' ' A' ' 84' ' ' LYS . . . . . . . . 0 N--CA 1.448 -0.543 0 CA-C-O 121.209 0.528 . . . . 0.0 109.679 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 2.8 m-85 -48.02 -16.58 0.09 Allowed 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.542 -0.754 . . . . 0.0 109.716 179.857 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . 0.488 ' H ' ' C ' ' A' ' 82' ' ' ALA . 60.5 mttp -64.3 -42.73 96.23 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.479 -0.782 . . . . 0.0 109.932 179.916 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 13.5 m120 -63.57 -45.66 89.43 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.9 -179.376 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 6.0 tt -61.21 -41.57 97.08 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.777 -179.388 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 56.3 mt -57.92 -38.11 75.28 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.111 -0.495 . . . . 0.0 109.77 179.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 87.4 mt-30 -70.22 -35.3 73.79 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.355 179.102 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 96.2 mt-10 -63.41 -48.58 77.22 Favored 'General case' 0 N--CA 1.462 0.161 0 C-N-CA 120.668 -0.413 . . . . 0.0 111.426 -179.022 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 15.3 pt -62.82 -44.31 99.44 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 116.449 -0.342 . . . . 0.0 110.765 -179.542 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . 0.482 ' O ' ' N ' ' A' ' 95' ' ' SER . . . -68.81 -45.48 71.12 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.015 -179.622 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -63.27 -47.7 81.25 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.62 -179.417 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -63.34 -42.52 98.95 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.766 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -92.81 7.56 43.23 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.449 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' SER . . . . . 0.482 ' N ' ' O ' ' A' ' 91' ' ' ALA . 14.2 m 39.49 47.15 1.54 Allowed 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 120.91 0.386 . . . . 0.0 110.641 -179.936 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 60.2 p -100.48 44.7 1.0 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.435 -179.273 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . 0.43 ' N ' ' CD1' ' A' ' 97' ' ' LEU . 9.9 mp 64.66 93.17 0.06 Allowed 'General case' 0 N--CA 1.461 0.092 0 CA-C-O 121.042 0.449 . . . . 0.0 110.705 -179.445 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . 0.429 ' N ' ' CD1' ' A' ' 98' ' ' LEU . 10.3 mp -45.59 146.69 1.7 Allowed Pre-proline 0 CA--C 1.532 0.278 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.324 -179.712 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -70.28 145.42 54.09 Favored 'Trans proline' 0 N--CA 1.493 1.452 0 C-N-CA 122.496 2.131 . . . . 0.0 111.863 -179.8 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 84.4 t80 -127.76 131.59 49.63 Favored 'General case' 0 CA--C 1.514 -0.436 0 N-CA-C 108.771 -0.825 . . . . 0.0 108.771 179.972 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 95.7 m-85 -97.52 143.18 28.48 Favored 'General case' 0 C--N 1.324 -0.521 0 C-N-CA 120.741 -0.384 . . . . 0.0 110.474 -179.191 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -143.85 145.28 32.21 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.075 179.681 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 98.6 m -122.57 127.21 49.15 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.514 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -123.24 150.91 42.86 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 110.007 -0.368 . . . . 0.0 110.007 179.785 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 35.1 p -106.85 137.42 44.92 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-O 120.761 0.315 . . . . 0.0 110.23 179.97 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 31.2 m -161.75 163.35 29.65 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.253 179.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 118.04 -178.34 16.84 Favored Glycine 0 CA--C 1.527 0.82 0 N-CA-C 111.281 -0.728 . . . . 0.0 111.281 179.535 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -61.4 154.42 59.01 Favored 'Trans proline' 0 N--CA 1.497 1.715 0 C-N-CA 122.702 2.268 . . . . 0.0 112.337 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 28.3 m -67.68 -18.16 64.83 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.627 -0.715 . . . . 0.0 109.978 179.29 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 94.9 m-70 -91.95 -36.54 13.38 Favored 'General case' 0 CA--C 1.52 -0.179 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.164 179.735 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -124.21 79.77 59.31 Favored Pre-proline 0 CA--C 1.538 0.519 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.077 179.232 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -81.45 121.39 3.81 Favored 'Trans proline' 0 N--CA 1.489 1.24 0 C-N-CA 122.481 2.121 . . . . 0.0 112.194 -179.917 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 4.9 p -109.26 172.8 6.64 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.004 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 -132.2 146.76 52.24 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.167 -179.765 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 88.5 m -131.52 126.95 36.22 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.152 -0.476 . . . . 0.0 109.86 179.138 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 68.2 m -94.4 121.23 35.71 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.367 -179.834 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 117' ' ' THR . . . . . 0.421 ' CG2' ' CG2' ' A' ' 124' ' ' VAL . 98.6 m -108.95 125.33 51.92 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.385 -179.869 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 11.0 p -110.55 139.66 33.12 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.3 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.004 -179.945 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 84.1 tt0 -123.25 130.35 52.63 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.619 179.925 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . 0.584 ' CZ ' ' CE1' ' A' ' 125' ' ' PHE . 47.7 p90 -163.72 157.45 19.13 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.533 179.214 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 52.59 21.85 1.98 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.788 0.328 . . . . 0.0 110.86 179.503 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 75.7 21.89 76.0 Favored Glycine 0 CA--C 1.523 0.568 0 N-CA-C 111.185 -0.766 . . . . 0.0 111.185 179.836 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 61.0 mttp -131.66 151.2 51.81 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 120.723 0.297 . . . . 0.0 110.303 179.898 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . 0.421 ' CG2' ' CG2' ' A' ' 117' ' ' THR . 13.6 p -123.03 129.77 74.86 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.27 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.763 -179.572 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 125' ' ' PHE . . . . . 0.584 ' CE1' ' CZ ' ' A' ' 120' ' ' PHE . 18.5 m-85 -117.56 123.34 46.01 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.167 179.979 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 12.3 p -83.66 141.55 31.42 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.594 -179.976 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -86.18 -169.62 46.12 Favored Glycine 0 CA--C 1.523 0.584 0 N-CA-C 110.704 -0.959 . . . . 0.0 110.704 179.847 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . 0.588 ' H ' ' CB ' ' A' ' 139' ' ' SER . 5.8 pt-20 -93.86 128.89 40.38 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-O 120.765 0.317 . . . . 0.0 111.056 -179.564 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -55.15 144.14 25.11 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 120.45 -0.5 . . . . 0.0 110.172 179.703 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -170.63 163.67 8.18 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.931 179.837 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 31.0 mtmm -89.71 32.84 0.86 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.366 179.226 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 4.0 t -156.43 149.5 24.16 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.601 179.493 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 58.8 mttp -80.57 -31.8 36.76 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.921 179.708 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . 0.496 ' O ' ' SD ' ' A' ' 138' ' ' MET . 25.9 mtpp -59.19 -51.18 71.09 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.038 -178.901 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 11.6 tp -64.76 -39.3 93.4 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-O 120.838 0.351 . . . . 0.0 110.936 -179.654 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 136' ' ' ALA . . . . . 0.438 ' O ' ' OG ' ' A' ' 139' ' ' SER . . . -59.36 -54.81 42.48 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.8 -179.351 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 80.6 mm-40 -58.15 -43.61 87.46 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 120.847 -0.341 . . . . 0.0 110.436 -179.382 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 138' ' ' MET . . . . . 0.571 ' SD ' ' N ' ' A' ' 138' ' ' MET . 0.0 OUTLIER -62.02 -41.98 98.67 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.458 -179.979 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 139' ' ' SER . . . . . 0.588 ' CB ' ' H ' ' A' ' 128' ' ' GLU . 77.4 p -65.06 -36.16 83.48 Favored 'General case' 0 C--N 1.329 -0.317 0 C-N-CA 120.922 -0.311 . . . . 0.0 111.022 -179.934 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -65.83 -47.32 75.38 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.047 0.451 . . . . 0.0 110.645 179.94 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -71.7 -24.41 61.81 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.738 -179.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -70.62 -49.35 48.53 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.246 179.812 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 7.1 p -68.37 -38.9 80.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.88 -179.545 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 144' ' ' ALA . . . . . 0.412 ' O ' ' OG ' ' A' ' 147' ' ' SER . . . -64.08 -44.95 90.8 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.82 0.343 . . . . 0.0 110.95 -179.612 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 145' ' ' PHE . . . . . . . . . . . . . 64.7 t80 -57.11 -44.21 83.03 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.472 -179.713 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 146' ' ' MET . . . . . . . . . . . . . 63.3 mtt -63.79 -38.98 93.13 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.88 179.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 147' ' ' SER . . . . . 0.412 ' OG ' ' O ' ' A' ' 144' ' ' ALA . 78.0 p -67.91 -44.98 75.68 Favored 'General case' 0 C--N 1.332 -0.189 0 C-N-CA 120.702 -0.399 . . . . 0.0 110.936 -179.752 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 148' ' ' ILE . . . . . . . . . . . . . 82.2 mt -52.1 -39.14 25.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.085 -179.521 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 32.6 mttm . . . . . 0 C--N 1.326 -0.444 0 C-N-CA 120.593 -0.443 . . . . 0.0 110.932 179.424 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . 0.477 ' C ' ' N ' ' A' ' 84' ' ' LYS . . . . . . . . 0 N--CA 1.447 -0.576 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 3.9 m-85 -48.56 -15.77 0.09 Allowed 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.515 -0.766 . . . . 0.0 109.575 179.709 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . 0.477 ' N ' ' C ' ' A' ' 82' ' ' ALA . 99.6 mttt -63.02 -39.47 94.84 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.758 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 93.0 m-20 -63.1 -44.84 94.54 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.739 -179.912 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 7.2 tt -71.92 -33.72 68.49 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.667 -179.515 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 17.7 mt -59.63 -41.71 91.07 Favored 'General case' 0 CA--C 1.52 -0.206 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.424 -178.839 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 17.0 pt20 -73.04 -29.43 62.98 Favored 'General case' 0 C--N 1.316 -0.866 0 C-N-CA 120.424 -0.51 . . . . 0.0 110.509 179.191 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 92.2 mt-10 -65.71 -42.87 90.63 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 120.693 -0.403 . . . . 0.0 111.251 -179.809 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 29.2 pt -72.13 -35.26 52.67 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.882 179.698 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -55.68 -49.53 72.7 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.937 -179.215 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 13.5 pt20 -67.96 -38.05 82.29 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.526 179.557 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 64.1 tttp -62.66 -47.72 82.46 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.384 -179.894 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 72.2 mm-40 -76.39 -2.83 33.77 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.494 -179.755 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 74.64 4.62 4.41 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.08 -0.509 . . . . 0.0 109.916 -179.724 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 18.9 m -74.17 162.71 28.68 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.287 179.89 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . 0.423 ' N ' ' CD1' ' A' ' 97' ' ' LEU . 10.5 mp -73.16 132.57 43.4 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.952 0.406 . . . . 0.0 110.052 -179.73 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . 0.409 ' N ' ' CD1' ' A' ' 98' ' ' LEU . 10.6 mp -45.63 149.21 1.12 Allowed Pre-proline 0 CA--C 1.534 0.336 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.68 -179.618 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -72.55 143.52 38.44 Favored 'Trans proline' 0 N--CA 1.49 1.315 0 C-N-CA 122.681 2.254 . . . . 0.0 111.59 179.881 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 87.7 t80 -127.57 130.47 49.13 Favored 'General case' 0 CA--C 1.511 -0.545 0 N-CA-C 108.542 -0.911 . . . . 0.0 108.542 179.956 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 76.3 m-85 -100.15 147.32 25.82 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 110.012 -0.366 . . . . 0.0 110.012 -179.092 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -146.17 146.89 31.0 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.379 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 99.8 m -121.57 128.14 51.68 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.368 179.732 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -116.27 144.13 44.62 Favored 'General case' 0 N--CA 1.467 0.389 0 N-CA-C 109.93 -0.396 . . . . 0.0 109.93 179.737 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 30.2 p -106.75 134.85 49.27 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 109.97 -0.382 . . . . 0.0 109.97 179.775 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 41.0 t -164.42 162.12 21.88 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.148 179.926 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 122.7 -177.87 16.45 Favored Glycine 0 CA--C 1.528 0.876 0 N-CA-C 111.268 -0.733 . . . . 0.0 111.268 179.459 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 23.4 Cg_endo -61.3 150.33 85.29 Favored 'Trans proline' 0 N--CA 1.497 1.718 0 C-N-CA 122.789 2.326 . . . . 0.0 112.317 179.902 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 36.9 t -63.99 -18.24 64.1 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.702 -0.681 . . . . 0.0 109.794 179.076 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 73.9 m80 -91.27 -38.19 12.82 Favored 'General case' 0 CA--C 1.518 -0.263 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.285 179.804 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -123.96 79.61 57.73 Favored Pre-proline 0 CA--C 1.538 0.508 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.185 179.463 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -80.8 122.07 4.28 Favored 'Trans proline' 0 N--CA 1.491 1.338 0 C-N-CA 122.619 2.213 . . . . 0.0 112.15 179.68 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 3.5 p -109.12 171.26 7.54 Favored 'General case' 0 CA--C 1.517 -0.307 0 CA-C-N 115.646 -0.706 . . . . 0.0 109.978 -179.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -133.89 148.56 51.25 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.182 -179.702 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 94.8 m -129.73 126.61 38.64 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.104 179.398 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 11.2 t -96.39 121.47 38.23 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.276 179.829 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 117' ' ' THR . . . . . 0.439 ' CG2' ' CG2' ' A' ' 124' ' ' VAL . 70.8 m -112.86 130.35 56.13 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.017 -179.913 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 7.7 p -113.73 141.8 28.48 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.357 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.03 -179.748 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 79.0 tt0 -125.14 131.86 53.18 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.49 -179.764 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . 0.625 ' CZ ' ' CE1' ' A' ' 125' ' ' PHE . 48.4 p90 -166.63 159.51 14.18 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.435 179.372 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 53.32 19.05 1.44 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.8 0.333 . . . . 0.0 110.904 179.711 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 78.24 20.0 73.32 Favored Glycine 0 CA--C 1.525 0.687 0 N-CA-C 111.323 -0.711 . . . . 0.0 111.323 179.617 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -132.13 152.91 50.99 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.806 0.336 . . . . 0.0 110.408 179.872 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . 0.439 ' CG2' ' CG2' ' A' ' 117' ' ' THR . 14.9 p -121.38 127.88 75.8 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.288 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.713 -179.904 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 125' ' ' PHE . . . . . 0.625 ' CE1' ' CZ ' ' A' ' 120' ' ' PHE . 36.8 m-85 -111.38 120.55 42.58 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.346 179.911 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 5.7 m -78.8 129.24 34.39 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.283 179.707 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -84.05 -173.25 49.66 Favored Glycine 0 CA--C 1.521 0.444 0 N-CA-C 111.139 -0.785 . . . . 0.0 111.139 -179.938 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . 0.446 ' CG ' ' N ' ' A' ' 129' ' ' GLU . 69.1 tt0 -77.75 165.89 23.64 Favored 'General case' 0 N--CA 1.442 -0.842 0 CA-C-O 120.671 0.272 . . . . 0.0 110.443 179.894 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 129' ' ' GLU . . . . . 0.446 ' N ' ' CG ' ' A' ' 128' ' ' GLU . 18.7 pt-20 -105.94 140.7 38.55 Favored 'General case' 0 C--N 1.332 -0.168 0 N-CA-C 109.879 -0.415 . . . . 0.0 109.879 179.106 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -171.57 166.48 6.75 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.86 179.596 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -86.12 35.36 0.64 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.041 179.065 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 4.3 t -152.47 144.77 23.97 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.844 179.772 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -82.54 -21.95 35.17 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.965 179.44 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 56.3 mtpt -68.79 -54.49 15.56 Favored 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 120.632 -0.427 . . . . 0.0 111.208 -179.278 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 3.6 tp -64.02 -38.9 92.77 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.959 -179.504 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -58.91 -54.64 44.83 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.67 -179.527 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 81.0 mm-40 -60.07 -43.03 95.75 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.866 0.365 . . . . 0.0 110.766 -179.777 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 60.3 mtt -61.77 -41.88 98.27 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.319 -179.509 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 37.8 m -65.07 -36.61 84.87 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.014 179.775 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -63.32 -46.37 86.95 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 121.046 0.45 . . . . 0.0 110.524 -179.962 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -70.21 -24.25 63.08 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.686 179.849 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 38.7 ttmt -70.76 -49.94 41.36 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.29 -0.413 . . . . 0.0 111.276 179.711 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 7.1 p -67.98 -40.9 84.07 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.151 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.019 -179.501 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -62.29 -45.79 91.67 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.935 0.398 . . . . 0.0 110.526 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 145' ' ' PHE . . . . . . . . . . . . . 69.8 t80 -59.19 -44.33 92.21 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.564 -179.656 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 146' ' ' MET . . . . . . . . . . . . . 64.1 ttp -61.68 -39.1 90.22 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.965 -179.711 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 11.7 t -67.34 -44.33 79.34 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 120.743 -0.383 . . . . 0.0 110.873 179.844 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 148' ' ' ILE . . . . . . . . . . . . . 94.2 mt -57.72 -29.57 35.23 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.204 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.994 -179.642 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 25.8 mtpp . . . . . 0 C--N 1.327 -0.413 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.51 179.87 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . 0.5 ' C ' ' H ' ' A' ' 84' ' ' LYS . . . . . . . . 0 N--CA 1.455 -0.209 0 CA-C-O 120.775 0.322 . . . . 0.0 110.528 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 2.1 m-85 -46.05 -15.89 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.27 179.709 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . 0.5 ' H ' ' C ' ' A' ' 82' ' ' ALA . 99.4 mttt -64.79 -40.75 95.76 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.447 179.266 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 38.8 t30 -64.92 -44.69 88.71 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.63 -179.91 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 5.3 tt -60.03 -43.36 95.34 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.588 -179.304 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 74.0 mt -56.25 -37.74 70.19 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.402 179.976 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 88.4 mt-30 -70.8 -35.26 72.46 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.578 179.651 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 79.9 mm-40 -62.27 -48.43 79.93 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.807 -179.169 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . 0.421 HG13 ' N ' ' A' ' 91' ' ' ALA . 19.9 pt -65.13 -41.34 91.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.655 -179.52 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . 0.519 ' O ' ' N ' ' A' ' 95' ' ' SER . . . -68.85 -49.9 54.45 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.852 -179.464 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 84.4 mt-30 -65.01 -45.68 84.5 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.865 -179.604 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 88.9 tttt -60.02 -47.35 86.19 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.562 -179.77 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . 0.408 ' O ' ' C ' ' A' ' 95' ' ' SER . 96.4 mt-10 -96.03 10.15 38.43 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.544 -179.928 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' SER . . . . . 0.519 ' N ' ' O ' ' A' ' 91' ' ' ALA . 13.9 t 39.24 40.84 0.56 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.47 -179.754 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' SER . . . . . 0.44 ' O ' ' CB ' ' A' ' 97' ' ' LEU . 44.7 m -87.47 33.26 0.69 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.653 -179.436 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . 0.44 ' CB ' ' O ' ' A' ' 96' ' ' SER . 2.6 tp 76.93 100.58 0.07 Allowed 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.866 179.907 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 11.0 mp -44.21 152.02 0.51 Allowed Pre-proline 0 C--N 1.325 -0.474 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.431 179.817 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_endo -65.86 171.16 10.28 Favored 'Trans proline' 0 C--N 1.304 -1.77 0 C-N-CA 122.951 2.434 . . . . 0.0 111.998 179.611 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 31.8 t80 -144.62 117.2 8.62 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.7 179.6 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 93.4 m-85 -96.95 129.03 44.47 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.505 -179.929 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -147.68 148.16 30.74 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.478 -179.781 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' THR . . . . . 0.44 ' HG1' ' N ' ' A' ' 104' ' ' ALA . 1.5 t -135.26 145.21 47.36 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.63 -179.924 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . 0.44 ' N ' ' HG1' ' A' ' 103' ' ' THR . . . -129.39 153.93 47.42 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.521 -179.925 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 16.2 p -110.28 138.43 46.67 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.576 179.631 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' SER . . . . . 0.525 ' HG ' ' N ' ' A' ' 107' ' ' GLY . 40.3 t -163.5 153.62 15.48 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.664 179.804 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . 0.525 ' N ' ' HG ' ' A' ' 106' ' ' SER . . . 125.65 -175.94 17.41 Favored Glycine 0 CA--C 1.524 0.612 0 N-CA-C 111.039 -0.824 . . . . 0.0 111.039 179.643 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 25.9 Cg_endo -62.45 150.46 87.32 Favored 'Trans proline' 0 C--N 1.303 -1.824 0 C-N-CA 122.785 2.323 . . . . 0.0 112.278 -179.883 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 37.1 t -65.05 -16.09 63.07 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.36 179.038 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 49.6 t-80 -90.51 -43.43 10.24 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.472 179.646 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -126.21 77.2 72.12 Favored Pre-proline 0 CA--C 1.53 0.178 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.21 179.213 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -80.62 126.52 6.02 Favored 'Trans proline' 0 C--N 1.303 -1.847 0 C-N-CA 122.611 2.208 . . . . 0.0 112.261 -179.588 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 5.6 p -103.97 170.89 7.65 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.362 179.609 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -133.46 146.71 51.4 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.589 -179.665 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 86.9 m -127.82 122.42 32.63 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.434 179.733 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 25.4 m -96.06 122.55 39.0 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.013 0.435 . . . . 0.0 110.556 -179.758 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 57.5 m -112.29 128.13 56.18 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.514 -179.894 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 8.6 p -110.42 140.82 27.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.506 179.928 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -127.27 136.78 52.45 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.566 179.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . 0.619 ' CZ ' ' CE1' ' A' ' 125' ' ' PHE . 50.7 p90 -170.15 160.2 7.86 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.385 179.85 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 51.56 21.38 1.27 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.511 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 77.08 21.22 74.25 Favored Glycine 0 CA--C 1.522 0.503 0 N-CA-C 111.098 -0.801 . . . . 0.0 111.098 179.732 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -131.99 151.59 51.64 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.786 0.327 . . . . 0.0 110.614 179.909 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 8.5 p -121.38 127.84 75.79 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-O 120.965 0.412 . . . . 0.0 110.842 -179.65 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 125' ' ' PHE . . . . . 0.619 ' CE1' ' CZ ' ' A' ' 120' ' ' PHE . 26.4 m-85 -112.63 120.48 41.69 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.367 179.56 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 43.5 t -80.09 132.16 35.9 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.707 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -80.26 -172.42 44.68 Favored Glycine 0 CA--C 1.525 0.688 0 N-CA-C 110.77 -0.932 . . . . 0.0 110.77 179.808 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . 0.42 ' O ' ' CG ' ' A' ' 128' ' ' GLU . 8.9 pt-20 -96.46 131.69 42.78 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.612 0.244 . . . . 0.0 110.475 -179.833 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -54.06 142.09 26.38 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.373 179.541 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -165.43 157.9 15.46 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.559 179.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 51.0 tttm -86.65 33.56 0.64 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.597 179.704 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 4.8 t -159.64 152.19 21.3 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.509 -179.712 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -81.84 -33.56 30.6 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.001 0.429 . . . . 0.0 110.978 179.896 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -58.28 -54.25 49.16 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.892 -178.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 4.0 tp -65.08 -38.75 91.78 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.66 179.938 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -57.7 -55.03 40.2 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.833 -179.358 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -60.84 -41.59 96.09 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.434 -179.752 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 78.9 mmm -62.61 -41.39 98.95 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.552 -179.472 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 20.2 m -64.4 -38.46 91.1 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.632 -179.946 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -64.73 -43.77 92.33 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.595 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -72.21 -24.99 61.48 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.456 179.671 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 63.0 tttp -70.31 -47.16 62.41 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.046 -179.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 7.7 p -70.55 -37.34 69.58 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.83 -179.542 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -64.06 -46.3 84.96 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.662 -179.857 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 145' ' ' PHE . . . . . . . . . . . . . 66.0 t80 -58.33 -43.44 88.25 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.553 -179.734 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 146' ' ' MET . . . . . . . . . . . . . 59.2 ttp -61.06 -37.41 82.54 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.577 -179.536 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 35.8 t -70.55 -45.59 65.17 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.955 -179.86 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 148' ' ' ILE . . . . . . . . . . . . . 93.9 mt -55.01 -31.52 25.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.617 -179.459 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 10.2 mtpm? . . . . . 0 C--N 1.327 -0.412 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.671 179.752 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . 0.51 ' C ' ' H ' ' A' ' 84' ' ' LYS . . . . . . . . 0 N--CA 1.451 -0.404 0 CA-C-O 121.06 0.457 . . . . 0.0 110.318 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 2.1 m-85 -46.13 -15.87 0.03 OUTLIER 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.172 179.728 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . 0.51 ' H ' ' C ' ' A' ' 82' ' ' ALA . 65.0 mttp -63.67 -40.26 96.39 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.169 179.509 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 63.6 t30 -65.95 -48.78 70.19 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.777 -179.467 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 6.4 tt -60.8 -40.98 94.68 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.791 -179.5 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 34.3 mt -56.11 -36.8 68.6 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.295 -179.591 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 89.4 mt-30 -69.81 -35.69 75.04 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.57 179.432 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 14.6 mm-40 -61.71 -49.7 75.41 Favored 'General case' 0 C--N 1.333 -0.11 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.107 -178.836 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 28.6 pt -65.02 -34.46 70.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.633 179.916 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -54.61 -50.44 68.05 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.529 -179.335 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 78.7 mt-30 -65.32 -42.32 93.09 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.851 -179.944 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 69.2 mmtt -61.35 -47.42 85.97 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.549 -179.512 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 80.9 mm-40 -68.15 -20.16 64.86 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.419 179.943 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 1.2 t 72.76 19.67 3.88 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.596 -179.825 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 75.3 m -80.43 -117.4 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.242 -179.898 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 40.9 tp -143.27 125.27 15.26 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.652 179.691 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . 0.475 ' H ' ' CD1' ' A' ' 98' ' ' LEU . 9.9 mp -44.36 142.65 2.24 Favored Pre-proline 0 N--CA 1.452 -0.359 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.871 -179.812 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_endo -69.63 145.42 57.84 Favored 'Trans proline' 0 C--N 1.311 -1.442 0 C-N-CA 122.524 2.149 . . . . 0.0 112.008 -179.781 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 92.6 t80 -127.2 128.73 46.57 Favored 'General case' 0 C--O 1.235 0.321 0 N-CA-C 109.544 -0.539 . . . . 0.0 109.544 179.643 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 85.6 m-85 -96.23 144.48 26.39 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.939 -179.596 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -143.74 145.4 32.37 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.439 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 98.0 m -122.83 127.67 49.37 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.466 -179.913 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -105.5 135.22 47.28 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.174 179.78 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 18.8 p -114.42 119.29 36.38 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-O 120.876 0.369 . . . . 0.0 110.414 179.592 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 11.4 p -160.66 163.96 32.11 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.403 179.934 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 122.24 168.78 13.34 Favored Glycine 0 CA--C 1.523 0.536 0 N-CA-C 110.888 -0.885 . . . . 0.0 110.888 179.659 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 24.9 Cg_endo -62.43 151.02 85.26 Favored 'Trans proline' 0 C--N 1.301 -1.928 0 C-N-CA 122.78 2.32 . . . . 0.0 112.143 179.63 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 77.7 p -63.99 -17.58 63.44 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.327 179.002 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 66.0 m80 -90.42 -43.14 10.49 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.501 179.628 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -125.04 78.02 66.58 Favored Pre-proline 0 N--CA 1.464 0.243 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.357 179.637 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 112' ' ' PRO . . . . . 0.4 ' O ' ' CG2' ' A' ' 113' ' ' THR . 56.8 Cg_endo -76.28 164.44 31.01 Favored 'Trans proline' 0 C--N 1.303 -1.866 0 C-N-CA 122.711 2.274 . . . . 0.0 112.279 -179.995 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 113' ' ' THR . . . . . 0.4 ' CG2' ' O ' ' A' ' 112' ' ' PRO . 33.8 p -156.83 152.01 26.33 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.641 179.555 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -131.68 144.14 50.79 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.335 -179.628 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 93.0 m -130.33 125.73 35.42 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.46 179.438 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 46.1 t -97.19 122.91 40.74 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.612 -179.827 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 117' ' ' THR . . . . . 0.408 ' CG2' ' CG2' ' A' ' 124' ' ' VAL . 54.3 m -114.81 131.45 56.81 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.357 -179.834 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 9.9 p -111.75 141.83 26.01 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.285 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.267 -179.949 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 79.3 tt0 -125.79 133.77 51.92 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.623 -179.672 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . 0.627 ' CZ ' ' CE1' ' A' ' 125' ' ' PHE . 45.9 p90 -166.53 157.56 12.68 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.368 179.466 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 52.61 24.86 3.33 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.518 179.719 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 72.64 22.82 78.78 Favored Glycine 0 CA--C 1.521 0.466 0 N-CA-C 111.083 -0.807 . . . . 0.0 111.083 179.913 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 62.9 mttp -131.66 151.66 51.45 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.807 0.337 . . . . 0.0 110.331 179.826 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . 0.408 ' CG2' ' CG2' ' A' ' 117' ' ' THR . 12.2 p -122.21 128.47 75.53 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.227 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.768 -179.7 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 125' ' ' PHE . . . . . 0.627 ' CE1' ' CZ ' ' A' ' 120' ' ' PHE . 27.0 m-85 -112.93 123.35 50.12 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.434 179.919 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 4.2 p -79.37 126.76 31.23 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.195 179.843 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -82.65 -172.53 48.32 Favored Glycine 0 CA--C 1.525 0.676 0 N-CA-C 110.97 -0.852 . . . . 0.0 110.97 -179.664 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . 0.459 ' CG ' ' N ' ' A' ' 129' ' ' GLU . 67.5 tt0 -78.7 167.09 21.73 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-O 120.759 0.314 . . . . 0.0 110.491 179.972 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 129' ' ' GLU . . . . . 0.459 ' N ' ' CG ' ' A' ' 128' ' ' GLU . 3.0 pp20? -109.61 145.31 36.64 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.979 0.419 . . . . 0.0 110.343 178.952 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -174.19 170.41 3.72 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.617 179.663 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -86.28 36.13 0.68 Allowed 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.238 178.849 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 5.1 t -156.41 148.66 23.33 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.893 0.378 . . . . 0.0 110.538 -179.637 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -82.54 -33.14 28.28 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.103 179.591 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 69.5 mmtt -58.82 -52.66 64.76 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.01 -178.213 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 10.3 tp -63.78 -39.76 95.03 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.466 -0.333 . . . . 0.0 110.973 -179.531 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -60.31 -54.78 41.57 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.53 -179.142 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -59.19 -44.43 92.19 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.708 -179.456 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 38.3 ttm -60.63 -41.8 95.64 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.478 -179.775 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 38.1 m -65.04 -35.17 80.3 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.754 179.763 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -62.7 -45.57 92.14 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.759 -179.733 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -72.41 -23.12 61.04 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.667 -179.771 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -71.6 -50.15 33.64 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.327 179.876 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 6.9 p -66.67 -41.01 87.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.696 -179.508 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -61.43 -43.56 98.65 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.479 -179.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 145' ' ' PHE . . . . . . . . . . . . . 65.4 t80 -60.2 -41.87 93.91 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.4 -179.832 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 146' ' ' MET . . . . . . . . . . . . . 89.9 mmm -63.85 -39.92 95.36 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.018 -179.349 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 9.1 t -67.48 -44.94 77.32 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.077 179.916 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 148' ' ' ILE . . . . . . . . . . . . . 78.7 mt -54.08 -33.5 24.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.582 -179.26 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 55.5 mtpt . . . . . 0 C--N 1.325 -0.491 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.532 -179.908 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . 0.51 ' C ' ' H ' ' A' ' 84' ' ' LYS . . . . . . . . 0 N--CA 1.451 -0.403 0 CA-C-O 121.079 0.466 . . . . 0.0 110.059 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -46.49 -16.36 0.03 OUTLIER 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.08 179.609 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . 0.51 ' H ' ' C ' ' A' ' 82' ' ' ALA . 99.4 mttt -63.97 -41.96 97.4 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.314 179.328 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 35.9 t30 -64.79 -43.67 92.44 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.357 -179.523 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 2.6 tp -60.95 -43.36 98.81 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.6 -179.241 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 74.4 mt -55.83 -35.85 66.85 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.309 -179.767 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 88.6 mt-30 -71.01 -34.58 71.48 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.546 179.64 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -62.36 -48.08 81.34 Favored 'General case' 0 C--N 1.334 -0.08 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.044 -179.013 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 22.1 pt -65.2 -35.71 76.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.691 -179.996 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -59.17 -50.66 73.2 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.559 -179.648 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 56.0 tt0 -65.3 -44.93 86.34 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.859 -179.668 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -63.34 -47.58 81.59 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.702 -179.808 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . 0.445 ' O ' ' CB ' ' A' ' 95' ' ' SER . 16.0 mm-40 -72.64 -16.38 61.71 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.292 -179.832 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' SER . . . . . 0.445 ' CB ' ' O ' ' A' ' 94' ' ' GLU . 0.7 OUTLIER 79.69 11.36 1.27 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.516 -179.91 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 9.7 p -80.89 165.28 21.96 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.458 -179.911 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 57.5 tp -67.39 126.11 28.26 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.647 -179.974 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . 0.428 ' N ' ' CD1' ' A' ' 98' ' ' LEU . 10.5 mp -46.4 148.37 1.66 Allowed Pre-proline 0 N--CA 1.45 -0.43 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.75 179.887 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -70.63 143.96 48.09 Favored 'Trans proline' 0 C--N 1.31 -1.474 0 C-N-CA 122.764 2.31 . . . . 0.0 111.996 179.63 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 91.5 t80 -129.97 131.37 45.9 Favored 'General case' 0 C--O 1.234 0.261 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 179.57 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 79.5 m-85 -98.72 146.17 26.16 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.823 -179.444 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -144.18 145.7 32.26 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.503 -179.883 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 94.4 m -123.97 129.76 51.47 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.423 -179.939 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -113.23 141.05 47.43 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.147 179.933 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 13.4 p -115.15 120.79 40.95 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-O 120.874 0.368 . . . . 0.0 110.627 179.452 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 35.6 p -159.02 164.67 35.3 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.425 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 122.8 164.97 12.27 Favored Glycine 0 CA--C 1.522 0.473 0 N-CA-C 110.834 -0.906 . . . . 0.0 110.834 179.721 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 20.4 Cg_endo -60.9 151.46 77.53 Favored 'Trans proline' 0 C--N 1.3 -1.98 0 C-N-CA 122.854 2.369 . . . . 0.0 112.16 179.344 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 91.2 p -63.68 -18.41 63.96 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.186 179.326 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 99.2 m-70 -89.9 -43.25 10.73 Favored 'General case' 0 CA--C 1.519 -0.234 0 CA-C-O 120.889 0.376 . . . . 0.0 110.538 179.409 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -124.2 77.75 60.31 Favored Pre-proline 0 CA--C 1.532 0.267 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.378 179.445 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 112' ' ' PRO . . . . . 0.401 ' O ' ' CG2' ' A' ' 113' ' ' THR . 59.7 Cg_endo -75.41 162.73 35.63 Favored 'Trans proline' 0 C--N 1.305 -1.743 0 C-N-CA 122.572 2.181 . . . . 0.0 112.295 179.836 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 113' ' ' THR . . . . . 0.401 ' CG2' ' O ' ' A' ' 112' ' ' PRO . 25.4 p -157.51 153.63 27.33 Favored 'General case' 0 CA--C 1.515 -0.378 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.629 179.488 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -130.75 143.14 50.53 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.287 -179.877 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 97.5 m -130.5 126.17 36.19 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.575 179.454 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 29.1 t -97.5 123.19 41.28 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.408 -179.922 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 117' ' ' THR . . . . . 0.427 ' CG2' ' CG2' ' A' ' 124' ' ' VAL . 51.7 m -112.97 129.14 56.59 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.196 -179.805 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 9.4 p -111.87 142.02 25.55 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.305 179.993 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 81.6 tt0 -124.64 132.71 53.4 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.767 179.908 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . 0.635 ' CZ ' ' CE1' ' A' ' 125' ' ' PHE . 48.3 p90 -167.3 158.57 11.92 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.51 179.168 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 54.12 21.47 3.02 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.605 179.685 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 75.52 21.88 76.43 Favored Glycine 0 CA--C 1.522 0.481 0 N-CA-C 111.075 -0.81 . . . . 0.0 111.075 -179.947 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -132.73 153.0 51.61 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.652 0.263 . . . . 0.0 110.575 179.872 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . 0.427 ' CG2' ' CG2' ' A' ' 117' ' ' THR . 14.2 p -121.4 126.81 75.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-O 120.91 0.386 . . . . 0.0 110.558 -179.826 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 125' ' ' PHE . . . . . 0.635 ' CE1' ' CZ ' ' A' ' 120' ' ' PHE . 41.9 m-85 -111.44 121.3 44.84 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.314 179.646 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 5.9 p -83.26 137.78 33.86 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.416 180.0 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -86.15 -169.07 45.54 Favored Glycine 0 CA--C 1.521 0.454 0 N-CA-C 110.654 -0.978 . . . . 0.0 110.654 179.826 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -97.88 132.88 43.07 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-O 120.653 0.263 . . . . 0.0 110.788 -179.91 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 98.4 mt-10 -56.55 146.98 23.32 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 120.924 0.392 . . . . 0.0 110.416 179.221 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -169.77 161.75 9.29 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.652 -179.962 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 77.5 tttt -88.84 33.03 0.78 Allowed 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.173 0.511 . . . . 0.0 110.311 179.532 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 2.5 t -159.28 150.6 20.12 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.789 -179.683 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -81.06 -32.83 33.83 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.933 179.758 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . 0.423 ' N ' ' CD ' ' A' ' 134' ' ' LYS . 4.5 mptp? -58.5 -51.87 68.03 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.644 -178.628 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 3.5 tp -65.8 -39.72 91.19 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-O 120.845 0.355 . . . . 0.0 110.824 179.916 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -57.79 -55.17 38.3 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.572 -179.157 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -59.24 -43.35 92.4 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.398 -179.433 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 47.8 ttp -61.4 -44.66 96.77 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.443 -179.573 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 18.1 m -62.08 -39.97 94.23 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.748 -179.854 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -62.88 -46.44 87.84 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.702 -179.946 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -71.88 -23.72 61.55 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.547 179.895 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 64.4 tttp -70.54 -48.73 54.02 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.261 179.78 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 7.6 p -69.16 -37.97 77.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.69 -179.542 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -63.19 -45.86 89.76 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.642 -179.622 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 145' ' ' PHE . . . . . . . . . . . . . 60.7 t80 -60.24 -43.01 96.45 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.566 -179.326 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 146' ' ' MET . . . . . . . . . . . . . 62.7 ttp -61.63 -39.63 91.97 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.95 -179.73 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 33.1 t -67.04 -43.6 82.36 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.901 -179.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 148' ' ' ILE . . . . . . . . . . . . . 89.6 mt -57.28 -31.82 39.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.695 -179.411 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 53.9 mtpt . . . . . 0 C--N 1.327 -0.395 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.819 179.864 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . 0.498 ' C ' ' H ' ' A' ' 84' ' ' LYS . . . . . . . . 0 N--CA 1.449 -0.51 0 CA-C-O 121.082 0.468 . . . . 0.0 110.274 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -47.01 -16.38 0.04 OUTLIER 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.914 -0.585 . . . . 0.0 109.804 179.603 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . 0.498 ' H ' ' C ' ' A' ' 82' ' ' ALA . 69.1 mttm -63.73 -42.51 97.89 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.686 -0.688 . . . . 0.0 109.993 179.86 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 89.5 m-20 -63.12 -44.49 95.49 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.525 -179.748 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 6.2 tt -63.71 -40.95 98.04 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.832 -179.879 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 39.4 mt -56.79 -36.19 69.57 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.092 -179.703 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 88.3 mt-30 -71.63 -31.36 66.78 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.59 179.672 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -66.07 -47.26 74.89 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.301 -179.386 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 30.4 pt -66.88 -34.96 73.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-O 120.929 0.395 . . . . 0.0 110.463 179.957 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -58.32 -49.89 75.58 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.706 -179.416 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 89.0 mt-30 -65.67 -44.24 86.87 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.754 179.809 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 64.4 tttp -62.28 -47.94 82.12 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.621 -179.745 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 98.1 mt-10 -74.92 -2.91 29.09 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.508 179.995 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 2.7 t 67.79 6.31 5.0 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.603 -179.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 7.6 p -75.03 160.72 30.18 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.261 -179.873 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 51.7 tp -67.15 129.8 41.05 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.879 -179.521 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 10.3 mp -45.47 155.01 0.48 Allowed Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.2 179.258 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -65.1 171.65 8.61 Favored 'Trans proline' 0 C--N 1.307 -1.637 0 C-N-CA 122.826 2.351 . . . . 0.0 111.737 179.621 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 29.0 t80 -144.27 122.57 12.29 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.124 179.191 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 -103.59 132.96 49.39 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.416 -179.682 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -144.07 145.1 31.95 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.328 179.883 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 97.7 m -126.2 133.53 51.5 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.656 -179.672 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -124.28 149.08 46.91 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.339 179.925 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 20.3 p -108.06 135.4 49.48 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-O 120.864 0.364 . . . . 0.0 110.706 179.814 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 26.5 m -162.73 161.71 26.46 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.499 179.905 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 119.3 179.19 16.68 Favored Glycine 0 CA--C 1.522 0.479 0 N-CA-C 110.668 -0.973 . . . . 0.0 110.668 179.884 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 28.6 Cg_endo -60.91 151.51 77.2 Favored 'Trans proline' 0 C--N 1.302 -1.91 0 C-N-CA 122.87 2.38 . . . . 0.0 112.392 -179.664 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 37.5 t -63.56 -18.86 64.31 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.172 179.433 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 52.3 t-80 -90.31 -37.0 14.35 Favored 'General case' 0 CA--C 1.519 -0.243 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.118 179.55 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -124.35 81.14 59.06 Favored Pre-proline 0 N--CA 1.465 0.32 0 CA-C-O 121.124 0.488 . . . . 0.0 110.11 179.427 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -84.33 117.32 2.12 Favored 'Trans proline' 0 C--N 1.303 -1.855 0 C-N-CA 122.55 2.167 . . . . 0.0 112.487 -179.215 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 48.2 p -105.37 170.06 8.1 Favored 'General case' 0 CA--C 1.517 -0.326 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.197 179.741 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -130.57 142.27 50.46 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.396 -179.842 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 86.3 m -121.0 119.1 31.56 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.285 179.68 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 21.5 m -97.9 122.12 40.64 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.122 -179.988 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 62.2 m -112.9 132.16 55.43 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.347 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 10.9 p -112.67 138.9 40.22 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.261 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.197 -179.87 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 84.0 tt0 -125.28 134.01 52.43 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.81 -179.714 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . 0.605 ' CZ ' ' CE1' ' A' ' 125' ' ' PHE . 48.7 p90 -166.61 158.73 13.52 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.615 179.442 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 52.73 23.01 2.5 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.828 0.347 . . . . 0.0 110.467 179.843 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 74.98 22.27 77.06 Favored Glycine 0 CA--C 1.521 0.44 0 N-CA-C 111.118 -0.793 . . . . 0.0 111.118 179.786 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 63.5 mttp -132.3 152.6 51.31 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 110.355 -0.239 . . . . 0.0 110.355 -179.892 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 7.2 p -118.99 124.61 73.47 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.23 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.69 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 125' ' ' PHE . . . . . 0.605 ' CE1' ' CZ ' ' A' ' 120' ' ' PHE . 50.5 m-85 -108.5 119.8 40.58 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.07 179.79 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 73.4 m -82.49 134.26 35.21 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.383 -179.91 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -91.2 -167.15 40.94 Favored Glycine 0 CA--C 1.524 0.63 0 N-CA-C 110.673 -0.971 . . . . 0.0 110.673 179.846 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . 0.473 ' H ' ' CB ' ' A' ' 139' ' ' SER . 35.7 tt0 -98.0 133.89 41.85 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-O 120.968 0.413 . . . . 0.0 110.658 179.716 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 -63.35 151.75 39.96 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.324 179.71 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -171.78 164.36 6.51 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.733 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 61.7 pttt -88.39 32.64 0.77 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.665 179.184 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 3.9 t -156.14 148.13 23.19 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.929 0.395 . . . . 0.0 110.361 179.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 99.9 mttt -81.81 -17.14 48.57 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.642 -0.708 . . . . 0.0 109.896 179.738 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -73.29 -56.86 4.51 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.815 -179.702 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 4.3 tp -65.46 -41.34 93.48 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.344 -179.491 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -56.53 -55.12 37.81 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.832 -178.959 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -60.71 -40.29 91.71 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.789 0.328 . . . . 0.0 110.586 -179.729 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 56.7 mtt -61.63 -42.75 99.32 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.46 -179.817 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 139' ' ' SER . . . . . 0.473 ' CB ' ' H ' ' A' ' 128' ' ' GLU . 74.1 m -61.38 -41.03 96.45 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.44 -0.345 . . . . 0.0 110.873 -179.885 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -63.02 -45.76 90.8 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.935 0.398 . . . . 0.0 110.937 -179.927 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -71.07 -24.22 62.28 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.711 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 52.7 tttp -71.95 -49.98 32.85 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.931 0.396 . . . . 0.0 111.254 179.828 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 7.4 p -68.29 -38.96 80.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.712 -179.67 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -64.44 -48.3 75.84 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.878 -179.647 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 145' ' ' PHE . . . . . 0.422 ' CD1' ' C ' ' A' ' 145' ' ' PHE . 30.7 t80 -58.76 -44.45 90.59 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.922 -179.594 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 146' ' ' MET . . . . . . . . . . . . . 61.6 ttp -60.82 -38.34 85.08 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.881 -179.286 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 6.6 t -67.95 -41.23 82.81 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.879 179.538 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 148' ' ' ILE . . . . . . . . . . . . . 80.8 mt -57.51 -42.85 81.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 115.681 -0.691 . . . . 0.0 111.147 -178.953 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 17.1 ptmt . . . . . 0 C--N 1.324 -0.506 0 C-N-CA 120.821 -0.352 . . . . 0.0 110.76 -179.783 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . 0.5 ' C ' ' H ' ' A' ' 84' ' ' LYS . . . . . . . . 0 N--CA 1.452 -0.347 0 CA-C-O 121.062 0.458 . . . . 0.0 110.051 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -47.01 -15.79 0.04 OUTLIER 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.93 179.748 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . 0.5 ' H ' ' C ' ' A' ' 82' ' ' ALA . 99.6 mttt -64.13 -42.0 97.0 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.733 -0.667 . . . . 0.0 109.901 179.679 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 92.5 m-20 -64.23 -46.27 84.53 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.786 -179.79 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 6.3 tt -62.35 -40.79 97.56 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.828 -179.848 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 33.4 mt -57.21 -36.72 71.22 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.05 -179.642 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -70.78 -33.42 70.74 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.932 -0.577 . . . . 0.0 110.537 179.592 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 97.6 mt-10 -63.99 -48.51 76.13 Favored 'General case' 0 N--CA 1.462 0.152 0 C-N-CA 120.694 -0.402 . . . . 0.0 111.1 -179.29 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 29.4 pt -68.55 -34.77 67.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.75 -179.996 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -57.72 -51.01 71.3 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.853 -179.535 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 69.3 tp60 -67.46 -41.5 84.58 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.539 179.937 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 65.8 tttm -60.97 -47.35 86.83 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.45 -179.505 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 96.1 mt-10 -72.85 -3.25 24.4 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.466 179.919 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 4.7 t 64.99 5.78 3.1 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.615 179.984 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' SER . . . . . 0.695 ' HG ' ' H ' ' A' ' 97' ' ' LEU . 29.3 t -61.86 -127.85 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.243 179.774 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . 0.695 ' H ' ' HG ' ' A' ' 96' ' ' SER . 94.1 mt -139.35 126.43 21.14 Favored 'General case' 0 CA--C 1.517 -0.3 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.548 179.977 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . 0.454 ' H ' ' CD1' ' A' ' 98' ' ' LEU . 10.2 mp -45.87 142.35 3.8 Favored Pre-proline 0 C--N 1.326 -0.435 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.658 -179.001 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -71.48 144.06 44.28 Favored 'Trans proline' 0 N--CA 1.494 1.546 0 C-N-CA 122.623 2.215 . . . . 0.0 112.241 179.757 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 87.4 t80 -123.28 126.62 47.23 Favored 'General case' 0 CA--C 1.513 -0.461 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 179.937 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 94.6 m-85 -95.18 142.05 28.06 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.393 -178.969 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -143.84 144.87 31.95 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 110.104 -0.332 . . . . 0.0 110.104 179.691 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 93.0 m -122.45 128.0 50.33 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.394 -179.936 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -114.58 142.77 46.0 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.223 179.848 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 29.4 p -103.68 132.4 49.98 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-O 120.787 0.327 . . . . 0.0 110.244 179.802 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 29.8 p -160.49 165.74 30.38 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.132 -179.837 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 115.4 -176.41 16.59 Favored Glycine 0 CA--C 1.524 0.615 0 N-CA-C 111.141 -0.784 . . . . 0.0 111.141 179.786 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 29.4 Cg_endo -64.35 156.83 57.74 Favored 'Trans proline' 0 C--N 1.308 -1.565 0 C-N-CA 122.862 2.375 . . . . 0.0 112.272 -179.909 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 26.6 m -69.98 -19.54 63.34 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.14 179.313 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 74.6 m80 -88.84 -39.35 13.91 Favored 'General case' 0 CA--C 1.518 -0.269 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.405 179.894 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -125.17 78.23 66.98 Favored Pre-proline 0 CA--C 1.534 0.344 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.257 179.221 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -80.81 126.38 5.83 Favored 'Trans proline' 0 C--N 1.305 -1.755 0 C-N-CA 122.344 2.029 . . . . 0.0 112.362 -179.725 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 4.3 p -110.36 173.64 6.23 Favored 'General case' 0 CA--C 1.513 -0.463 0 CA-C-O 120.951 0.405 . . . . 0.0 109.952 179.667 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 1.1 m-85 -134.14 148.28 50.93 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.491 -179.599 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 96.6 m -128.32 124.59 36.86 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.144 179.365 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 32.6 p -95.19 120.03 34.73 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.314 -179.649 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 117' ' ' THR . . . . . 0.42 ' CG2' ' CG2' ' A' ' 124' ' ' VAL . 99.8 m -107.92 126.57 52.84 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.17 179.856 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 11.6 p -109.33 137.35 41.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.203 -179.719 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 77.5 tt0 -123.82 131.8 53.66 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.822 -179.808 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . 0.615 ' CZ ' ' CE1' ' A' ' 125' ' ' PHE . 44.6 p90 -164.98 156.7 15.24 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.48 179.696 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 52.24 24.55 2.88 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.86 0.362 . . . . 0.0 110.617 179.832 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 73.54 22.22 78.71 Favored Glycine 0 CA--C 1.524 0.649 0 N-CA-C 111.139 -0.785 . . . . 0.0 111.139 179.787 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -131.99 152.25 51.24 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 110.319 -0.252 . . . . 0.0 110.319 -179.969 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . 0.42 ' CG2' ' CG2' ' A' ' 117' ' ' THR . 14.9 p -122.01 128.35 75.59 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.194 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.76 -179.649 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 125' ' ' PHE . . . . . 0.615 ' CE1' ' CZ ' ' A' ' 120' ' ' PHE . 24.5 m-85 -112.35 122.87 48.93 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.285 179.873 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 8.8 m -79.61 127.39 32.11 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.123 179.996 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -85.2 -171.84 48.57 Favored Glycine 0 CA--C 1.528 0.853 0 N-CA-C 110.891 -0.884 . . . . 0.0 110.891 -179.938 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . 0.467 ' CG ' ' N ' ' A' ' 129' ' ' GLU . 70.5 tt0 -80.25 167.8 19.85 Favored 'General case' 0 N--CA 1.445 -0.7 0 CA-C-O 120.664 0.269 . . . . 0.0 110.362 -179.915 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 129' ' ' GLU . . . . . 0.485 ' N ' ' CD ' ' A' ' 129' ' ' GLU . 1.3 pm0 -107.66 142.61 37.36 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.129 0.49 . . . . 0.0 110.138 179.242 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -172.11 166.64 6.1 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.856 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 63.2 mttp -86.12 35.2 0.63 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.35 178.932 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 3.1 t -153.13 146.41 24.79 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.865 179.951 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 99.7 mttt -83.65 -21.65 32.41 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.802 179.692 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -69.26 -54.92 12.23 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.99 -179.187 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 4.0 tp -65.41 -40.19 93.09 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.888 -179.596 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -57.55 -54.99 40.56 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.621 -179.174 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -60.83 -41.39 95.66 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.804 0.335 . . . . 0.0 110.627 -179.741 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 33.3 tpp -60.23 -42.73 95.83 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.359 -179.727 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 38.5 m -64.45 -36.81 85.37 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.847 -179.937 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -62.33 -46.46 88.6 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.971 0.415 . . . . 0.0 110.573 -179.822 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -70.38 -23.92 62.86 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.504 179.826 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -71.99 -50.61 27.25 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.291 -179.896 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 7.4 p -68.11 -40.97 83.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.763 -179.531 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -64.76 -46.88 80.29 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.667 -179.834 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 145' ' ' PHE . . . . . 0.45 ' CD1' ' C ' ' A' ' 145' ' ' PHE . 27.3 t80 -58.31 -45.93 87.1 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.931 -179.487 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 146' ' ' MET . . . . . . . . . . . . . 47.4 tpp -61.24 -38.02 85.14 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.863 -179.323 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 19.1 m -67.4 -41.03 85.58 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.106 -179.874 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 148' ' ' ILE . . . . . . . . . . . . . 81.1 mt -56.78 -42.53 77.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.608 -179.363 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 17.9 ptmt . . . . . 0 C--N 1.328 -0.367 0 CA-C-O 120.846 0.355 . . . . 0.0 110.787 179.9 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . 0.496 ' C ' ' H ' ' A' ' 84' ' ' LYS . . . . . . . . 0 N--CA 1.45 -0.457 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 2.8 m-85 -48.26 -16.46 0.1 Allowed 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.432 -0.804 . . . . 0.0 109.533 179.62 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . 0.496 ' H ' ' C ' ' A' ' 82' ' ' ALA . 63.9 mttp -63.8 -43.34 96.58 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.465 -0.789 . . . . 0.0 109.891 -179.978 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 41.8 t30 -63.33 -44.1 95.89 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.711 -179.135 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 6.1 tt -61.51 -41.69 97.67 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.982 -179.416 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 65.1 mt -57.44 -36.52 71.5 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.197 0.522 . . . . 0.0 109.626 -179.638 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 88.9 mt-30 -70.39 -35.59 73.57 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.541 178.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 80.9 mm-40 -63.3 -48.44 78.07 Favored 'General case' 0 N--CA 1.462 0.138 0 C-N-CA 120.664 -0.414 . . . . 0.0 111.494 -179.054 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 14.6 pt -63.7 -43.69 98.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 C-N-CA 120.858 -0.337 . . . . 0.0 110.491 -179.791 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . 0.515 ' O ' ' N ' ' A' ' 95' ' ' SER . . . -64.31 -47.69 78.47 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.814 -179.651 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 3.5 tm0? -65.76 -46.51 78.51 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.81 -179.55 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 55.7 mtpt -62.43 -44.78 95.62 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.869 -179.743 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 96.1 mt-10 -91.73 -0.44 57.55 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.225 -179.663 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' SER . . . . . 0.515 ' N ' ' O ' ' A' ' 91' ' ' ALA . 13.8 m 41.33 81.36 0.03 OUTLIER 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.535 -179.658 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' SER . . . . . 0.434 ' O ' ' CB ' ' A' ' 97' ' ' LEU . 75.5 p -139.64 36.19 2.01 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.776 -179.578 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . 0.434 ' CB ' ' O ' ' A' ' 96' ' ' SER . 0.2 OUTLIER 79.59 93.98 0.05 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.939 0.399 . . . . 0.0 110.779 179.749 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . 0.426 ' N ' ' CD1' ' A' ' 98' ' ' LEU . 10.5 mp -45.74 147.65 1.53 Allowed Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.284 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -68.53 140.95 49.1 Favored 'Trans proline' 0 N--CA 1.495 1.612 0 C-N-CA 122.707 2.271 . . . . 0.0 111.844 -179.859 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 87.0 t80 -126.88 130.04 49.38 Favored 'General case' 0 CA--C 1.511 -0.521 0 N-CA-C 108.417 -0.957 . . . . 0.0 108.417 179.795 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 94.8 m-85 -97.53 143.61 28.06 Favored 'General case' 0 C--N 1.322 -0.597 0 C-N-CA 120.723 -0.391 . . . . 0.0 110.35 -178.972 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -142.61 144.4 32.81 Favored 'General case' 0 N--CA 1.464 0.243 0 N-CA-C 109.986 -0.376 . . . . 0.0 109.986 179.611 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 90.1 m -124.53 130.24 52.1 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.456 -179.971 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -119.54 146.95 45.01 Favored 'General case' 0 N--CA 1.467 0.409 0 N-CA-C 109.851 -0.426 . . . . 0.0 109.851 179.492 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 32.2 p -110.36 138.34 46.87 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 110.175 -0.306 . . . . 0.0 110.175 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 44.3 t -167.4 154.2 8.34 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 110.032 -0.358 . . . . 0.0 110.032 179.85 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 126.08 -175.75 17.6 Favored Glycine 0 CA--C 1.529 0.915 0 N-CA-C 111.307 -0.717 . . . . 0.0 111.307 179.554 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -61.37 153.06 68.42 Favored 'Trans proline' 0 N--CA 1.495 1.599 0 C-N-CA 122.59 2.193 . . . . 0.0 112.366 179.881 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 92.9 p -67.3 -16.53 64.32 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.661 -0.7 . . . . 0.0 109.927 179.202 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 52.7 t-80 -91.79 -41.97 10.37 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-O 120.894 0.378 . . . . 0.0 110.301 -179.942 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -123.95 79.64 57.61 Favored Pre-proline 0 CA--C 1.535 0.373 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.225 179.383 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_endo -83.17 122.68 3.34 Favored 'Trans proline' 0 N--CA 1.491 1.348 0 C-N-CA 122.699 2.266 . . . . 0.0 112.232 179.949 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 63.6 p -102.82 167.31 9.95 Favored 'General case' 0 CA--C 1.515 -0.399 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.003 179.896 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 1.2 m-85 -130.9 144.42 51.45 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.121 -179.897 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 115' ' ' THR . . . . . 0.437 ' OG1' ' OE1' ' A' ' 129' ' ' GLU . 46.5 m -123.82 120.26 32.08 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.659 -0.497 . . . . 0.0 109.659 179.395 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 41.2 t -95.21 121.41 36.83 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.229 -179.821 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 70.6 m -115.83 129.82 56.59 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.29 -0.413 . . . . 0.0 109.932 -179.91 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 12.9 p -113.77 145.74 19.25 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.259 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.164 -179.75 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -127.29 133.41 50.16 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.584 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . 0.619 ' CZ ' ' CE1' ' A' ' 125' ' ' PHE . 49.3 p90 -166.3 159.79 15.23 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.525 179.179 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 52.89 19.37 1.3 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.694 0.283 . . . . 0.0 110.761 179.423 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 77.5 21.3 72.84 Favored Glycine 0 CA--C 1.526 0.742 0 N-CA-C 111.249 -0.74 . . . . 0.0 111.249 179.76 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -131.69 151.54 51.56 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 110.192 -0.299 . . . . 0.0 110.192 179.765 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 6.7 p -121.02 127.71 75.97 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.171 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.643 -179.478 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 125' ' ' PHE . . . . . 0.619 ' CE1' ' CZ ' ' A' ' 120' ' ' PHE . 27.5 m-85 -109.44 154.48 22.57 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.664 179.915 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 37.2 p -117.79 132.99 56.38 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.624 -179.998 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -83.81 -169.79 45.66 Favored Glycine 0 CA--C 1.52 0.394 0 N-CA-C 110.624 -0.99 . . . . 0.0 110.624 179.668 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . 0.447 ' H ' ' CB ' ' A' ' 139' ' ' SER . 7.1 pt-20 -94.51 127.75 40.65 Favored 'General case' 0 CA--C 1.529 0.152 0 CA-C-O 120.553 0.216 . . . . 0.0 111.025 -179.373 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 129' ' ' GLU . . . . . 0.437 ' OE1' ' OG1' ' A' ' 115' ' ' THR . 79.8 mm-40 -53.81 143.73 20.25 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 120.457 -0.497 . . . . 0.0 110.209 179.832 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -169.63 161.62 9.5 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.772 179.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 22.4 pttp -88.61 33.99 0.76 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.416 179.652 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 4.8 t -154.74 147.86 24.78 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.621 179.493 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 99.7 mttt -79.98 -33.41 39.46 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.877 179.639 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 62.9 mttp -59.9 -54.68 43.29 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.037 -178.826 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 3.7 tp -64.81 -38.86 92.39 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.914 0.387 . . . . 0.0 110.388 179.924 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -57.16 -54.94 41.07 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.568 -179.406 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -64.14 -41.01 97.35 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.714 -179.218 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 93.0 mtp -62.41 -41.44 98.69 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.208 -179.826 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 139' ' ' SER . . . . . 0.447 ' CB ' ' H ' ' A' ' 128' ' ' GLU . 68.8 m -66.7 -36.55 82.77 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.724 179.39 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -65.17 -45.84 83.26 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.953 0.406 . . . . 0.0 110.65 179.553 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -72.36 -24.27 61.25 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.419 179.856 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -70.01 -48.68 57.12 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.048 179.757 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 7.2 p -67.98 -37.37 78.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.705 -179.94 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 144' ' ' ALA . . . . . 0.438 ' O ' ' OG ' ' A' ' 147' ' ' SER . . . -65.52 -46.41 79.72 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.903 0.382 . . . . 0.0 110.722 -179.952 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 145' ' ' PHE . . . . . . . . . . . . . 85.6 t80 -60.72 -41.52 95.45 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.797 -179.986 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 146' ' ' MET . . . . . . . . . . . . . 75.4 mmm -60.69 -38.47 85.09 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.627 -179.461 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 147' ' ' SER . . . . . 0.438 ' OG ' ' O ' ' A' ' 144' ' ' ALA . 58.5 p -70.76 -39.81 73.02 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 120.75 -0.38 . . . . 0.0 111.089 179.429 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 148' ' ' ILE . . . . . . . . . . . . . 84.3 mt -58.5 -26.78 31.82 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.242 0 CA-C-O 120.715 0.293 . . . . 0.0 110.622 -179.608 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 36.5 mtmt . . . . . 0 C--N 1.323 -0.577 0 C-N-CA 120.326 -0.55 . . . . 0.0 110.576 -179.413 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . 0.498 ' C ' ' H ' ' A' ' 84' ' ' LYS . . . . . . . . 0 N--CA 1.451 -0.422 0 CA-C-O 121.13 0.49 . . . . 0.0 109.759 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -47.63 -16.09 0.06 Allowed 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.72 179.971 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . 0.498 ' H ' ' C ' ' A' ' 82' ' ' ALA . 64.7 mttp -63.88 -42.11 97.58 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.617 -0.719 . . . . 0.0 109.804 179.716 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 13.7 m120 -63.73 -46.19 86.48 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.884 -179.403 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 7.1 tt -62.64 -39.67 94.59 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.556 -179.724 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 33.7 mt -57.74 -38.97 76.25 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 -179.689 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 78.7 mt-30 -69.26 -35.11 75.75 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.645 179.122 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 95.7 mt-10 -62.99 -48.73 77.58 Favored 'General case' 0 N--CA 1.466 0.327 0 C-N-CA 120.761 -0.376 . . . . 0.0 111.166 -179.121 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 29.8 pt -66.42 -34.77 72.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.683 -179.968 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -55.71 -49.09 73.93 Favored 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 120.737 -0.385 . . . . 0.0 110.667 -179.37 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 52.9 tt0 -67.97 -43.49 78.86 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.846 -179.857 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 66.0 tttm -61.82 -48.52 80.2 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.899 0.381 . . . . 0.0 110.555 -179.487 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 80.2 mm-40 -76.84 2.62 14.04 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.576 -179.764 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 4.3 t 64.42 8.04 4.01 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.78 179.766 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 18.7 m -75.21 158.46 32.92 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.437 179.732 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . 0.476 ' N ' ' CD1' ' A' ' 97' ' ' LEU . 9.4 mp -69.29 131.68 45.24 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.998 0.428 . . . . 0.0 110.393 -179.459 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . 0.42 ' N ' ' CD1' ' A' ' 98' ' ' LEU . 10.3 mp -46.16 148.23 1.59 Allowed Pre-proline 0 C--N 1.326 -0.426 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.601 -179.727 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -73.07 142.69 34.84 Favored 'Trans proline' 0 N--CA 1.496 1.65 0 C-N-CA 122.828 2.352 . . . . 0.0 111.992 179.541 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 94.6 t80 -124.93 127.4 47.0 Favored 'General case' 0 CA--C 1.51 -0.564 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 179.798 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 84.1 m-85 -96.93 145.98 25.39 Favored 'General case' 0 C--N 1.324 -0.512 0 C-N-CA 120.726 -0.39 . . . . 0.0 110.303 -178.885 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -142.37 143.53 32.75 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.51 -0.314 . . . . 0.0 110.266 179.712 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 97.3 m -125.83 133.03 52.11 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.305 179.809 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -127.17 152.28 47.56 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.176 179.765 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 33.3 p -108.22 135.01 50.26 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-O 120.823 0.344 . . . . 0.0 110.133 -179.891 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 99.5 p -160.08 164.41 33.11 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.461 -179.805 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 117.47 -175.5 15.73 Favored Glycine 0 CA--C 1.527 0.835 0 N-CA-C 111.171 -0.772 . . . . 0.0 111.171 179.618 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 25.0 Cg_endo -62.15 152.3 76.73 Favored 'Trans proline' 0 N--CA 1.497 1.713 0 C-N-CA 122.863 2.376 . . . . 0.0 112.461 179.895 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 89.7 p -67.46 -17.31 64.65 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.016 179.284 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 55.1 t-80 -89.6 -42.73 11.23 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.209 179.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -123.93 78.07 58.1 Favored Pre-proline 0 CA--C 1.535 0.391 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.112 179.331 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -79.07 127.95 7.98 Favored 'Trans proline' 0 N--CA 1.49 1.27 0 C-N-CA 122.347 2.031 . . . . 0.0 112.435 179.768 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 52.0 p -110.19 172.87 6.61 Favored 'General case' 0 CA--C 1.519 -0.249 0 CA-C-N 115.793 -0.639 . . . . 0.0 109.86 179.629 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 1.7 m-85 -130.47 143.9 51.06 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.503 -179.377 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 97.9 m -124.59 120.91 33.27 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.265 -0.425 . . . . 0.0 109.965 179.307 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 12.9 t -102.14 128.82 48.46 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.239 179.917 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 97.5 m -129.6 141.44 50.95 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.322 -179.87 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 14.2 p -117.77 152.09 19.75 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.227 0 CA-C-N 116.044 -0.525 . . . . 0.0 109.76 179.86 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -129.03 136.98 51.03 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.004 0.43 . . . . 0.0 110.308 -179.895 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . 0.62 ' CZ ' ' CE1' ' A' ' 125' ' ' PHE . 55.0 p90 -169.31 161.42 10.01 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.791 -0.641 . . . . 0.0 110.744 179.14 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 52.87 19.21 1.24 Allowed 'General case' 0 N--CA 1.462 0.166 0 CA-C-O 120.771 0.32 . . . . 0.0 110.712 179.39 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 75.86 20.44 77.92 Favored Glycine 0 CA--C 1.526 0.723 0 N-CA-C 111.05 -0.82 . . . . 0.0 111.05 179.774 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 97.2 mttt -131.82 151.5 51.63 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.955 0.407 . . . . 0.0 110.145 -179.703 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . 0.48 ' C ' ' CD1' ' A' ' 125' ' ' PHE . 7.7 p -103.54 160.29 4.62 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.229 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.606 -179.325 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 125' ' ' PHE . . . . . 0.62 ' CE1' ' CZ ' ' A' ' 120' ' ' PHE . 85.8 m-85 -151.63 105.69 3.17 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.154 179.817 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 34.2 t -88.48 151.92 22.22 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.499 179.7 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -99.93 -159.36 28.5 Favored Glycine 0 N--CA 1.464 0.54 0 N-CA-C 110.652 -0.979 . . . . 0.0 110.652 179.454 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . 0.463 ' H ' ' CB ' ' A' ' 139' ' ' SER . 5.7 pt-20 -101.89 135.87 42.7 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-O 120.434 0.159 . . . . 0.0 110.801 -179.381 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -55.05 145.62 20.18 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 120.599 -0.441 . . . . 0.0 110.258 179.384 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -167.13 159.31 12.87 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.881 -179.999 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 48.0 tttp -88.58 32.18 0.8 Allowed 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.209 179.682 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 5.8 t -157.8 150.46 22.75 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.613 179.677 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -79.67 -35.98 38.36 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.054 179.619 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -56.45 -55.12 37.61 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.005 -178.926 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 4.3 tp -65.18 -40.4 94.22 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.269 -179.724 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -55.84 -54.44 44.56 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.501 -179.221 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -60.69 -40.25 91.51 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.897 0.38 . . . . 0.0 110.335 -179.593 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 51.4 ttp -60.16 -48.45 81.68 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.296 -179.722 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 139' ' ' SER . . . . . 0.463 ' CB ' ' H ' ' A' ' 128' ' ' GLU . 57.1 m -60.72 -35.47 76.41 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.7 179.92 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -68.82 -49.28 59.8 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.888 0.375 . . . . 0.0 110.825 179.727 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -60.07 -25.61 65.52 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.645 -179.559 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 30.7 mmtm -68.04 -43.33 78.98 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.87 179.311 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 3.3 t -62.39 -45.42 98.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.576 -179.116 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -63.12 -49.14 75.58 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-O 120.875 0.369 . . . . 0.0 111.012 -179.755 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 145' ' ' PHE . . . . . . . . . . . . . 49.7 t80 -61.53 -44.52 96.9 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.84 -179.367 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 146' ' ' MET . . . . . . . . . . . . . 72.6 mmm -64.36 -40.26 95.5 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.794 0.33 . . . . 0.0 110.883 -179.537 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 16.3 m -69.78 -41.85 74.58 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.935 179.934 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 148' ' ' ILE . . . . . . . . . . . . . 48.1 mt -56.49 -32.58 36.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.369 -179.78 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 55.4 mtpt . . . . . 0 C--N 1.327 -0.409 0 C-N-CA 120.618 -0.433 . . . . 0.0 110.486 -179.989 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . 0.514 ' C ' ' H ' ' A' ' 84' ' ' LYS . . . . . . . . 0 N--CA 1.449 -0.504 0 CA-C-O 121.167 0.508 . . . . 0.0 110.155 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 2.2 m-85 -46.61 -16.04 0.03 OUTLIER 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.033 179.605 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . 0.514 ' H ' ' C ' ' A' ' 82' ' ' ALA . 68.6 mttm -65.06 -42.37 94.27 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.004 179.604 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 89.9 m-20 -63.72 -45.77 88.46 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.478 -179.66 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 6.4 tt -61.98 -41.55 98.15 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.793 -179.741 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 37.6 mt -56.76 -37.04 70.52 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.115 -179.618 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 88.1 mt-30 -71.97 -32.68 67.51 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.415 179.737 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 78.5 mm-40 -65.01 -46.6 80.72 Favored 'General case' 0 CA--C 1.522 -0.102 0 C-N-CA 120.761 -0.375 . . . . 0.0 111.087 -179.048 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . 0.419 HG13 ' N ' ' A' ' 91' ' ' ALA . 18.1 pt -65.2 -44.45 95.25 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.703 -179.804 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . 0.504 ' O ' ' N ' ' A' ' 95' ' ' SER . . . -68.14 -47.77 67.18 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.538 -179.446 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 58.3 tt0 -64.78 -46.25 82.87 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.689 -179.809 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 66.3 tttm -61.67 -47.17 86.55 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.675 -179.923 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 80.9 mm-40 -92.94 8.47 39.65 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.408 -179.953 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' SER . . . . . 0.504 ' N ' ' O ' ' A' ' 91' ' ' ALA . 5.9 p 41.14 42.67 1.71 Allowed 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 120.848 0.356 . . . . 0.0 110.497 -179.882 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 18.7 p -92.74 39.43 1.04 Allowed 'General case' 0 CA--C 1.513 -0.466 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.788 -179.518 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 43.3 mt 69.4 100.4 0.06 Allowed 'General case' 0 CA--C 1.52 -0.21 0 O-C-N 123.451 0.469 . . . . 0.0 110.907 179.888 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 10.0 mp -44.85 155.06 0.41 Allowed Pre-proline 0 N--CA 1.452 -0.34 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.676 179.852 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_endo -64.8 170.17 10.49 Favored 'Trans proline' 0 C--N 1.305 -1.713 0 C-N-CA 122.791 2.328 . . . . 0.0 111.901 179.529 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 36.9 t80 -144.97 116.79 8.22 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.446 178.966 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 98.5 m-85 -98.77 131.95 44.51 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.918 0.39 . . . . 0.0 110.287 179.976 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -141.63 143.17 33.5 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.357 179.842 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 95.9 m -123.1 128.77 50.56 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.316 179.954 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -105.2 134.41 48.35 Favored 'General case' 0 CA--C 1.522 -0.108 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.271 179.714 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 19.4 p -115.21 123.95 50.16 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-O 120.897 0.379 . . . . 0.0 110.463 179.828 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 106' ' ' SER . . . . . 0.418 ' HG ' ' N ' ' A' ' 107' ' ' GLY . 35.1 t -167.41 151.96 6.89 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.352 179.945 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . 0.418 ' N ' ' HG ' ' A' ' 106' ' ' SER . . . 132.69 168.43 11.99 Favored Glycine 0 CA--C 1.522 0.491 0 N-CA-C 110.934 -0.867 . . . . 0.0 110.934 179.714 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 22.0 Cg_endo -61.46 151.38 80.12 Favored 'Trans proline' 0 C--N 1.303 -1.825 0 C-N-CA 122.814 2.342 . . . . 0.0 112.122 179.421 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 5.9 m -65.04 -17.42 64.44 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.031 -0.532 . . . . 0.0 110.254 179.395 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 93.4 m-70 -90.83 -41.91 10.94 Favored 'General case' 0 CA--C 1.52 -0.203 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.441 179.817 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -124.36 77.85 61.47 Favored Pre-proline 0 CA--C 1.531 0.248 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.356 179.508 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -76.46 160.72 35.13 Favored 'Trans proline' 0 C--N 1.304 -1.801 0 C-N-CA 122.681 2.254 . . . . 0.0 112.492 179.884 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 24.5 p -155.8 150.3 25.95 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.56 179.423 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -132.59 146.05 51.59 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.352 179.98 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 91.6 m -126.12 121.33 32.56 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 116.175 -0.466 . . . . 0.0 109.878 179.197 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 116' ' ' SER . . . . . 0.516 ' HG ' ' C ' ' A' ' 136' ' ' ALA . 10.4 p -95.76 121.75 37.81 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.601 179.927 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 52.6 m -115.77 130.67 56.94 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.044 179.944 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 9.8 p -112.59 143.79 21.62 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.267 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.208 179.994 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 84.0 tt0 -129.59 138.07 51.06 Favored 'General case' 0 CA--C 1.52 -0.189 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.632 -179.98 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . 0.627 ' CZ ' ' CE1' ' A' ' 125' ' ' PHE . 49.9 p90 -170.19 160.32 7.86 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.527 179.5 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 52.35 19.11 1.04 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.883 0.373 . . . . 0.0 110.559 179.419 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 79.55 20.37 69.04 Favored Glycine 0 CA--C 1.522 0.487 0 N-CA-C 111.353 -0.699 . . . . 0.0 111.353 179.697 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -131.9 150.8 52.05 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.661 0.267 . . . . 0.0 110.384 -179.96 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 7.8 p -119.59 126.41 75.3 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.312 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.972 -179.848 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 125' ' ' PHE . . . . . 0.627 ' CE1' ' CZ ' ' A' ' 120' ' ' PHE . 33.6 m-85 -110.83 118.2 35.49 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.112 179.805 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 11.3 p -76.64 125.25 28.92 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.479 -179.863 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -78.31 -172.67 40.67 Favored Glycine 0 CA--C 1.525 0.666 0 N-CA-C 110.904 -0.878 . . . . 0.0 110.904 179.914 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 18.9 mm-40 -79.62 169.81 17.46 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.649 0.262 . . . . 0.0 110.813 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 129' ' ' GLU . . . . . 0.498 ' CD ' ' H ' ' A' ' 129' ' ' GLU . 1.3 pm0 -109.33 139.17 44.62 Favored 'General case' 0 N--CA 1.464 0.262 0 N-CA-C 109.721 -0.474 . . . . 0.0 109.721 179.516 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -173.2 169.54 4.52 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.729 -179.994 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 22.6 pttp -86.86 36.34 0.72 Allowed 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.282 178.598 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 1.7 t -154.39 147.75 24.98 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.972 0.415 . . . . 0.0 110.665 -179.854 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -84.08 -25.61 29.66 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.027 179.594 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -66.22 -49.33 67.61 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.32 -178.496 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 4.2 tp -65.18 -42.59 93.49 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.573 -179.296 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 136' ' ' ALA . . . . . 0.516 ' C ' ' HG ' ' A' ' 116' ' ' SER . . . -62.81 -54.92 31.52 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.391 -179.125 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -57.31 -46.24 83.41 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.739 0.304 . . . . 0.0 110.572 -179.965 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 36.8 ttm -62.98 -39.34 94.41 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.259 -179.969 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 37.5 m -63.01 -38.85 92.86 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.831 179.8 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -62.4 -40.62 97.1 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.622 -179.909 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -68.38 -27.15 65.98 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.911 -179.807 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 92.6 mttt -72.12 -51.1 23.03 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.802 179.233 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 7.2 p -66.6 -41.28 88.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.742 -179.625 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -64.07 -46.54 83.88 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.59 -179.798 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 145' ' ' PHE . . . . . . . . . . . . . 71.2 t80 -60.52 -42.66 96.89 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.41 -179.74 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 146' ' ' MET . . . . . 0.451 ' C ' ' SD ' ' A' ' 146' ' ' MET . 14.9 tmm? -61.63 -38.66 88.49 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.8 -179.742 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 6.8 t -69.22 -44.58 71.74 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.916 0.389 . . . . 0.0 110.976 179.874 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 148' ' ' ILE . . . . . 0.42 HG23 HD11 ' A' ' 148' ' ' ILE . 86.4 mt -56.17 -31.1 31.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.737 -179.466 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 55.0 mtpt . . . . . 0 C--N 1.326 -0.433 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.69 -179.939 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . 0.511 ' C ' ' H ' ' A' ' 84' ' ' LYS . . . . . . . . 0 N--CA 1.449 -0.504 0 CA-C-O 121.26 0.552 . . . . 0.0 110.026 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -46.68 -16.3 0.03 OUTLIER 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.71 -0.677 . . . . 0.0 109.831 179.674 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . 0.511 ' H ' ' C ' ' A' ' 82' ' ' ALA . 68.6 mttm -63.89 -41.98 97.57 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.953 179.709 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 65.7 t30 -66.38 -46.44 76.69 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.599 179.91 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 2.6 tp -60.59 -42.69 97.25 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.374 -179.482 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 34.1 mt -56.54 -34.81 67.42 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.152 -179.497 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 99.2 mt-30 -71.74 -35.58 70.17 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.42 179.38 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 94.9 mt-10 -61.7 -48.95 78.44 Favored 'General case' 0 C--O 1.231 0.09 0 CA-C-O 120.913 0.387 . . . . 0.0 111.107 -178.887 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 21.8 pt -62.3 -36.76 76.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.506 -179.929 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -58.18 -47.6 82.91 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.572 -179.518 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 76.1 mm-40 -64.55 -49.09 72.59 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.707 179.973 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 19.3 tptm -62.18 -48.07 81.68 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.724 -179.457 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -71.88 -15.37 62.11 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.429 -179.984 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 1.9 p 74.54 15.52 3.36 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.473 -179.723 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 11.2 p -84.26 161.91 20.32 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.676 -179.984 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 60.2 mt -61.62 124.68 21.37 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.493 -179.948 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . 0.455 ' N ' ' CD1' ' A' ' 98' ' ' LEU . 9.4 mp -49.09 147.93 4.55 Favored Pre-proline 0 C--N 1.326 -0.436 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.706 -179.513 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_endo -68.45 140.11 47.08 Favored 'Trans proline' 0 C--N 1.311 -1.405 0 C-N-CA 122.508 2.138 . . . . 0.0 112.009 179.452 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 85.9 t80 -132.36 133.84 44.46 Favored 'General case' 0 CA--C 1.517 -0.322 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 179.819 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 45.0 m-85 -103.35 149.32 24.87 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.35 -179.303 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -152.27 93.5 1.82 Allowed 'General case' 0 C--O 1.234 0.265 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.175 179.883 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -70.93 138.95 50.5 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.178 179.848 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -126.59 152.77 46.18 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.209 179.945 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 43.4 p -105.93 134.6 48.79 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-O 120.819 0.342 . . . . 0.0 110.414 179.798 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 51.0 p -161.7 161.0 29.24 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.229 179.902 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 116.83 -176.9 16.49 Favored Glycine 0 CA--C 1.523 0.584 0 N-CA-C 110.889 -0.884 . . . . 0.0 110.889 179.789 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -62.43 152.59 76.19 Favored 'Trans proline' 0 C--N 1.307 -1.644 0 C-N-CA 122.627 2.218 . . . . 0.0 112.298 -179.717 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 78.7 p -67.66 -15.35 63.6 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 109.46 -0.57 . . . . 0.0 109.46 178.833 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 77.2 m80 -90.13 -43.76 10.24 Favored 'General case' 0 CA--C 1.519 -0.242 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.546 179.981 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -124.89 78.67 65.2 Favored Pre-proline 0 N--CA 1.462 0.17 0 CA-C-N 116.018 -0.537 . . . . 0.0 109.636 179.011 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -82.0 126.91 5.22 Favored 'Trans proline' 0 C--N 1.306 -1.686 0 C-N-CA 122.467 2.112 . . . . 0.0 112.168 -179.716 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 3.9 p -108.16 172.9 6.57 Favored 'General case' 0 CA--C 1.516 -0.339 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.078 179.756 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 1.2 m-85 -131.1 145.46 52.0 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.448 -179.743 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 89.7 m -128.98 123.8 33.37 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.035 179.368 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 116' ' ' SER . . . . . 0.414 ' OG ' ' O ' ' A' ' 136' ' ' ALA . 93.6 p -92.06 119.37 31.69 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.731 -179.865 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 91.2 m -106.22 123.54 48.2 Favored 'General case' 0 N--CA 1.465 0.301 0 N-CA-C 109.991 -0.374 . . . . 0.0 109.991 179.921 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 7.5 p -109.7 137.81 40.15 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.301 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.144 -179.946 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 82.8 tt0 -123.47 131.29 53.6 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.707 -179.907 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . 0.626 ' CZ ' ' CE1' ' A' ' 125' ' ' PHE . 47.2 p90 -166.53 157.34 12.49 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.428 179.504 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 53.93 21.72 2.98 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.915 0.388 . . . . 0.0 110.494 179.667 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 75.45 21.51 77.28 Favored Glycine 0 CA--C 1.522 0.499 0 N-CA-C 111.024 -0.83 . . . . 0.0 111.024 -179.991 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -132.51 152.95 51.39 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.536 0.208 . . . . 0.0 110.509 179.944 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 12.0 p -122.49 128.27 75.33 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.232 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.776 -179.914 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 125' ' ' PHE . . . . . 0.626 ' CE1' ' CZ ' ' A' ' 120' ' ' PHE . 25.5 m-85 -114.02 123.46 49.75 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.257 179.673 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 96.0 p -83.29 137.36 34.02 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.531 -179.912 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -85.12 -171.48 48.28 Favored Glycine 0 CA--C 1.521 0.424 0 N-CA-C 110.711 -0.955 . . . . 0.0 110.711 179.93 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . 0.42 ' O ' ' CG ' ' A' ' 128' ' ' GLU . 9.7 pt-20 -92.74 127.57 38.29 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-O 121.003 0.43 . . . . 0.0 110.858 -179.823 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 129' ' ' GLU . . . . . 0.53 ' CD ' ' H ' ' A' ' 129' ' ' GLU . 1.2 pm0 -54.64 145.34 19.3 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 121.066 0.46 . . . . 0.0 110.695 179.305 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -171.66 163.15 6.53 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.645 179.884 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 51.8 tttm -89.2 33.91 0.8 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.986 0.422 . . . . 0.0 110.301 179.447 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -154.43 143.05 20.77 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.667 -179.644 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -78.91 -45.65 20.11 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.247 179.938 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 43.9 pttt -53.32 -46.71 69.56 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.539 -179.433 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 4.1 tp -66.69 -42.11 87.01 Favored 'General case' 0 N--CA 1.443 -0.78 0 CA-C-O 120.741 0.305 . . . . 0.0 110.942 -179.756 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 136' ' ' ALA . . . . . 0.414 ' O ' ' OG ' ' A' ' 116' ' ' SER . . . -59.55 -51.96 67.62 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.48 -179.381 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 95.6 mt-10 -55.77 -44.0 77.26 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.384 -179.667 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 47.9 ttp -61.54 -42.54 98.97 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.266 -179.739 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 23.3 m -63.16 -39.01 93.43 Favored 'General case' 0 CA--C 1.519 -0.221 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.954 -179.841 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -64.27 -44.89 90.32 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.009 0.433 . . . . 0.0 110.589 -179.788 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -72.16 -24.17 61.39 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.389 179.934 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 63.4 tttp -71.11 -48.89 49.68 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.293 179.867 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 7.5 p -68.34 -37.75 78.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.698 -179.734 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -62.9 -44.59 95.67 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.781 -179.544 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 145' ' ' PHE . . . . . . . . . . . . . 60.6 t80 -59.9 -43.12 95.02 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.739 -179.39 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 146' ' ' MET . . . . . . . . . . . . . 47.1 ttp -61.26 -39.43 90.34 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.732 0.301 . . . . 0.0 110.848 -179.242 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 12.2 t -67.44 -44.62 78.25 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.966 -179.999 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 148' ' ' ILE . . . . . . . . . . . . . 91.4 mt -56.22 -33.47 37.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.695 -179.665 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 56.0 mtpt . . . . . 0 C--N 1.324 -0.505 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.797 -179.929 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . 0.51 ' C ' ' H ' ' A' ' 84' ' ' LYS . . . . . . . . 0 N--CA 1.449 -0.483 0 CA-C-O 121.075 0.464 . . . . 0.0 110.086 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 -46.7 -16.06 0.03 OUTLIER 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.027 179.533 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . 0.51 ' H ' ' C ' ' A' ' 82' ' ' ALA . 99.4 mttt -64.72 -41.07 96.25 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.844 -0.617 . . . . 0.0 110.125 179.69 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 14.3 m120 -66.71 -47.2 73.1 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.692 -179.823 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 5.8 tt -60.82 -42.96 98.72 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.723 -179.406 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 33.8 mt -55.86 -35.23 66.22 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.259 -179.56 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 88.8 mt-30 -70.71 -34.0 71.45 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.303 179.459 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 80.9 mm-40 -63.95 -49.98 70.42 Favored 'General case' 0 C--O 1.231 0.098 0 C-N-CA 120.608 -0.437 . . . . 0.0 111.188 -178.807 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 30.8 pt -63.37 -35.39 72.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.515 179.982 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -58.53 -48.88 79.38 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.666 -179.187 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 87.6 mt-30 -66.09 -43.94 85.83 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.776 179.932 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 88.9 tttt -63.47 -48.32 78.14 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.478 -179.84 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . 0.41 ' O ' ' OG ' ' A' ' 95' ' ' SER . 98.4 mt-10 -72.87 -10.11 59.44 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.31 -179.937 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' SER . . . . . 0.41 ' OG ' ' O ' ' A' ' 94' ' ' GLU . 2.0 p 74.08 8.53 4.7 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.462 -179.881 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 10.0 p -77.66 164.14 25.57 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.322 179.93 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . 0.469 ' N ' ' CD1' ' A' ' 97' ' ' LEU . 9.6 mp -68.31 128.23 35.81 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.981 0.42 . . . . 0.0 110.422 -179.555 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . 0.417 ' N ' ' CD1' ' A' ' 98' ' ' LEU . 10.7 mp -46.39 148.54 1.6 Allowed Pre-proline 0 N--CA 1.448 -0.54 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.822 -179.846 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_endo -69.02 140.3 45.08 Favored 'Trans proline' 0 C--N 1.311 -1.42 0 C-N-CA 122.649 2.232 . . . . 0.0 112.072 179.834 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 49.9 t80 -132.27 132.39 42.99 Favored 'General case' 0 C--O 1.235 0.338 0 N-CA-C 109.696 -0.483 . . . . 0.0 109.696 179.823 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 33.7 m-85 -101.94 149.08 24.58 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.755 -179.578 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -142.27 91.38 2.33 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-O 120.991 0.424 . . . . 0.0 111.349 179.918 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 43.6 m -71.52 133.19 45.64 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.085 179.655 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -138.17 161.31 37.16 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 110.136 -0.32 . . . . 0.0 110.136 -179.969 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 37.4 p -100.72 134.96 42.91 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-O 120.906 0.384 . . . . 0.0 110.508 179.743 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 106' ' ' SER . . . . . 0.415 ' O ' ' OG1' ' A' ' 113' ' ' THR . 34.1 p -160.75 163.64 32.15 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.473 -179.899 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 119.83 -165.13 13.49 Favored Glycine 0 CA--C 1.526 0.723 0 N-CA-C 111.128 -0.789 . . . . 0.0 111.128 179.583 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_endo -70.2 150.72 65.96 Favored 'Trans proline' 0 C--N 1.306 -1.668 0 C-N-CA 122.61 2.207 . . . . 0.0 112.453 -179.422 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 77.8 p -68.47 -20.02 64.59 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.243 178.729 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 73.0 m80 -85.23 -37.88 19.58 Favored 'General case' 0 CA--C 1.518 -0.251 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.413 179.706 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -126.91 78.29 73.96 Favored Pre-proline 0 N--CA 1.465 0.291 0 CA-C-O 121.18 0.515 . . . . 0.0 110.396 178.76 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -62.63 122.46 10.82 Favored 'Trans proline' 0 C--N 1.301 -1.966 0 C-N-CA 122.315 2.01 . . . . 0.0 112.367 -179.693 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 113' ' ' THR . . . . . 0.415 ' OG1' ' O ' ' A' ' 106' ' ' SER . 40.8 p -111.69 173.96 6.1 Favored 'General case' 0 CA--C 1.515 -0.391 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.198 179.638 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 1.6 m-85 -130.28 144.37 51.33 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.506 -179.579 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 86.1 m -131.26 127.55 38.03 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.479 179.514 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 10.5 t -97.73 122.01 40.31 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.419 -179.934 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 98.5 m -107.78 127.7 53.94 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.183 -179.95 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 7.4 p -111.82 139.24 37.16 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.303 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.239 -179.945 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 84.1 tt0 -124.27 131.21 53.51 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.53 179.736 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . 0.612 ' CZ ' ' CE1' ' A' ' 125' ' ' PHE . 45.2 p90 -167.84 159.1 11.31 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.177 179.249 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 54.57 20.84 3.05 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.145 0.498 . . . . 0.0 109.767 -179.908 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 72.73 23.56 77.68 Favored Glycine 0 CA--C 1.521 0.448 0 N-CA-C 110.937 -0.865 . . . . 0.0 110.937 -179.77 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 62.9 mttp -132.6 152.25 51.69 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.587 0.232 . . . . 0.0 110.382 -179.884 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 12.7 p -120.19 127.26 75.89 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.167 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.926 -179.742 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 125' ' ' PHE . . . . . 0.612 ' CE1' ' CZ ' ' A' ' 120' ' ' PHE . 39.2 m-85 -112.74 119.88 39.57 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.079 179.312 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 6.8 m -82.26 138.43 34.6 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.638 -179.998 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -86.65 -168.21 44.56 Favored Glycine 0 CA--C 1.523 0.532 0 N-CA-C 110.646 -0.981 . . . . 0.0 110.646 179.724 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -98.87 133.26 43.41 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.819 0.342 . . . . 0.0 110.522 -179.87 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -57.33 148.09 23.93 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.072 0.463 . . . . 0.0 110.545 179.068 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -170.78 162.74 7.72 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.811 179.818 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 97.2 mttt -88.35 32.79 0.76 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.369 179.22 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 3.1 t -158.43 151.4 22.56 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.741 179.877 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 68.9 mttm -81.56 -36.32 29.22 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.083 0.468 . . . . 0.0 110.442 179.508 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 30.7 mmtp -53.42 -54.28 39.08 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.828 -178.979 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 4.4 tp -64.89 -40.5 95.2 Favored 'General case' 0 N--CA 1.446 -0.639 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.066 -179.906 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -55.64 -54.63 41.81 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.659 -179.172 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 97.3 mt-10 -60.96 -40.01 91.73 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.733 0.302 . . . . 0.0 110.404 -179.458 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 48.2 ttp -62.48 -46.68 87.35 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.735 -179.595 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 68.8 m -61.95 -39.07 90.85 Favored 'General case' 0 CA--C 1.518 -0.269 0 CA-C-N 116.554 -0.294 . . . . 0.0 110.965 -179.356 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -63.66 -46.05 87.37 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.981 0.419 . . . . 0.0 110.563 -179.879 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -72.35 -23.5 61.15 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.563 -179.973 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 66.2 tttm -70.35 -48.63 55.53 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.054 0.454 . . . . 0.0 111.428 179.713 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 6.9 p -67.94 -36.41 75.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.614 -179.631 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -64.07 -45.01 90.64 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.614 -179.334 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 145' ' ' PHE . . . . . . . . . . . . . 62.1 t80 -60.46 -41.92 95.13 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.505 -179.615 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 146' ' ' MET . . . . . . . . . . . . . 47.9 ttp -63.74 -40.04 95.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.689 -179.648 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 67.8 m -68.27 -43.64 77.35 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.913 -179.885 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 148' ' ' ILE . . . . . 0.411 HG22 HD13 ' A' ' 148' ' ' ILE . 78.5 mt -55.77 -31.85 30.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.704 -179.686 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 54.3 mtpt . . . . . 0 C--N 1.326 -0.429 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.462 179.85 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . 0.519 ' C ' ' H ' ' A' ' 84' ' ' LYS . . . . . . . . 0 N--CA 1.45 -0.461 0 CA-C-O 121.245 0.545 . . . . 0.0 109.968 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -47.48 -15.99 0.06 Allowed 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.616 -0.72 . . . . 0.0 109.777 179.633 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . 0.519 ' H ' ' C ' ' A' ' 82' ' ' ALA . 99.3 mttt -64.59 -41.84 95.98 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.038 179.958 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 57.0 t-20 -65.01 -46.47 81.27 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.615 -179.625 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 5.8 tt -61.21 -41.8 97.48 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.896 -179.665 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 34.9 mt -57.01 -37.18 71.33 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.223 -0.444 . . . . 0.0 109.939 -179.565 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 87.0 mt-30 -71.29 -34.78 70.96 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.413 179.395 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -63.0 -46.6 86.89 Favored 'General case' 0 N--CA 1.462 0.158 0 C-N-CA 120.727 -0.389 . . . . 0.0 111.412 -179.163 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . 0.417 HG13 ' N ' ' A' ' 91' ' ' ALA . 17.5 pt -64.93 -44.15 96.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.891 -179.876 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . 0.474 ' O ' ' N ' ' A' ' 95' ' ' SER . . . -67.21 -47.68 70.15 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.955 -179.643 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 52.0 tt0 -66.85 -45.08 79.31 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.83 -179.921 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 88.9 tttt -62.87 -46.98 85.32 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.577 -179.865 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 70.0 mm-40 -90.85 2.1 56.42 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.328 -179.645 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' SER . . . . . 0.474 ' N ' ' O ' ' A' ' 91' ' ' ALA . 3.2 t 40.99 78.01 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.488 179.911 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' SER . . . . . 0.416 ' O ' ' CB ' ' A' ' 97' ' ' LEU . 67.0 p -136.44 38.59 2.68 Favored 'General case' 0 CA--C 1.513 -0.462 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.485 -179.702 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . 0.416 ' CB ' ' O ' ' A' ' 96' ' ' SER . 3.2 tp 78.15 94.47 0.06 Allowed 'General case' 0 N--CA 1.454 -0.254 0 CA-C-O 120.896 0.379 . . . . 0.0 111.026 179.514 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . 0.403 ' N ' ' CD1' ' A' ' 98' ' ' LEU . 10.8 mp -44.99 148.8 0.93 Allowed Pre-proline 0 C--N 1.326 -0.428 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.484 -179.784 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_endo -68.99 138.3 39.94 Favored 'Trans proline' 0 N--CA 1.495 1.591 0 C-N-CA 122.53 2.154 . . . . 0.0 112.174 -179.879 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 90.8 t80 -125.56 127.32 46.19 Favored 'General case' 0 CA--C 1.513 -0.463 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 179.991 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 92.8 m-85 -93.78 141.26 28.7 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.5 -179.182 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -136.7 138.0 40.57 Favored 'General case' 0 CA--C 1.514 -0.424 0 N-CA-C 110.064 -0.347 . . . . 0.0 110.064 179.619 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 25.2 m -120.31 126.6 50.94 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.455 -179.963 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -127.31 153.57 46.01 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.092 179.654 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 33.7 p -102.69 133.41 47.77 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-O 120.879 0.371 . . . . 0.0 110.196 179.836 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 50.8 p -162.7 166.36 24.51 Favored 'General case' 0 CA--C 1.515 -0.403 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.273 -179.745 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 120.58 -163.2 14.26 Favored Glycine 0 CA--C 1.527 0.79 0 N-CA-C 111.153 -0.779 . . . . 0.0 111.153 179.572 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 40.9 Cg_endo -69.53 147.42 64.28 Favored 'Trans proline' 0 N--CA 1.494 1.533 0 C-N-CA 122.59 2.193 . . . . 0.0 112.335 -179.324 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 78.8 p -68.5 -16.69 63.97 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.848 179.092 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 95.8 m-70 -86.01 -41.32 14.94 Favored 'General case' 0 CA--C 1.516 -0.364 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.181 179.998 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -126.96 78.33 74.11 Favored Pre-proline 0 N--CA 1.467 0.418 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.264 178.562 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_exo -59.92 125.68 18.33 Favored 'Trans proline' 0 C--N 1.304 -1.78 0 C-N-CA 122.465 2.11 . . . . 0.0 112.395 -179.693 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 69.1 p -111.57 173.83 6.16 Favored 'General case' 0 CA--C 1.514 -0.416 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.097 179.825 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 -132.1 146.66 52.19 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.651 -179.714 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 86.4 m -129.55 124.38 33.72 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.023 179.446 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 60.3 m -94.75 121.93 36.85 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.538 -179.953 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 117' ' ' THR . . . . . 0.427 ' CG2' ' CG2' ' A' ' 124' ' ' VAL . 81.3 m -112.92 127.29 56.16 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.218 -179.891 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 11.9 p -112.89 144.91 19.62 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.23 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.015 -179.792 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 82.9 tt0 -126.28 133.03 51.54 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.695 -179.867 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . 0.628 ' CZ ' ' CE1' ' A' ' 125' ' ' PHE . 48.7 p90 -166.73 157.96 12.59 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.508 179.478 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 53.38 19.98 1.81 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.871 0.367 . . . . 0.0 110.755 179.599 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 77.51 21.43 72.48 Favored Glycine 0 CA--C 1.524 0.655 0 N-CA-C 111.131 -0.788 . . . . 0.0 111.131 179.872 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -132.67 152.04 51.8 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 110.198 -0.297 . . . . 0.0 110.198 179.917 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . 0.427 ' CG2' ' CG2' ' A' ' 117' ' ' THR . 13.1 p -120.69 127.69 75.96 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.301 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.861 -179.804 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 125' ' ' PHE . . . . . 0.628 ' CE1' ' CZ ' ' A' ' 120' ' ' PHE . 53.0 m-85 -113.08 120.12 40.2 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.159 179.879 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 72.0 m -83.32 138.78 33.4 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.468 179.955 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -85.0 -169.38 45.92 Favored Glycine 0 CA--C 1.52 0.379 0 N-CA-C 110.591 -1.004 . . . . 0.0 110.591 179.871 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . 0.411 ' OE2' ' OG ' ' A' ' 139' ' ' SER . 6.6 pt-20 -97.34 132.99 42.54 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-O 120.839 0.352 . . . . 0.0 110.95 -179.711 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 98.1 mt-10 -55.38 146.0 20.8 Favored 'General case' 0 C--N 1.32 -0.717 0 C-N-CA 120.508 -0.477 . . . . 0.0 110.484 179.522 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -169.53 160.4 9.04 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.524 -179.997 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 29.3 ttpt -91.12 32.48 1.02 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.044 0.449 . . . . 0.0 110.479 179.789 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 132' ' ' THR . . . . . 0.415 ' HG1' ' CG ' ' A' ' 134' ' ' LYS . 0.4 OUTLIER -151.49 140.9 21.51 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.573 -179.75 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 28.6 ttmt -74.66 -47.08 33.86 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.352 179.885 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . 0.415 ' CG ' ' HG1' ' A' ' 132' ' ' THR . 47.1 pttt -53.7 -46.22 70.66 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.509 -179.252 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 4.7 tp -65.32 -39.44 92.45 Favored 'General case' 0 N--CA 1.444 -0.768 0 CA-C-O 120.811 0.338 . . . . 0.0 110.977 -179.678 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -57.68 -52.06 66.97 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.745 -179.311 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 69.9 mm-40 -57.85 -41.26 82.02 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.866 0.365 . . . . 0.0 110.608 -179.75 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 94.8 mtp -63.81 -41.39 97.88 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.575 -179.789 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 139' ' ' SER . . . . . 0.411 ' OG ' ' OE2' ' A' ' 128' ' ' GLU . 15.2 m -64.05 -39.2 93.54 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-N 116.544 -0.298 . . . . 0.0 110.72 -179.687 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -65.69 -44.38 86.36 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.819 -179.896 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -71.74 -24.79 61.84 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.568 179.983 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 38.1 ttmt -71.24 -48.56 50.39 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.201 179.773 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 7.1 p -70.11 -37.81 73.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.799 -179.626 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -63.89 -47.08 82.06 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-O 120.838 0.352 . . . . 0.0 110.801 -179.764 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 145' ' ' PHE . . . . . . . . . . . . . 63.7 t80 -60.55 -43.47 97.19 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.795 179.935 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 146' ' ' MET . . . . . . . . . . . . . 63.9 ttp -60.24 -38.64 84.05 Favored 'General case' 0 C--N 1.327 -0.407 0 O-C-N 123.331 0.394 . . . . 0.0 111.077 -179.433 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 48.8 m -72.26 -42.61 65.4 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.165 179.81 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 148' ' ' ILE . . . . . . . . . . . . . 71.9 mt -54.87 -25.33 15.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.63 -179.695 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 36.6 mtmt . . . . . 0 C--N 1.319 -0.728 0 C-N-CA 120.573 -0.451 . . . . 0.0 110.556 -179.617 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . 0.511 ' C ' ' H ' ' A' ' 84' ' ' LYS . . . . . . . . 0 N--CA 1.45 -0.45 0 CA-C-O 120.895 0.379 . . . . 0.0 110.379 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 -46.63 -15.83 0.03 OUTLIER 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.203 179.509 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . 0.511 ' H ' ' C ' ' A' ' 82' ' ' ALA . 63.8 mttp -64.45 -41.64 96.43 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.182 179.311 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 14.6 m120 -65.29 -47.14 77.68 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.522 -179.33 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 7.0 tt -59.74 -43.65 94.16 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.692 -179.126 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 59.0 mt -55.93 -35.56 66.76 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.523 -179.937 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 88.9 mt-30 -70.84 -34.98 72.24 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.425 179.496 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -63.78 -48.12 78.22 Favored 'General case' 0 C--O 1.23 0.054 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.001 -178.794 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 29.8 pt -66.48 -35.09 74.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.606 179.919 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -58.05 -49.65 76.17 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.36 -179.398 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 56.8 tt0 -65.19 -44.26 88.96 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.707 -179.656 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 65.2 tttm -63.43 -47.15 83.12 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.557 -179.938 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -76.47 -0.45 23.0 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.351 -179.825 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 3.9 t 65.49 7.4 4.33 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.653 -179.813 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 26.0 m -75.15 158.03 33.69 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.483 -179.93 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . 0.437 ' N ' ' CD1' ' A' ' 97' ' ' LEU . 10.2 mp -64.39 128.19 34.7 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.398 -179.789 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . 0.446 ' N ' ' CD1' ' A' ' 98' ' ' LEU . 10.2 mp -50.13 148.02 6.52 Favored Pre-proline 0 N--CA 1.451 -0.396 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.609 179.764 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -71.08 142.96 43.35 Favored 'Trans proline' 0 C--N 1.311 -1.401 0 C-N-CA 122.772 2.314 . . . . 0.0 112.173 179.539 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 74.4 t80 -130.72 132.96 45.66 Favored 'General case' 0 C--O 1.233 0.237 0 N-CA-C 109.809 -0.441 . . . . 0.0 109.809 -179.994 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 39.0 m-85 -103.81 149.53 24.96 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.655 -179.734 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -150.02 92.99 1.95 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.924 0.392 . . . . 0.0 111.025 -179.908 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 103' ' ' THR . . . . . 0.417 ' OG1' ' NZ ' ' A' ' 133' ' ' LYS . 0.0 OUTLIER -70.4 136.99 50.07 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.195 179.911 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -128.25 153.32 47.08 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 120.866 0.365 . . . . 0.0 110.244 179.873 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 35.0 p -103.86 135.71 44.89 Favored 'General case' 0 N--CA 1.455 -0.208 0 CA-C-O 120.912 0.387 . . . . 0.0 110.642 179.9 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 24.8 m -163.1 161.81 25.41 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.447 179.987 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 116.68 -175.07 15.55 Favored Glycine 0 CA--C 1.522 0.52 0 N-CA-C 111.035 -0.826 . . . . 0.0 111.035 179.592 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_endo -64.66 152.22 82.72 Favored 'Trans proline' 0 C--N 1.301 -1.962 0 C-N-CA 122.725 2.283 . . . . 0.0 112.251 -179.904 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 78.1 p -66.39 -19.29 65.76 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.351 178.93 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 57.7 t-80 -86.84 -43.65 12.31 Favored 'General case' 0 CA--C 1.52 -0.188 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.541 179.821 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -124.66 77.75 63.9 Favored Pre-proline 0 N--CA 1.463 0.211 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.261 179.19 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -78.94 128.5 8.44 Favored 'Trans proline' 0 C--N 1.305 -1.716 0 C-N-CA 122.595 2.197 . . . . 0.0 112.375 -179.452 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 2.9 p -109.68 173.7 6.2 Favored 'General case' 0 CA--C 1.517 -0.305 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.321 179.485 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -131.25 143.89 50.9 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.526 -179.657 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 88.3 m -127.13 125.5 41.3 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.642 179.489 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 7.3 t -97.27 120.4 37.56 Favored 'General case' 0 CA--C 1.518 -0.258 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.389 -179.958 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 94.9 m -105.93 127.37 53.09 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.163 179.916 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 8.8 p -110.2 137.14 43.82 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.271 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.272 -179.901 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 9.1 tm-20 -124.16 130.42 52.52 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.613 -179.909 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . 0.626 ' CZ ' ' CE1' ' A' ' 125' ' ' PHE . 45.4 p90 -164.93 158.12 16.8 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.566 179.006 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 53.61 23.42 3.56 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.606 179.819 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 73.85 22.49 78.06 Favored Glycine 0 CA--C 1.521 0.461 0 N-CA-C 110.881 -0.888 . . . . 0.0 110.881 179.874 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -133.25 153.81 51.22 Favored 'General case' 0 CA--C 1.516 -0.337 0 CA-C-O 120.889 0.376 . . . . 0.0 110.606 179.789 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 7.2 p -122.2 128.61 75.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.862 -179.75 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 125' ' ' PHE . . . . . 0.626 ' CE1' ' CZ ' ' A' ' 120' ' ' PHE . 26.1 m-85 -113.33 122.33 47.09 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.249 179.408 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 4.8 p -81.97 136.64 35.26 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.512 -179.898 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -88.86 -170.26 45.23 Favored Glycine 0 CA--C 1.522 0.51 0 N-CA-C 110.785 -0.926 . . . . 0.0 110.785 179.902 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . 0.433 ' H ' ' CB ' ' A' ' 139' ' ' SER . 14.9 tt0 -96.55 133.98 40.34 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-O 120.872 0.368 . . . . 0.0 110.71 179.581 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -58.93 149.39 27.27 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.501 179.209 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -171.17 160.78 6.46 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.613 179.982 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -86.59 33.55 0.64 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.624 179.011 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 4.6 t -158.42 150.82 21.92 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.579 179.833 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . 0.417 ' NZ ' ' OG1' ' A' ' 103' ' ' THR . 68.4 mttm -82.41 -21.85 35.59 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.741 179.66 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -68.92 -54.79 13.52 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.774 -179.106 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 4.3 tp -63.61 -41.67 98.3 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 116.51 -0.314 . . . . 0.0 111.046 -179.635 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -55.46 -54.91 38.0 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.497 -179.365 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -61.01 -38.31 85.64 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.46 179.847 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 48.0 ttp -62.85 -42.7 99.85 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.387 -179.512 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 139' ' ' SER . . . . . 0.433 ' CB ' ' H ' ' A' ' 128' ' ' GLU . 63.3 m -65.23 -38.65 91.05 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.893 -179.781 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -63.42 -46.44 86.36 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.962 0.411 . . . . 0.0 110.717 -179.892 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -71.21 -22.98 61.94 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.449 179.95 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 142' ' ' LYS . . . . . 0.458 ' HZ3' ' CE ' ' A' ' 146' ' ' MET . 65.7 tttm -71.62 -49.27 41.72 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.327 179.674 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 6.4 p -67.45 -39.03 81.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.652 -179.4 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -61.96 -44.91 95.77 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.564 -179.3 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 145' ' ' PHE . . . . . . . . . . . . . 60.2 t80 -58.48 -42.74 88.2 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.522 -179.261 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 146' ' ' MET . . . . . 0.458 ' CE ' ' HZ3' ' A' ' 142' ' ' LYS . 56.3 mtt -63.74 -39.62 94.72 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.943 -179.604 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 68.1 m -67.18 -45.69 76.19 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.974 -179.946 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 148' ' ' ILE . . . . . . . . . . . . . 81.5 mt -52.56 -36.24 21.99 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.54 -179.509 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 54.7 mtpt . . . . . 0 C--N 1.326 -0.428 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.782 -179.484 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 30.9 m . . . . . 0 N--CA 1.49 1.554 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . 0.503 ' C ' ' H ' ' A' ' 84' ' ' LYS . . . -153.5 96.2 2.0 Allowed 'General case' 0 N--CA 1.453 -0.296 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.548 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 1.9 m-85 -45.41 -16.37 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.336 179.887 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.503 ' H ' ' C ' ' A' ' 82' ' ' ALA . 67.8 mttm -64.41 -40.13 95.18 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.11 179.677 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 13.6 m120 -66.08 -47.47 74.13 Favored 'General case' 0 N--CA 1.457 -0.098 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.485 -179.658 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 6.5 tt -60.95 -42.06 97.49 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.549 -179.319 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 34.7 mt -55.78 -37.32 68.42 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.062 -179.576 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 86.6 mt-30 -71.32 -36.69 71.68 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.981 0.419 . . . . 0.0 110.511 179.577 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 70.6 mm-40 -59.63 -49.26 78.44 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.994 -179.222 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 30.3 pt -64.29 -32.3 56.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.637 179.576 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -55.85 -49.3 73.69 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.178 -179.404 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 59.4 tt0 -67.14 -49.76 63.71 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.914 -179.683 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 65.4 tttm -58.95 -50.78 72.78 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.534 -179.335 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . 0.467 ' O ' ' CB ' ' A' ' 95' ' ' SER . 97.6 mt-10 -69.95 -15.76 63.1 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.6 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' SER . . . . . 0.467 ' CB ' ' O ' ' A' ' 94' ' ' GLU . 0.7 OUTLIER 79.17 9.91 1.64 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.433 -179.731 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 20.7 m -77.61 162.86 26.74 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.531 -179.793 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . 0.473 ' N ' ' CD1' ' A' ' 97' ' ' LEU . 9.7 mp -70.22 127.49 32.97 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.683 -179.959 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . 0.441 ' H ' ' CD1' ' A' ' 98' ' ' LEU . 10.1 mp -45.31 120.58 4.7 Favored Pre-proline 0 N--CA 1.452 -0.358 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.488 179.756 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -49.34 149.02 9.81 Favored 'Trans proline' 0 C--N 1.308 -1.563 0 C-N-CA 122.941 2.428 . . . . 0.0 112.866 179.404 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 85.1 t80 -130.73 133.48 46.08 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-O 121.119 0.485 . . . . 0.0 110.598 -179.32 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 88.2 m-85 -96.41 143.74 27.17 Favored 'General case' 0 N--CA 1.463 0.182 0 C-N-CA 120.745 -0.382 . . . . 0.0 111.251 -179.346 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -146.41 147.58 31.42 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.999 0.428 . . . . 0.0 110.93 -179.698 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -133.55 143.31 48.63 Favored 'General case' 0 CA--C 1.516 -0.348 0 CA-C-O 120.82 0.343 . . . . 0.0 110.463 179.594 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -120.68 146.83 46.03 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 120.882 0.373 . . . . 0.0 110.342 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 21.1 p -115.4 126.96 55.03 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.51 179.767 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 47.6 t -165.46 156.2 13.71 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.58 179.879 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 127.83 166.06 11.98 Favored Glycine 0 CA--C 1.524 0.602 0 N-CA-C 111.208 -0.757 . . . . 0.0 111.208 179.678 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 29.1 Cg_endo -61.46 152.45 72.95 Favored 'Trans proline' 0 C--N 1.301 -1.957 0 C-N-CA 122.736 2.29 . . . . 0.0 112.467 179.67 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 78.1 p -64.27 -19.65 65.54 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.279 179.509 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 70.0 m80 -90.03 -38.73 13.39 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.298 179.699 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -125.21 79.0 66.61 Favored Pre-proline 0 C--O 1.234 0.268 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.216 179.581 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -76.33 158.11 37.04 Favored 'Trans proline' 0 C--N 1.3 -2.007 0 C-N-CA 122.883 2.388 . . . . 0.0 112.111 179.657 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 25.2 p -156.48 150.96 25.57 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.612 179.648 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -133.91 147.34 51.09 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.375 179.941 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 92.3 m -129.79 124.72 34.05 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.368 179.567 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 11.2 t -99.57 125.93 45.46 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.246 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 81.2 m -122.95 136.21 54.78 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.661 -179.527 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 12.3 p -114.83 147.89 17.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 120.962 0.41 . . . . 0.0 110.322 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 85.2 tt0 -127.23 134.32 50.11 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.415 -179.9 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . 0.623 ' CZ ' ' CE1' ' A' ' 125' ' ' PHE . 49.6 p90 -167.84 159.95 12.0 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.336 179.431 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 54.25 20.7 2.74 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.485 179.462 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 75.62 22.37 75.27 Favored Glycine 0 CA--C 1.522 0.526 0 N-CA-C 110.767 -0.933 . . . . 0.0 110.767 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -131.94 152.5 51.04 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-O 120.876 0.369 . . . . 0.0 110.567 179.839 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 7.4 p -120.35 126.61 75.45 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.289 0 CA-C-O 120.916 0.388 . . . . 0.0 110.532 -179.907 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' PHE . . . . . 0.623 ' CE1' ' CZ ' ' A' ' 120' ' ' PHE . 35.6 m-85 -111.42 120.01 40.73 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.294 -0.412 . . . . 0.0 109.913 179.623 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 5.2 p -83.35 137.75 33.82 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.498 -179.777 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -84.71 -168.87 45.06 Favored Glycine 0 CA--C 1.521 0.423 0 N-CA-C 110.618 -0.993 . . . . 0.0 110.618 179.908 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . 0.542 ' H ' ' CB ' ' A' ' 139' ' ' SER . 8.4 pt-20 -98.68 132.97 43.65 Favored 'General case' 0 C--N 1.33 -0.266 0 O-C-N 122.701 -0.293 . . . . 0.0 110.699 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -54.13 144.71 18.96 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.224 179.258 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -169.76 159.92 8.36 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.319 -179.729 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 25.7 pttm -90.9 33.65 0.93 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.527 179.702 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 3.4 t -158.05 149.35 21.24 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.586 -179.612 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -79.65 -32.76 41.63 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.213 179.579 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -59.17 -52.97 63.43 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.005 -178.893 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 4.0 tp -65.32 -40.2 93.43 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.292 -179.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 136' ' ' ALA . . . . . 0.455 ' O ' ' OG ' ' A' ' 139' ' ' SER . . . -56.35 -54.91 39.97 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.357 -179.597 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -57.92 -39.93 79.18 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.515 -179.83 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 50.7 ttp -63.47 -41.52 98.6 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.767 -179.753 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 139' ' ' SER . . . . . 0.542 ' CB ' ' H ' ' A' ' 128' ' ' GLU . 78.0 p -63.95 -35.73 81.66 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.777 -179.53 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . 0.416 ' N ' ' HG ' ' A' ' 139' ' ' SER . . . -67.64 -47.03 70.73 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.785 -179.991 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -71.24 -25.47 62.5 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.93 179.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -70.94 -49.36 46.44 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.184 179.832 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 8.3 p -68.39 -40.05 81.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.885 -179.8 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -62.21 -46.3 89.48 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.941 -179.471 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 145' ' ' PHE . . . . . . . . . . . . . 74.9 t80 -60.26 -42.08 94.58 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.925 0.393 . . . . 0.0 110.621 179.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 146' ' ' MET . . . . . . . . . . . . . 33.5 ttm -62.37 -39.58 93.65 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.044 -179.829 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 35.9 t -68.66 -43.45 76.16 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.99 -179.783 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 148' ' ' ILE . . . . . . . . . . . . . 85.4 mt -56.98 -29.94 32.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.796 -179.598 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 25.0 mtpp -62.67 -41.1 98.9 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.766 -179.944 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 150' ' ' ASN . . . . . . . . . . . . . 63.5 t30 -86.07 107.73 17.95 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.589 -179.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.221 -0.679 0 CA-C-O 117.964 -1.464 . . . . 0.0 110.969 179.971 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 55.8 t . . . . . 0 N--CA 1.49 1.539 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . 0.522 ' C ' ' H ' ' A' ' 84' ' ' LYS . . . -153.67 96.0 1.96 Allowed 'General case' 0 N--CA 1.451 -0.422 0 CA-C-O 121.166 0.508 . . . . 0.0 110.332 -179.8 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 3.0 m-85 -47.43 -15.5 0.05 OUTLIER 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.788 -0.642 . . . . 0.0 109.766 179.452 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.522 ' H ' ' C ' ' A' ' 82' ' ' ALA . 99.4 mttt -63.74 -39.95 95.52 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.05 179.795 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . 0.416 ' OD1' ' OE2' ' A' ' 89' ' ' GLU . 24.6 t-20 -66.19 -46.5 77.1 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.675 -0.693 . . . . 0.0 111.049 -179.689 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 6.0 tt -60.54 -42.64 96.94 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.677 -179.547 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 56.9 mt -56.22 -35.06 66.91 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.117 179.794 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 88.6 mt-30 -74.68 -37.46 62.67 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.08 179.26 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.416 ' OE2' ' OD1' ' A' ' 85' ' ' ASN . 97.6 mt-10 -63.32 -50.34 70.43 Favored 'General case' 0 C--O 1.232 0.142 0 C-N-CA 120.776 -0.369 . . . . 0.0 111.415 -179.173 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 2.2 pp -66.21 -41.73 89.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.304 179.78 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -57.18 -48.7 78.07 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.527 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 88.6 mt-30 -71.8 -41.33 68.4 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.802 179.779 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . 0.4 ' C ' ' H ' ' A' ' 95' ' ' SER . 88.9 tttt -60.88 -49.27 78.13 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.551 -179.576 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . 0.464 ' C ' ' H ' ' A' ' 96' ' ' SER . 98.0 mt-10 -75.95 9.21 2.55 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.379 179.947 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' SER . . . . . 0.436 ' O ' ' O ' ' A' ' 96' ' ' SER . 13.9 t 55.06 9.03 0.28 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.571 179.955 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' SER . . . . . 0.464 ' H ' ' C ' ' A' ' 94' ' ' GLU . 5.4 t -59.89 -130.82 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.226 179.724 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 92.3 mt -134.85 124.73 25.51 Favored 'General case' 0 CA--C 1.515 -0.388 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.588 179.895 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . 0.445 ' H ' ' CD1' ' A' ' 98' ' ' LEU . 10.7 mp -44.94 151.29 0.65 Allowed Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.439 -179.385 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_endo -66.88 170.88 11.96 Favored 'Trans proline' 0 C--N 1.308 -1.559 0 C-N-CA 122.836 2.357 . . . . 0.0 111.931 -179.896 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 32.8 t80 -143.82 114.76 7.79 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.178 179.246 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 97.7 m-85 -96.2 129.93 43.39 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.933 0.397 . . . . 0.0 110.253 -179.948 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -147.44 147.86 30.66 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.427 -179.81 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 1.5 t -136.3 146.16 46.31 Favored 'General case' 0 CA--C 1.518 -0.252 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.563 179.866 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -121.35 146.17 47.13 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.156 179.935 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 12.1 p -114.64 126.2 54.62 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-O 120.978 0.418 . . . . 0.0 110.39 179.839 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 52.8 p -160.72 164.17 31.83 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.275 179.817 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 119.64 163.8 12.41 Favored Glycine 0 CA--C 1.525 0.698 0 N-CA-C 111.005 -0.838 . . . . 0.0 111.005 179.681 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 22.4 Cg_endo -61.15 151.75 76.6 Favored 'Trans proline' 0 C--N 1.304 -1.811 0 C-N-CA 122.938 2.425 . . . . 0.0 112.127 179.537 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 38.8 t -62.94 -19.35 64.17 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.209 179.193 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 58.3 m170 -89.39 -44.09 10.43 Favored 'General case' 0 CA--C 1.517 -0.301 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.499 179.91 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -124.56 77.56 63.21 Favored Pre-proline 0 N--CA 1.467 0.387 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.156 179.244 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -77.33 165.09 28.15 Favored 'Trans proline' 0 C--N 1.306 -1.672 0 C-N-CA 122.661 2.24 . . . . 0.0 112.367 -179.694 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 38.8 p -156.17 151.4 26.6 Favored 'General case' 0 CA--C 1.516 -0.352 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.314 179.929 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -132.49 145.79 51.44 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.442 -179.853 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 88.7 m -133.45 128.15 34.84 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.184 -0.462 . . . . 0.0 109.991 179.63 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 27.6 t -102.19 129.76 48.66 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.471 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 65.4 m -119.09 132.63 56.03 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.032 -179.908 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 12.8 p -113.64 146.15 18.6 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.214 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.104 -179.597 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 81.2 tt0 -131.07 139.2 49.86 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.724 179.929 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . 0.626 ' CZ ' ' CE1' ' A' ' 125' ' ' PHE . 52.4 p90 -168.89 160.26 10.09 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.576 179.739 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 51.87 22.42 1.74 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.992 0.425 . . . . 0.0 110.683 179.697 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 75.88 22.74 73.82 Favored Glycine 0 CA--C 1.524 0.65 0 N-CA-C 111.132 -0.787 . . . . 0.0 111.132 179.825 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -132.19 151.02 52.02 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 110.089 -0.337 . . . . 0.0 110.089 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 6.5 p -118.23 125.06 73.99 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.225 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.93 -179.644 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 125' ' ' PHE . . . . . 0.626 ' CE1' ' CZ ' ' A' ' 120' ' ' PHE . 63.0 m-85 -110.14 117.53 33.96 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 116.185 -0.461 . . . . 0.0 109.888 179.903 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 6.0 p -80.6 132.12 35.59 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.503 -179.909 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -84.69 -167.64 43.24 Favored Glycine 0 CA--C 1.52 0.391 0 N-CA-C 110.614 -0.995 . . . . 0.0 110.614 179.689 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 4.6 pt-20 -90.77 -178.6 5.3 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.835 0.35 . . . . 0.0 110.182 -179.905 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . 0.539 ' N ' ' OE1' ' A' ' 129' ' ' GLU . 55.1 mp0 -110.8 145.7 37.69 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.235 178.995 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -170.24 163.35 8.91 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.689 -179.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 62.1 mttp -85.83 35.31 0.62 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.37 179.354 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 7.5 t -157.54 150.54 23.32 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.676 179.887 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 63.2 mttp -82.06 -34.73 29.3 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.824 179.398 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . 0.405 ' N ' ' CD ' ' A' ' 134' ' ' LYS . 13.6 mptt -56.66 -54.34 47.18 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.84 -178.789 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 11.6 tp -63.34 -38.43 91.12 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.559 -179.696 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -58.13 -54.48 46.51 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.808 -179.574 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 81.1 mm-40 -58.75 -42.74 89.59 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.797 0.332 . . . . 0.0 110.403 -179.674 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 26.1 ttm -61.48 -41.41 97.21 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.664 179.882 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 15.7 m -58.81 -39.93 82.6 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.786 -179.699 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -64.88 -42.23 95.0 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.93 0.395 . . . . 0.0 111.046 -179.897 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -69.66 -28.81 66.2 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.95 179.97 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 85.5 mttt -71.73 -49.79 36.09 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.79 179.694 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 7.3 p -67.34 -42.52 87.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.737 -179.581 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -63.16 -46.47 87.04 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.901 -179.81 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 145' ' ' PHE . . . . . . . . . . . . . 69.6 t80 -60.21 -42.69 95.68 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.534 -179.757 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 146' ' ' MET . . . . . . . . . . . . . 54.6 ttp -61.43 -37.57 84.01 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.631 -179.487 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 37.6 t -71.29 -44.28 65.48 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.962 0.41 . . . . 0.0 111.133 179.858 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 148' ' ' ILE . . . . . . . . . . . . . 90.6 mt -55.95 -30.44 28.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.525 -179.752 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 53.3 mtpt -62.31 -42.75 99.63 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.789 179.888 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 150' ' ' ASN . . . . . . . . . . . . . 58.3 t30 -86.97 109.99 19.74 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.388 -179.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.727 0 CA-C-O 117.984 -1.454 . . . . 0.0 110.854 179.96 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 4.6 m . . . . . 0 N--CA 1.49 1.528 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . 0.512 ' C ' ' H ' ' A' ' 84' ' ' LYS . . . -153.6 96.71 2.04 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-O 121.253 0.549 . . . . 0.0 110.187 -179.756 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 2.2 m-85 -46.46 -16.09 0.03 OUTLIER 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 115.845 -0.616 . . . . 0.0 109.929 179.633 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.512 ' H ' ' C ' ' A' ' 82' ' ' ALA . 68.4 mttm -63.9 -39.74 94.89 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.089 179.67 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 45.2 t30 -66.58 -47.07 73.92 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.679 -179.838 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 7.0 tt -61.76 -41.34 97.56 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.812 -179.905 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 32.3 mt -55.79 -36.24 67.18 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.139 -0.482 . . . . 0.0 109.856 -179.527 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 90.5 mt-30 -72.29 -36.05 68.85 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.294 179.29 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 70.3 mm-40 -60.34 -47.3 86.64 Favored 'General case' 0 C--O 1.233 0.216 0 C-N-CA 120.779 -0.368 . . . . 0.0 111.043 -179.131 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 28.0 pt -65.08 -32.89 60.23 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.499 179.869 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -55.49 -49.28 72.95 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.541 -179.604 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 90.4 mm-40 -67.92 -49.46 61.74 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.301 -0.408 . . . . 0.0 111.116 179.798 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -58.88 -51.25 70.85 Favored 'General case' 0 C--N 1.331 -0.203 0 C-N-CA 120.702 -0.399 . . . . 0.0 110.786 -179.379 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . 0.406 ' O ' ' CB ' ' A' ' 95' ' ' SER . 80.4 mm-40 -68.97 -13.75 62.64 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.666 179.748 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' SER . . . . . 0.406 ' CB ' ' O ' ' A' ' 94' ' ' GLU . 1.0 OUTLIER 75.45 10.37 3.52 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.287 -179.861 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 8.6 p -79.71 166.2 22.04 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.659 -179.518 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 70.3 mt -72.7 133.8 44.76 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.932 0.396 . . . . 0.0 110.739 -179.706 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 11.0 mp -44.81 152.92 0.51 Allowed Pre-proline 0 C--N 1.327 -0.405 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.71 -179.651 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_endo -61.17 170.0 5.55 Favored 'Trans proline' 0 N--CA 1.496 1.654 0 C-N-CA 122.847 2.365 . . . . 0.0 111.889 179.964 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 42.6 t80 -145.9 117.92 8.28 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.454 179.172 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' TYR . . . . . 0.471 ' CE2' ' NZ ' ' A' ' 84' ' ' LYS . 96.9 m-85 -102.79 136.62 42.28 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.898 0.38 . . . . 0.0 110.349 179.949 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -145.98 146.68 31.1 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.455 -179.803 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 92.2 m -124.31 130.86 53.25 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.314 179.926 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -111.35 139.8 46.45 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.529 -0.305 . . . . 0.0 110.224 179.825 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 22.7 p -117.22 122.71 44.76 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-O 121.019 0.438 . . . . 0.0 110.803 179.499 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 51.8 p -162.52 162.6 27.45 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.325 179.893 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 126.4 165.45 11.99 Favored Glycine 0 CA--C 1.523 0.54 0 N-CA-C 111.118 -0.793 . . . . 0.0 111.118 179.511 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -60.54 150.9 79.1 Favored 'Trans proline' 0 C--N 1.304 -1.796 0 C-N-CA 122.787 2.325 . . . . 0.0 112.036 179.378 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 99.0 p -63.2 -16.74 61.1 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.416 179.379 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 84.6 t60 -92.66 -43.4 9.11 Favored 'General case' 0 CA--C 1.519 -0.23 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.627 179.759 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -124.24 78.16 60.45 Favored Pre-proline 0 CA--C 1.531 0.219 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.527 179.807 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 70.2 Cg_endo -76.43 163.22 32.49 Favored 'Trans proline' 0 C--N 1.305 -1.718 0 C-N-CA 122.669 2.246 . . . . 0.0 112.192 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 31.0 p -156.61 151.32 25.81 Favored 'General case' 0 CA--C 1.514 -0.431 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.132 179.375 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -131.27 144.52 51.35 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.022 -0.535 . . . . 0.0 109.734 -179.801 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' THR . . . . . 0.424 ' OG1' ' OE1' ' A' ' 129' ' ' GLU . 72.4 m -130.33 125.5 34.84 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.932 0.396 . . . . 0.0 110.16 179.822 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 11.7 t -96.94 122.4 39.88 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.018 179.779 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 52.2 m -114.24 130.62 56.64 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.131 179.911 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 10.8 p -113.33 143.51 22.88 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.234 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.908 -179.953 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 80.9 tt0 -128.05 135.32 49.7 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.64 179.957 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . 0.622 ' CZ ' ' CE1' ' A' ' 125' ' ' PHE . 52.6 p90 -167.26 158.5 11.93 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.5 179.709 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 54.64 21.56 3.51 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.857 0.361 . . . . 0.0 110.594 179.587 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 76.0 22.59 73.81 Favored Glycine 0 CA--C 1.521 0.468 0 N-CA-C 110.869 -0.893 . . . . 0.0 110.869 179.927 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -132.34 151.99 51.61 Favored 'General case' 0 C--N 1.328 -0.338 0 O-C-N 122.768 -0.254 . . . . 0.0 110.413 -179.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 7.1 p -121.34 127.77 75.8 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.555 -179.782 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 125' ' ' PHE . . . . . 0.622 ' CE1' ' CZ ' ' A' ' 120' ' ' PHE . 24.1 m-85 -113.11 120.3 40.81 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.163 179.782 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 84.4 p -81.21 136.07 35.81 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.544 179.895 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -83.82 -169.89 45.79 Favored Glycine 0 CA--C 1.524 0.629 0 N-CA-C 110.689 -0.964 . . . . 0.0 110.689 179.806 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . 0.431 ' H ' ' CB ' ' A' ' 139' ' ' SER . 12.2 tt0 -99.1 134.18 42.31 Favored 'General case' 0 N--CA 1.448 -0.525 0 CA-C-O 121.014 0.435 . . . . 0.0 110.715 179.596 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . 0.424 ' OE1' ' OG1' ' A' ' 115' ' ' THR . 70.4 mm-40 -56.06 146.05 23.9 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.385 179.109 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -169.5 159.95 8.82 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.517 -179.936 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 52.4 mtpt -88.97 33.07 0.79 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.63 179.462 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 132' ' ' THR . . . . . 0.544 ' HG1' ' H ' ' A' ' 134' ' ' LYS . 3.6 t -158.49 150.17 21.18 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.688 179.835 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 55.8 mtmt -82.58 -21.44 35.24 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.785 179.364 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . 0.544 ' H ' ' HG1' ' A' ' 132' ' ' THR . 59.5 mttp -69.59 -53.95 16.39 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.788 -179.447 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 4.1 tp -64.3 -40.24 95.54 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-O 120.789 0.328 . . . . 0.0 111.002 -179.796 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -57.29 -54.29 48.41 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.355 -179.111 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 75.8 mm-40 -56.51 -40.87 75.73 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.854 0.359 . . . . 0.0 110.512 -179.869 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 51.8 mtt -62.99 -41.39 99.55 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.967 -179.616 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 139' ' ' SER . . . . . 0.431 ' CB ' ' H ' ' A' ' 128' ' ' GLU . 68.7 m -62.92 -40.74 98.51 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 121.04 -0.264 . . . . 0.0 111.19 -179.95 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -62.37 -45.82 91.44 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.102 0.477 . . . . 0.0 110.59 -179.583 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -69.83 -25.49 63.77 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.936 179.991 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . 0.513 ' O ' ' SD ' ' A' ' 146' ' ' MET . 37.5 ttpt -71.43 -49.72 38.88 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.042 0.449 . . . . 0.0 111.597 -179.992 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 7.6 p -67.33 -39.62 83.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.067 -179.693 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 144' ' ' ALA . . . . . 0.436 ' O ' ' OG ' ' A' ' 147' ' ' SER . . . -63.28 -46.48 86.62 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-N 116.339 -0.392 . . . . 0.0 111.079 -179.098 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 145' ' ' PHE . . . . . . . . . . . . . 65.6 t80 -59.84 -42.28 93.24 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.484 -0.325 . . . . 0.0 110.573 -179.71 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 146' ' ' MET . . . . . 0.581 ' SD ' ' N ' ' A' ' 146' ' ' MET . 0.0 OUTLIER -63.07 -39.34 94.44 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.764 -179.601 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 147' ' ' SER . . . . . 0.487 ' HG ' ' N ' ' A' ' 148' ' ' ILE . 72.8 p -67.76 -42.1 82.29 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.989 -179.858 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 148' ' ' ILE . . . . . 0.487 ' N ' ' HG ' ' A' ' 147' ' ' SER . 93.3 mt -59.05 -30.85 44.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.78 -179.675 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 54.9 mtpt -62.92 -40.66 98.3 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.802 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 150' ' ' ASN . . . . . . . . . . . . . 78.5 m-20 -62.98 -40.72 98.58 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.419 -179.848 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.776 0 CA-C-O 118.018 -1.434 . . . . 0.0 110.953 179.935 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 14.4 t . . . . . 0 N--CA 1.491 1.608 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . 0.501 ' C ' ' H ' ' A' ' 84' ' ' LYS . . . -153.2 96.56 2.07 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-O 121.118 0.485 . . . . 0.0 109.723 -179.877 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -47.58 -16.35 0.06 Allowed 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.526 -0.761 . . . . 0.0 109.761 179.792 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.501 ' H ' ' C ' ' A' ' 82' ' ' ALA . 51.9 mtmt -63.73 -41.08 98.11 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.027 179.843 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 34.1 t30 -64.68 -47.91 76.65 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.934 -179.517 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 6.3 tt -61.92 -39.69 92.93 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.885 -179.684 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 29.9 mt -56.75 -38.71 72.8 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 -179.628 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 84.5 mt-30 -68.96 -36.2 77.64 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.682 179.214 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 80.7 mm-40 -61.74 -48.14 82.04 Favored 'General case' 0 C--O 1.232 0.154 0 C-N-CA 120.67 -0.412 . . . . 0.0 111.355 -179.066 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 27.2 pt -65.0 -35.15 74.79 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.501 179.804 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -58.83 -49.88 76.07 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.687 -179.516 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 68.4 tp60 -66.77 -47.33 72.51 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.992 -179.738 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -61.48 -47.83 83.85 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.607 -179.31 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . 0.432 ' O ' ' CB ' ' A' ' 95' ' ' SER . 80.3 mm-40 -71.68 -14.42 62.03 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.575 179.806 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' SER . . . . . 0.432 ' CB ' ' O ' ' A' ' 94' ' ' GLU . 0.7 OUTLIER 78.94 9.11 1.85 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.383 -179.996 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 17.5 m -77.81 164.39 25.25 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.504 179.918 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 69.2 mt -69.68 129.24 39.07 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.495 -179.654 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . 0.425 ' N ' ' CD1' ' A' ' 98' ' ' LEU . 10.3 mp -45.63 147.93 1.4 Allowed Pre-proline 0 CA--C 1.533 0.321 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.54 -179.491 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -69.77 140.76 43.45 Favored 'Trans proline' 0 N--CA 1.494 1.513 0 C-N-CA 122.74 2.293 . . . . 0.0 111.767 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 88.9 t80 -125.95 128.77 48.03 Favored 'General case' 0 CA--C 1.511 -0.529 0 N-CA-C 108.542 -0.91 . . . . 0.0 108.542 -179.966 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 88.5 m-85 -97.51 145.32 26.34 Favored 'General case' 0 C--N 1.324 -0.53 0 C-N-CA 120.706 -0.398 . . . . 0.0 110.321 -179.07 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -144.19 145.67 32.23 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 110.174 -0.306 . . . . 0.0 110.174 179.651 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 96.8 m -125.97 132.11 52.12 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.499 179.927 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -125.45 151.85 45.69 Favored 'General case' 0 N--CA 1.467 0.391 0 N-CA-C 109.999 -0.371 . . . . 0.0 109.999 179.798 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 22.1 p -110.4 135.38 51.19 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-O 120.834 0.349 . . . . 0.0 110.258 179.85 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 30.3 p -161.33 163.06 31.02 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.26 179.903 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 120.07 -176.09 16.08 Favored Glycine 0 CA--C 1.527 0.836 0 N-CA-C 111.328 -0.709 . . . . 0.0 111.328 179.556 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -61.75 153.44 67.63 Favored 'Trans proline' 0 N--CA 1.495 1.59 0 C-N-CA 122.655 2.236 . . . . 0.0 112.276 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 6.5 m -68.3 -16.26 63.88 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.735 -0.666 . . . . 0.0 109.97 179.156 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 55.4 t-80 -90.81 -43.63 9.94 Favored 'General case' 0 CA--C 1.518 -0.253 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.442 179.774 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -124.4 78.52 61.52 Favored Pre-proline 0 CA--C 1.533 0.303 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.413 179.271 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -81.08 129.74 7.02 Favored 'Trans proline' 0 C--N 1.313 -1.31 0 C-N-CA 122.464 2.109 . . . . 0.0 112.466 179.835 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 72.2 p -111.2 173.44 6.34 Favored 'General case' 0 CA--C 1.515 -0.388 0 CA-C-N 115.885 -0.598 . . . . 0.0 109.895 179.926 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -130.81 145.19 51.91 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.444 -179.768 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 88.4 m -125.25 120.36 31.02 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.198 -0.455 . . . . 0.0 109.821 179.493 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 35.9 t -95.66 122.77 38.78 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.36 -179.837 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' THR . . . . . 0.418 ' CG2' ' N ' ' A' ' 118' ' ' VAL . 54.0 m -107.17 159.89 15.99 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.029 179.937 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' VAL . . . . . 0.418 ' N ' ' CG2' ' A' ' 117' ' ' THR . 14.7 p -141.25 137.94 33.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.187 -0.46 . . . . 0.0 109.965 179.664 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 81.2 tt0 -121.82 127.15 50.23 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.634 179.848 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . 0.403 ' CZ ' ' CE1' ' A' ' 125' ' ' PHE . 42.1 p90 -159.6 154.57 24.82 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.519 179.225 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 52.18 25.66 3.44 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.888 0.375 . . . . 0.0 110.902 179.557 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 72.75 23.68 77.46 Favored Glycine 0 CA--C 1.522 0.501 0 N-CA-C 111.002 -0.839 . . . . 0.0 111.002 179.849 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 45.7 mmtt -130.93 150.57 52.03 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 110.224 -0.288 . . . . 0.0 110.224 -179.78 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 6.2 p -120.59 125.74 74.45 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.627 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 125' ' ' PHE . . . . . 0.403 ' CE1' ' CZ ' ' A' ' 120' ' ' PHE . 41.9 m-85 -112.05 120.6 42.4 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.262 179.774 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 43.1 t -82.29 137.11 34.91 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.515 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -84.76 -169.63 46.07 Favored Glycine 0 CA--C 1.521 0.466 0 N-CA-C 110.559 -1.017 . . . . 0.0 110.559 179.802 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -99.28 136.06 39.78 Favored 'General case' 0 CA--C 1.532 0.264 0 O-C-N 122.769 -0.254 . . . . 0.0 111.068 -179.577 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 18.4 pt-20 -54.29 142.59 25.9 Favored 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 120.403 -0.519 . . . . 0.0 110.138 179.589 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -162.94 155.74 19.1 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.602 179.835 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 51.2 tttm -90.49 31.09 1.05 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.302 179.918 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 7.4 t -159.06 149.53 19.57 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.765 179.798 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -73.7 -40.61 63.48 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.188 179.388 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -53.36 -55.17 27.07 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.949 -178.75 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 12.1 tp -64.32 -39.44 93.92 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.785 0.326 . . . . 0.0 110.845 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -57.08 -55.18 38.1 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.678 -179.305 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -59.86 -42.12 92.96 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.841 0.353 . . . . 0.0 110.46 -179.54 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 41.5 tpp -60.19 -46.32 90.13 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.371 -179.606 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 37.1 m -61.3 -37.04 81.78 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.009 -179.812 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -63.97 -47.57 79.86 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.936 0.398 . . . . 0.0 110.725 179.781 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -73.2 -23.48 60.4 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.742 179.901 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -70.81 -49.58 44.82 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.227 179.968 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 7.1 p -68.87 -41.49 82.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.786 -179.767 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -63.72 -46.09 86.99 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.698 -179.857 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 145' ' ' PHE . . . . . . . . . . . . . 84.7 t80 -60.56 -43.41 97.3 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.809 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 146' ' ' MET . . . . . . . . . . . . . 79.8 mmm -63.02 -37.56 87.69 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.476 -179.773 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 147' ' ' SER . . . . . 0.438 ' O ' ' OD1' ' A' ' 150' ' ' ASN . 37.8 m -72.29 -43.14 64.67 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 120.784 -0.366 . . . . 0.0 111.044 179.569 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 148' ' ' ILE . . . . . . . . . . . . . 71.5 mt -55.87 -27.3 22.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 C-N-CA 120.956 -0.298 . . . . 0.0 110.78 -179.559 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 41.6 mttt -62.12 -42.23 99.03 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 120.653 -0.419 . . . . 0.0 111.242 179.662 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 150' ' ' ASN . . . . . 0.474 ' OD1' ' N ' ' A' ' 151' ' ' GLY . 47.1 p30 -65.77 -14.77 61.99 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 120.802 -0.359 . . . . 0.0 110.634 -179.383 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 151' ' ' GLY . . . . . 0.474 ' N ' ' OD1' ' A' ' 150' ' ' ASN . . . . . . . . 0 C--O 1.221 -0.711 0 CA-C-O 117.921 -1.489 . . . . 0.0 111.097 -179.63 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 6.8 t . . . . . 0 N--CA 1.489 1.519 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . 0.509 ' C ' ' H ' ' A' ' 84' ' ' LYS . . . -153.37 96.04 2.0 Allowed 'General case' 0 N--CA 1.452 -0.35 0 CA-C-O 121.143 0.497 . . . . 0.0 110.019 -179.806 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -47.07 -15.75 0.04 OUTLIER 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.689 -0.687 . . . . 0.0 109.885 179.551 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.509 ' H ' ' C ' ' A' ' 82' ' ' ALA . 99.4 mttt -64.44 -40.51 95.87 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.08 179.759 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . 0.414 ' O ' ' OE2' ' A' ' 89' ' ' GLU . 94.5 m-20 -65.12 -47.82 75.81 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.843 -179.769 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 6.3 tt -60.68 -40.54 92.53 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.908 -179.631 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 38.2 mt -56.6 -37.68 70.98 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.269 -0.423 . . . . 0.0 109.995 -179.779 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 87.4 mt-30 -69.83 -36.97 76.03 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.429 179.526 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.521 ' OE1' ' N ' ' A' ' 89' ' ' GLU . 0.3 OUTLIER -61.63 -48.85 79.01 Favored 'General case' 0 C--O 1.233 0.22 0 C-N-CA 120.774 -0.37 . . . . 0.0 111.037 -178.932 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 19.2 pt -63.74 -40.47 89.17 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.663 -179.693 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -59.57 -48.88 79.93 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.657 -179.78 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 58.6 tt0 -68.71 -41.98 78.35 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.722 179.717 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 65.1 tttm -61.7 -49.5 76.2 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.693 -179.73 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . 0.419 ' O ' ' CB ' ' A' ' 95' ' ' SER . 98.1 mt-10 -66.6 -19.58 65.8 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.456 179.627 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' SER . . . . . 0.419 ' CB ' ' O ' ' A' ' 94' ' ' GLU . 1.1 t 76.02 21.21 1.58 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.013 -179.654 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' SER . . . . . 0.458 ' HG ' ' H ' ' A' ' 97' ' ' LEU . 12.8 p -79.56 -114.73 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.283 -179.874 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . 0.458 ' H ' ' HG ' ' A' ' 96' ' ' SER . 54.4 tp -141.03 126.55 18.83 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.398 179.747 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . 0.429 ' N ' ' CD1' ' A' ' 98' ' ' LEU . 10.4 mp -44.91 143.94 2.1 Favored Pre-proline 0 C--N 1.327 -0.375 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.704 -179.503 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -70.26 139.35 38.31 Favored 'Trans proline' 0 N--CA 1.495 1.601 0 C-N-CA 122.508 2.139 . . . . 0.0 111.899 -179.897 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 86.8 t80 -128.05 129.08 46.09 Favored 'General case' 0 CA--C 1.514 -0.422 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 -179.527 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 81.6 m-85 -96.53 146.14 25.07 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.588 -179.126 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -147.35 148.14 31.04 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.242 179.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 1.2 t -130.67 138.22 49.94 Favored 'General case' 0 CA--C 1.519 -0.217 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.666 179.75 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -123.02 150.77 42.62 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.289 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 30.1 p -108.79 136.5 48.26 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-O 120.863 0.363 . . . . 0.0 110.152 179.757 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' SER . . . . . 0.514 ' HG ' ' N ' ' A' ' 107' ' ' GLY . 38.6 t -164.01 160.97 22.4 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.22 -179.812 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . 0.514 ' N ' ' HG ' ' A' ' 106' ' ' SER . . . 119.43 -179.13 16.67 Favored Glycine 0 CA--C 1.522 0.521 0 N-CA-C 111.21 -0.756 . . . . 0.0 111.21 179.908 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_endo -61.07 148.57 92.44 Favored 'Trans proline' 0 C--N 1.308 -1.57 0 C-N-CA 122.828 2.352 . . . . 0.0 112.139 -179.881 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 32.7 t -63.5 -16.63 61.26 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.819 -0.628 . . . . 0.0 109.872 179.124 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 61.3 t-80 -89.22 -44.0 10.59 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.396 179.872 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -125.58 77.81 68.97 Favored Pre-proline 0 N--CA 1.465 0.286 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.38 179.124 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -81.42 128.97 6.41 Favored 'Trans proline' 0 C--N 1.306 -1.677 0 C-N-CA 122.467 2.111 . . . . 0.0 112.253 179.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 4.4 p -108.77 173.07 6.48 Favored 'General case' 0 CA--C 1.515 -0.38 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.049 179.712 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -133.62 147.42 51.48 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.493 -179.455 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 85.6 m -129.11 123.1 31.32 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.137 179.602 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 35.0 t -96.74 125.17 41.01 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.25 -179.861 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 98.2 m -121.86 133.8 54.88 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.289 -179.74 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 13.8 p -118.51 152.3 20.66 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.208 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.255 -179.622 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -131.01 139.15 49.94 Favored 'General case' 0 CA--C 1.52 -0.185 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.592 -179.803 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . 0.626 ' CZ ' ' CE1' ' A' ' 125' ' ' PHE . 54.1 p90 -166.71 159.04 13.57 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.718 179.964 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 51.72 24.28 2.35 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.873 0.368 . . . . 0.0 110.519 179.701 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 73.21 23.02 78.37 Favored Glycine 0 CA--C 1.524 0.613 0 N-CA-C 111.009 -0.836 . . . . 0.0 111.009 179.829 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -131.22 150.41 52.16 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.885 0.374 . . . . 0.0 110.322 -179.893 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . 0.478 ' O ' ' CD1' ' A' ' 125' ' ' PHE . 14.9 p -104.73 160.38 5.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.792 -179.461 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 125' ' ' PHE . . . . . 0.626 ' CE1' ' CZ ' ' A' ' 120' ' ' PHE . 85.8 m-85 -153.4 108.92 3.24 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.413 179.908 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 69.1 m -84.29 142.24 30.37 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.799 -179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -85.85 -167.3 43.29 Favored Glycine 0 CA--C 1.519 0.317 0 N-CA-C 110.536 -1.026 . . . . 0.0 110.536 179.783 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -99.38 134.52 42.14 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-O 120.803 0.335 . . . . 0.0 110.902 -179.676 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 97.3 mt-10 -51.2 138.63 20.12 Favored 'General case' 0 C--N 1.322 -0.599 0 C-N-CA 120.489 -0.485 . . . . 0.0 110.296 179.642 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -160.53 155.03 23.61 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.661 -179.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 40.9 tttp -88.19 32.33 0.77 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.987 0.422 . . . . 0.0 110.334 179.867 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 4.9 t -160.57 153.95 22.0 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.531 179.875 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -79.68 -37.35 36.01 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.019 179.854 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -56.63 -54.41 46.35 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.991 -178.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 4.9 tp -63.99 -39.17 93.52 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-O 120.654 0.264 . . . . 0.0 110.76 -179.807 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -59.25 -54.44 46.82 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.712 -179.502 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 99.1 mt-10 -57.15 -44.98 83.94 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.714 0.293 . . . . 0.0 110.677 -179.535 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 72.3 mtm -62.78 -41.04 99.07 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.528 -179.75 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 20.4 m -60.0 -39.26 85.15 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 120.999 -0.281 . . . . 0.0 110.585 -179.938 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -64.43 -42.29 96.1 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.962 0.41 . . . . 0.0 110.672 -179.842 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -69.49 -27.52 65.28 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.684 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 65.7 mttm -71.63 -49.85 36.17 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.379 179.83 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 7.5 p -67.56 -41.11 85.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.622 -179.763 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -64.01 -45.97 86.61 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.804 0.335 . . . . 0.0 110.473 -179.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 145' ' ' PHE . . . . . . . . . . . . . 70.9 t80 -60.89 -43.98 97.76 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.606 -179.737 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 146' ' ' MET . . . . . . . . . . . . . 48.8 ttp -60.96 -38.78 87.11 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.688 -179.653 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 147' ' ' SER . . . . . 0.424 ' O ' ' OD1' ' A' ' 150' ' ' ASN . 37.7 t -67.61 -42.27 82.65 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.927 0.394 . . . . 0.0 111.193 -179.996 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 148' ' ' ILE . . . . . . . . . . . . . 93.7 mt -60.85 -29.16 44.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.076 -179.386 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 53.6 mtpt -62.86 -43.2 99.45 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.139 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 150' ' ' ASN . . . . . 0.424 ' OD1' ' O ' ' A' ' 147' ' ' SER . 99.6 m-20 54.57 34.92 22.35 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.84 -0.344 . . . . 0.0 110.519 -179.932 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.734 0 CA-C-O 118.008 -1.44 . . . . 0.0 111.002 -179.921 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 13.6 p . . . . . 0 N--CA 1.489 1.494 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . 0.525 ' C ' ' H ' ' A' ' 84' ' ' LYS . . . -153.19 95.48 1.95 Allowed 'General case' 0 N--CA 1.45 -0.44 0 CA-C-O 121.135 0.493 . . . . 0.0 110.344 -179.947 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 -46.55 -15.29 0.03 OUTLIER 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.109 179.302 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.525 ' H ' ' C ' ' A' ' 82' ' ' ALA . 99.4 mttt -64.87 -40.63 95.44 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.118 179.342 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 66.3 t30 -66.11 -48.24 71.52 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.549 -0.751 . . . . 0.0 110.803 -179.632 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 6.5 tt -60.21 -42.37 94.98 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.809 -179.33 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 38.1 mt -55.7 -35.96 66.64 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.118 -179.561 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 88.7 mt-30 -71.59 -36.12 70.75 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.401 179.328 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 81.1 mm-40 -61.11 -48.96 79.25 Favored 'General case' 0 N--CA 1.462 0.146 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.793 -179.041 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 26.8 pt -66.11 -35.87 76.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.584 179.802 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -59.43 -50.34 74.31 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.518 -179.511 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 87.8 mt-30 -70.65 -43.76 68.52 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.804 179.845 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -60.32 -50.91 71.73 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.67 -179.595 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 -69.35 -2.61 11.33 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.29 179.848 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 1.5 m 62.3 16.67 8.68 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.367 -179.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' SER . . . . . 0.468 ' OG ' ' N ' ' A' ' 97' ' ' LEU . 66.7 p -73.08 -124.82 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.25 -179.72 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . 0.468 ' N ' ' OG ' ' A' ' 96' ' ' SER . 89.6 mt -137.62 128.35 26.98 Favored 'General case' 0 CA--C 1.52 -0.197 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.701 -179.831 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 11.1 mp -44.77 152.25 0.56 Allowed Pre-proline 0 N--CA 1.452 -0.332 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.714 -179.734 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -64.69 169.7 11.07 Favored 'Trans proline' 0 C--N 1.308 -1.579 0 C-N-CA 122.879 2.386 . . . . 0.0 112.194 -179.917 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 55.5 t80 -145.05 114.53 7.16 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.417 179.236 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 93.2 m-85 -99.33 133.64 43.33 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.306 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -145.5 146.51 31.49 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.405 -179.694 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 88.9 m -126.36 132.19 51.62 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.235 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -117.13 145.23 43.93 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.247 -0.433 . . . . 0.0 109.888 179.651 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 17.6 p -114.42 125.48 53.89 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-O 120.813 0.34 . . . . 0.0 110.605 179.761 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' SER . . . . . 0.464 ' O ' ' O ' ' A' ' 113' ' ' THR . 34.6 p -164.04 160.77 22.09 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.553 179.974 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 130.4 170.57 12.73 Favored Glycine 0 CA--C 1.52 0.372 0 N-CA-C 110.814 -0.915 . . . . 0.0 110.814 179.533 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 27.2 Cg_endo -63.31 149.1 92.16 Favored 'Trans proline' 0 C--N 1.302 -1.877 0 C-N-CA 122.772 2.314 . . . . 0.0 111.905 179.471 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 50.2 m -65.16 -16.32 63.38 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.059 -0.518 . . . . 0.0 110.07 178.965 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 52.6 t-80 -88.96 -41.94 12.08 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.354 179.366 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -126.93 78.82 73.52 Favored Pre-proline 0 N--CA 1.464 0.251 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.557 178.711 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 24.4 Cg_exo -62.43 158.24 41.82 Favored 'Trans proline' 0 C--N 1.301 -1.958 0 C-N-CA 122.723 2.282 . . . . 0.0 112.363 -180.0 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' THR . . . . . 0.464 ' O ' ' O ' ' A' ' 106' ' ' SER . 23.7 p -155.83 150.97 26.6 Favored 'General case' 0 CA--C 1.517 -0.29 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.864 179.719 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -131.59 145.51 51.74 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.304 -179.955 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 99.3 m -126.11 119.72 28.3 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.561 179.338 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 59.8 p -94.23 122.0 36.32 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.351 -179.894 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 91.5 m -105.88 157.03 17.77 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.195 179.808 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 9.9 p -140.45 138.13 36.36 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.459 179.566 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . 0.428 ' OE2' ' N ' ' A' ' 123' ' ' LYS . 5.2 tm-20 -124.58 130.84 53.2 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.735 179.73 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . 0.622 ' CZ ' ' CE1' ' A' ' 125' ' ' PHE . 49.8 p90 -164.84 156.76 15.62 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.52 179.225 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 53.45 21.23 2.34 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.767 0.318 . . . . 0.0 110.609 179.565 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 76.56 22.32 72.92 Favored Glycine 0 CA--C 1.523 0.534 0 N-CA-C 110.983 -0.847 . . . . 0.0 110.983 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . 0.428 ' N ' ' OE2' ' A' ' 119' ' ' GLU . 51.8 mtpt -132.67 151.81 51.86 Favored 'General case' 0 CA--C 1.517 -0.293 0 O-C-N 122.75 -0.265 . . . . 0.0 110.487 179.832 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 12.7 p -122.13 128.7 75.63 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.159 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.872 -179.669 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 125' ' ' PHE . . . . . 0.622 ' CE1' ' CZ ' ' A' ' 120' ' ' PHE . 22.2 m-85 -116.05 123.27 47.51 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.3 179.707 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 66.1 m -81.99 136.11 35.3 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.486 179.893 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -80.46 -171.37 43.51 Favored Glycine 0 CA--C 1.522 0.485 0 N-CA-C 110.665 -0.974 . . . . 0.0 110.665 179.834 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . 0.62 ' H ' ' CB ' ' A' ' 139' ' ' SER . 13.6 tt0 -94.89 130.16 41.6 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-O 120.931 0.396 . . . . 0.0 110.668 179.643 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . 0.43 ' OE1' ' N ' ' A' ' 129' ' ' GLU . 56.4 mp0 -56.22 144.18 30.83 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 116.04 -0.527 . . . . 0.0 109.978 179.087 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -172.96 166.78 5.09 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.78 -179.661 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 22.6 pttp -93.3 33.38 1.22 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.567 179.022 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 132' ' ' THR . . . . . 0.711 ' HG1' ' HZ2' ' A' ' 134' ' ' LYS . 0.3 OUTLIER -153.66 142.82 21.39 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.512 -179.826 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 58.1 mttp -79.27 -45.03 20.54 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.195 0.522 . . . . 0.0 110.729 179.779 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . 0.711 ' HZ2' ' HG1' ' A' ' 132' ' ' THR . 16.3 pttp -53.63 -46.5 70.52 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.932 -179.4 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 4.4 tp -66.33 -41.84 89.02 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.677 179.871 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 136' ' ' ALA . . . . . 0.529 ' O ' ' OG ' ' A' ' 139' ' ' SER . . . -60.21 -53.07 62.04 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 -179.451 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 96.1 mt-10 -54.19 -40.67 67.78 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 -179.727 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 50.1 mtt -61.34 -42.47 98.74 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.217 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 139' ' ' SER . . . . . 0.62 ' CB ' ' H ' ' A' ' 128' ' ' GLU . 90.9 p -60.09 -38.75 83.86 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.658 -179.316 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -65.54 -44.24 87.47 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.999 0.428 . . . . 0.0 110.818 -179.619 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -69.31 -30.16 68.16 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.719 -179.462 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 57.5 mttp -71.94 -51.15 23.47 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.905 0.383 . . . . 0.0 111.56 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 11.3 p -66.15 -43.32 92.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.555 -179.207 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -61.67 -46.15 90.96 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.625 -179.584 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 145' ' ' PHE . . . . . . . . . . . . . 64.6 t80 -60.67 -42.27 96.72 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.528 -179.598 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 146' ' ' MET . . . . . . . . . . . . . 59.6 mtt -62.8 -39.16 93.4 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.816 -179.638 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 78.1 p -69.21 -42.1 76.2 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.847 0.356 . . . . 0.0 110.904 -179.709 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 148' ' ' ILE . . . . . . . . . . . . . 87.2 mt -59.05 -29.23 40.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.769 -179.646 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 55.2 mtpt -63.73 -42.15 97.95 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.669 179.688 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 150' ' ' ASN . . . . . . . . . . . . . 7.4 m120 -63.95 -40.45 96.46 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.508 -179.901 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.776 0 CA-C-O 118.034 -1.426 . . . . 0.0 110.939 -179.988 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 17.0 m . . . . . 0 N--CA 1.492 1.629 0 N-CA-C 109.341 -0.614 . . . . 0.0 109.341 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . 0.488 ' C ' ' H ' ' A' ' 84' ' ' LYS . . . -153.96 96.59 1.98 Allowed 'General case' 0 N--CA 1.448 -0.543 0 CA-C-O 121.209 0.528 . . . . 0.0 109.679 -179.965 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 2.8 m-85 -48.02 -16.58 0.09 Allowed 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.542 -0.754 . . . . 0.0 109.716 179.857 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.488 ' H ' ' C ' ' A' ' 82' ' ' ALA . 60.5 mttp -64.3 -42.73 96.23 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.479 -0.782 . . . . 0.0 109.932 179.916 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 13.5 m120 -63.57 -45.66 89.43 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.9 -179.376 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 6.0 tt -61.21 -41.57 97.08 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.777 -179.388 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 56.3 mt -57.92 -38.11 75.28 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.111 -0.495 . . . . 0.0 109.77 179.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 87.4 mt-30 -70.22 -35.3 73.79 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.355 179.102 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 96.2 mt-10 -63.41 -48.58 77.22 Favored 'General case' 0 N--CA 1.462 0.161 0 C-N-CA 120.668 -0.413 . . . . 0.0 111.426 -179.022 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 15.3 pt -62.82 -44.31 99.44 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 116.449 -0.342 . . . . 0.0 110.765 -179.542 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . 0.482 ' O ' ' N ' ' A' ' 95' ' ' SER . . . -68.81 -45.48 71.12 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.015 -179.622 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -63.27 -47.7 81.25 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.62 -179.417 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -63.34 -42.52 98.95 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.766 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -92.81 7.56 43.23 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.449 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' SER . . . . . 0.482 ' N ' ' O ' ' A' ' 91' ' ' ALA . 14.2 m 39.49 47.15 1.54 Allowed 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 120.91 0.386 . . . . 0.0 110.641 -179.936 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 60.2 p -100.48 44.7 1.0 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.435 -179.273 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . 0.43 ' N ' ' CD1' ' A' ' 97' ' ' LEU . 9.9 mp 64.66 93.17 0.06 Allowed 'General case' 0 N--CA 1.461 0.092 0 CA-C-O 121.042 0.449 . . . . 0.0 110.705 -179.445 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . 0.429 ' N ' ' CD1' ' A' ' 98' ' ' LEU . 10.3 mp -45.59 146.69 1.7 Allowed Pre-proline 0 CA--C 1.532 0.278 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.324 -179.712 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -70.28 145.42 54.09 Favored 'Trans proline' 0 N--CA 1.493 1.452 0 C-N-CA 122.496 2.131 . . . . 0.0 111.863 -179.8 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 84.4 t80 -127.76 131.59 49.63 Favored 'General case' 0 CA--C 1.514 -0.436 0 N-CA-C 108.771 -0.825 . . . . 0.0 108.771 179.972 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 95.7 m-85 -97.52 143.18 28.48 Favored 'General case' 0 C--N 1.324 -0.521 0 C-N-CA 120.741 -0.384 . . . . 0.0 110.474 -179.191 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -143.85 145.28 32.21 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.075 179.681 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 98.6 m -122.57 127.21 49.15 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.514 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -123.24 150.91 42.86 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 110.007 -0.368 . . . . 0.0 110.007 179.785 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 35.1 p -106.85 137.42 44.92 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-O 120.761 0.315 . . . . 0.0 110.23 179.97 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 31.2 m -161.75 163.35 29.65 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.253 179.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 118.04 -178.34 16.84 Favored Glycine 0 CA--C 1.527 0.82 0 N-CA-C 111.281 -0.728 . . . . 0.0 111.281 179.535 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -61.4 154.42 59.01 Favored 'Trans proline' 0 N--CA 1.497 1.715 0 C-N-CA 122.702 2.268 . . . . 0.0 112.337 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 28.3 m -67.68 -18.16 64.83 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.627 -0.715 . . . . 0.0 109.978 179.29 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 94.9 m-70 -91.95 -36.54 13.38 Favored 'General case' 0 CA--C 1.52 -0.179 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.164 179.735 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -124.21 79.77 59.31 Favored Pre-proline 0 CA--C 1.538 0.519 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.077 179.232 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -81.45 121.39 3.81 Favored 'Trans proline' 0 N--CA 1.489 1.24 0 C-N-CA 122.481 2.121 . . . . 0.0 112.194 -179.917 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 4.9 p -109.26 172.8 6.64 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.004 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 -132.2 146.76 52.24 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.167 -179.765 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 88.5 m -131.52 126.95 36.22 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.152 -0.476 . . . . 0.0 109.86 179.138 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 68.2 m -94.4 121.23 35.71 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.367 -179.834 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' THR . . . . . 0.421 ' CG2' ' CG2' ' A' ' 124' ' ' VAL . 98.6 m -108.95 125.33 51.92 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.385 -179.869 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 11.0 p -110.55 139.66 33.12 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.3 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.004 -179.945 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 84.1 tt0 -123.25 130.35 52.63 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.619 179.925 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . 0.584 ' CZ ' ' CE1' ' A' ' 125' ' ' PHE . 47.7 p90 -163.72 157.45 19.13 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.533 179.214 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 52.59 21.85 1.98 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.788 0.328 . . . . 0.0 110.86 179.503 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 75.7 21.89 76.0 Favored Glycine 0 CA--C 1.523 0.568 0 N-CA-C 111.185 -0.766 . . . . 0.0 111.185 179.836 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 61.0 mttp -131.66 151.2 51.81 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 120.723 0.297 . . . . 0.0 110.303 179.898 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . 0.421 ' CG2' ' CG2' ' A' ' 117' ' ' THR . 13.6 p -123.03 129.77 74.86 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.27 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.763 -179.572 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 125' ' ' PHE . . . . . 0.584 ' CE1' ' CZ ' ' A' ' 120' ' ' PHE . 18.5 m-85 -117.56 123.34 46.01 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.167 179.979 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 12.3 p -83.66 141.55 31.42 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.594 -179.976 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -86.18 -169.62 46.12 Favored Glycine 0 CA--C 1.523 0.584 0 N-CA-C 110.704 -0.959 . . . . 0.0 110.704 179.847 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . 0.588 ' H ' ' CB ' ' A' ' 139' ' ' SER . 5.8 pt-20 -93.86 128.89 40.38 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-O 120.765 0.317 . . . . 0.0 111.056 -179.564 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -55.15 144.14 25.11 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 120.45 -0.5 . . . . 0.0 110.172 179.703 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -170.63 163.67 8.18 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.931 179.837 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 31.0 mtmm -89.71 32.84 0.86 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.366 179.226 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 4.0 t -156.43 149.5 24.16 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.601 179.493 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 58.8 mttp -80.57 -31.8 36.76 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.921 179.708 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . 0.496 ' O ' ' SD ' ' A' ' 138' ' ' MET . 25.9 mtpp -59.19 -51.18 71.09 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.038 -178.901 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 11.6 tp -64.76 -39.3 93.4 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-O 120.838 0.351 . . . . 0.0 110.936 -179.654 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 136' ' ' ALA . . . . . 0.438 ' O ' ' OG ' ' A' ' 139' ' ' SER . . . -59.36 -54.81 42.48 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.8 -179.351 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 80.6 mm-40 -58.15 -43.61 87.46 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 120.847 -0.341 . . . . 0.0 110.436 -179.382 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 138' ' ' MET . . . . . 0.571 ' SD ' ' N ' ' A' ' 138' ' ' MET . 0.0 OUTLIER -62.02 -41.98 98.67 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.458 -179.979 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 139' ' ' SER . . . . . 0.588 ' CB ' ' H ' ' A' ' 128' ' ' GLU . 77.4 p -65.06 -36.16 83.48 Favored 'General case' 0 C--N 1.329 -0.317 0 C-N-CA 120.922 -0.311 . . . . 0.0 111.022 -179.934 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -65.83 -47.32 75.38 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.047 0.451 . . . . 0.0 110.645 179.94 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -71.7 -24.41 61.81 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.738 -179.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -70.62 -49.35 48.53 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.246 179.812 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 7.1 p -68.37 -38.9 80.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.88 -179.545 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 144' ' ' ALA . . . . . 0.412 ' O ' ' OG ' ' A' ' 147' ' ' SER . . . -64.08 -44.95 90.8 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.82 0.343 . . . . 0.0 110.95 -179.612 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 145' ' ' PHE . . . . . . . . . . . . . 64.7 t80 -57.11 -44.21 83.03 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.472 -179.713 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 146' ' ' MET . . . . . . . . . . . . . 63.3 mtt -63.79 -38.98 93.13 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.88 179.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 147' ' ' SER . . . . . 0.412 ' OG ' ' O ' ' A' ' 144' ' ' ALA . 78.0 p -67.91 -44.98 75.68 Favored 'General case' 0 C--N 1.332 -0.189 0 C-N-CA 120.702 -0.399 . . . . 0.0 110.936 -179.752 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 148' ' ' ILE . . . . . . . . . . . . . 82.2 mt -52.1 -39.14 25.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.085 -179.521 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 32.6 mttm -62.59 -42.17 99.4 Favored 'General case' 0 C--N 1.326 -0.444 0 C-N-CA 120.593 -0.443 . . . . 0.0 110.932 179.424 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 150' ' ' ASN . . . . . . . . . . . . . 41.8 t30 -62.96 -40.64 98.31 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.383 -0.372 . . . . 0.0 110.555 -179.881 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.768 0 CA-C-O 118.003 -1.443 . . . . 0.0 111.0 179.929 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 34.0 m . . . . . 0 N--CA 1.489 1.523 0 N-CA-C 109.241 -0.651 . . . . 0.0 109.241 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . 0.477 ' C ' ' N ' ' A' ' 84' ' ' LYS . . . -153.8 96.63 2.01 Favored 'General case' 0 N--CA 1.447 -0.576 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 179.925 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 3.9 m-85 -48.56 -15.77 0.09 Allowed 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.515 -0.766 . . . . 0.0 109.575 179.709 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.477 ' N ' ' C ' ' A' ' 82' ' ' ALA . 99.6 mttt -63.02 -39.47 94.84 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.758 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 93.0 m-20 -63.1 -44.84 94.54 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.739 -179.912 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 7.2 tt -71.92 -33.72 68.49 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.667 -179.515 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 17.7 mt -59.63 -41.71 91.07 Favored 'General case' 0 CA--C 1.52 -0.206 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.424 -178.839 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 17.0 pt20 -73.04 -29.43 62.98 Favored 'General case' 0 C--N 1.316 -0.866 0 C-N-CA 120.424 -0.51 . . . . 0.0 110.509 179.191 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 92.2 mt-10 -65.71 -42.87 90.63 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 120.693 -0.403 . . . . 0.0 111.251 -179.809 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 29.2 pt -72.13 -35.26 52.67 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.882 179.698 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -55.68 -49.53 72.7 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.937 -179.215 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 13.5 pt20 -67.96 -38.05 82.29 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.526 179.557 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 64.1 tttp -62.66 -47.72 82.46 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.384 -179.894 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 72.2 mm-40 -76.39 -2.83 33.77 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.494 -179.755 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 74.64 4.62 4.41 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.08 -0.509 . . . . 0.0 109.916 -179.724 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 18.9 m -74.17 162.71 28.68 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.287 179.89 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . 0.423 ' N ' ' CD1' ' A' ' 97' ' ' LEU . 10.5 mp -73.16 132.57 43.4 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.952 0.406 . . . . 0.0 110.052 -179.73 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . 0.409 ' N ' ' CD1' ' A' ' 98' ' ' LEU . 10.6 mp -45.63 149.21 1.12 Allowed Pre-proline 0 CA--C 1.534 0.336 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.68 -179.618 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -72.55 143.52 38.44 Favored 'Trans proline' 0 N--CA 1.49 1.315 0 C-N-CA 122.681 2.254 . . . . 0.0 111.59 179.881 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 87.7 t80 -127.57 130.47 49.13 Favored 'General case' 0 CA--C 1.511 -0.545 0 N-CA-C 108.542 -0.911 . . . . 0.0 108.542 179.956 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 76.3 m-85 -100.15 147.32 25.82 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 110.012 -0.366 . . . . 0.0 110.012 -179.092 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -146.17 146.89 31.0 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.379 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 99.8 m -121.57 128.14 51.68 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.368 179.732 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -116.27 144.13 44.62 Favored 'General case' 0 N--CA 1.467 0.389 0 N-CA-C 109.93 -0.396 . . . . 0.0 109.93 179.737 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 30.2 p -106.75 134.85 49.27 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 109.97 -0.382 . . . . 0.0 109.97 179.775 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 41.0 t -164.42 162.12 21.88 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.148 179.926 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 122.7 -177.87 16.45 Favored Glycine 0 CA--C 1.528 0.876 0 N-CA-C 111.268 -0.733 . . . . 0.0 111.268 179.459 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 23.4 Cg_endo -61.3 150.33 85.29 Favored 'Trans proline' 0 N--CA 1.497 1.718 0 C-N-CA 122.789 2.326 . . . . 0.0 112.317 179.902 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 36.9 t -63.99 -18.24 64.1 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.702 -0.681 . . . . 0.0 109.794 179.076 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 73.9 m80 -91.27 -38.19 12.82 Favored 'General case' 0 CA--C 1.518 -0.263 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.285 179.804 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -123.96 79.61 57.73 Favored Pre-proline 0 CA--C 1.538 0.508 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.185 179.463 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -80.8 122.07 4.28 Favored 'Trans proline' 0 N--CA 1.491 1.338 0 C-N-CA 122.619 2.213 . . . . 0.0 112.15 179.68 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 3.5 p -109.12 171.26 7.54 Favored 'General case' 0 CA--C 1.517 -0.307 0 CA-C-N 115.646 -0.706 . . . . 0.0 109.978 -179.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -133.89 148.56 51.25 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.182 -179.702 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 94.8 m -129.73 126.61 38.64 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.104 179.398 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 11.2 t -96.39 121.47 38.23 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.276 179.829 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' THR . . . . . 0.439 ' CG2' ' CG2' ' A' ' 124' ' ' VAL . 70.8 m -112.86 130.35 56.13 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.017 -179.913 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 7.7 p -113.73 141.8 28.48 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.357 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.03 -179.748 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 79.0 tt0 -125.14 131.86 53.18 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.49 -179.764 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . 0.625 ' CZ ' ' CE1' ' A' ' 125' ' ' PHE . 48.4 p90 -166.63 159.51 14.18 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.435 179.372 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 53.32 19.05 1.44 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.8 0.333 . . . . 0.0 110.904 179.711 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 78.24 20.0 73.32 Favored Glycine 0 CA--C 1.525 0.687 0 N-CA-C 111.323 -0.711 . . . . 0.0 111.323 179.617 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -132.13 152.91 50.99 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.806 0.336 . . . . 0.0 110.408 179.872 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . 0.439 ' CG2' ' CG2' ' A' ' 117' ' ' THR . 14.9 p -121.38 127.88 75.8 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.288 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.713 -179.904 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 125' ' ' PHE . . . . . 0.625 ' CE1' ' CZ ' ' A' ' 120' ' ' PHE . 36.8 m-85 -111.38 120.55 42.58 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.346 179.911 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 5.7 m -78.8 129.24 34.39 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.283 179.707 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -84.05 -173.25 49.66 Favored Glycine 0 CA--C 1.521 0.444 0 N-CA-C 111.139 -0.785 . . . . 0.0 111.139 -179.938 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . 0.446 ' CG ' ' N ' ' A' ' 129' ' ' GLU . 69.1 tt0 -77.75 165.89 23.64 Favored 'General case' 0 N--CA 1.442 -0.842 0 CA-C-O 120.671 0.272 . . . . 0.0 110.443 179.894 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . 0.446 ' N ' ' CG ' ' A' ' 128' ' ' GLU . 18.7 pt-20 -105.94 140.7 38.55 Favored 'General case' 0 C--N 1.332 -0.168 0 N-CA-C 109.879 -0.415 . . . . 0.0 109.879 179.106 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -171.57 166.48 6.75 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.86 179.596 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -86.12 35.36 0.64 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.041 179.065 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 4.3 t -152.47 144.77 23.97 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.844 179.772 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -82.54 -21.95 35.17 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.965 179.44 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 56.3 mtpt -68.79 -54.49 15.56 Favored 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 120.632 -0.427 . . . . 0.0 111.208 -179.278 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 3.6 tp -64.02 -38.9 92.77 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.959 -179.504 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -58.91 -54.64 44.83 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.67 -179.527 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 81.0 mm-40 -60.07 -43.03 95.75 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.866 0.365 . . . . 0.0 110.766 -179.777 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 60.3 mtt -61.77 -41.88 98.27 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.319 -179.509 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 37.8 m -65.07 -36.61 84.87 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.014 179.775 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -63.32 -46.37 86.95 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 121.046 0.45 . . . . 0.0 110.524 -179.962 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -70.21 -24.25 63.08 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.686 179.849 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 38.7 ttmt -70.76 -49.94 41.36 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.29 -0.413 . . . . 0.0 111.276 179.711 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 7.1 p -67.98 -40.9 84.07 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.151 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.019 -179.501 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -62.29 -45.79 91.67 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.935 0.398 . . . . 0.0 110.526 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 145' ' ' PHE . . . . . . . . . . . . . 69.8 t80 -59.19 -44.33 92.21 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.564 -179.656 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 146' ' ' MET . . . . . . . . . . . . . 64.1 ttp -61.68 -39.1 90.22 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.965 -179.711 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 11.7 t -67.34 -44.33 79.34 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 120.743 -0.383 . . . . 0.0 110.873 179.844 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 148' ' ' ILE . . . . . . . . . . . . . 94.2 mt -57.72 -29.57 35.23 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.204 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.994 -179.642 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 25.8 mtpp -64.54 -8.57 14.45 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.51 179.87 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 150' ' ' ASN . . . . . 0.477 ' OD1' ' N ' ' A' ' 151' ' ' GLY . 35.9 p-10 -63.36 -39.67 95.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.499 -179.962 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 151' ' ' GLY . . . . . 0.477 ' N ' ' OD1' ' A' ' 150' ' ' ASN . . . . . . . . 0 C--O 1.22 -0.723 0 CA-C-O 117.972 -1.46 . . . . 0.0 110.935 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 6.5 t . . . . . 0 N--CA 1.49 1.574 0 N-CA-C 109.406 -0.591 . . . . 0.0 109.406 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . 0.5 ' C ' ' H ' ' A' ' 84' ' ' LYS . . . -152.71 95.73 2.03 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.528 179.96 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 2.1 m-85 -46.05 -15.89 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.27 179.709 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.5 ' H ' ' C ' ' A' ' 82' ' ' ALA . 99.4 mttt -64.79 -40.75 95.76 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.447 179.266 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 38.8 t30 -64.92 -44.69 88.71 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.63 -179.91 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 5.3 tt -60.03 -43.36 95.34 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.588 -179.304 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 74.0 mt -56.25 -37.74 70.19 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.402 179.976 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 88.4 mt-30 -70.8 -35.26 72.46 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.578 179.651 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 79.9 mm-40 -62.27 -48.43 79.93 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.807 -179.169 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . 0.421 HG13 ' N ' ' A' ' 91' ' ' ALA . 19.9 pt -65.13 -41.34 91.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.655 -179.52 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . 0.519 ' O ' ' N ' ' A' ' 95' ' ' SER . . . -68.85 -49.9 54.45 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.852 -179.464 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 84.4 mt-30 -65.01 -45.68 84.5 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.865 -179.604 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 88.9 tttt -60.02 -47.35 86.19 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.562 -179.77 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . 0.408 ' O ' ' C ' ' A' ' 95' ' ' SER . 96.4 mt-10 -96.03 10.15 38.43 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.544 -179.928 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' SER . . . . . 0.519 ' N ' ' O ' ' A' ' 91' ' ' ALA . 13.9 t 39.24 40.84 0.56 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.47 -179.754 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' SER . . . . . 0.44 ' O ' ' CB ' ' A' ' 97' ' ' LEU . 44.7 m -87.47 33.26 0.69 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.653 -179.436 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . 0.44 ' CB ' ' O ' ' A' ' 96' ' ' SER . 2.6 tp 76.93 100.58 0.07 Allowed 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.866 179.907 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 11.0 mp -44.21 152.02 0.51 Allowed Pre-proline 0 C--N 1.325 -0.474 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.431 179.817 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_endo -65.86 171.16 10.28 Favored 'Trans proline' 0 C--N 1.304 -1.77 0 C-N-CA 122.951 2.434 . . . . 0.0 111.998 179.611 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 31.8 t80 -144.62 117.2 8.62 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.7 179.6 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 93.4 m-85 -96.95 129.03 44.47 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.505 -179.929 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -147.68 148.16 30.74 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.478 -179.781 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' THR . . . . . 0.44 ' HG1' ' N ' ' A' ' 104' ' ' ALA . 1.5 t -135.26 145.21 47.36 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.63 -179.924 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . 0.44 ' N ' ' HG1' ' A' ' 103' ' ' THR . . . -129.39 153.93 47.42 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.521 -179.925 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 16.2 p -110.28 138.43 46.67 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.576 179.631 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' SER . . . . . 0.525 ' HG ' ' N ' ' A' ' 107' ' ' GLY . 40.3 t -163.5 153.62 15.48 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.664 179.804 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . 0.525 ' N ' ' HG ' ' A' ' 106' ' ' SER . . . 125.65 -175.94 17.41 Favored Glycine 0 CA--C 1.524 0.612 0 N-CA-C 111.039 -0.824 . . . . 0.0 111.039 179.643 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 25.9 Cg_endo -62.45 150.46 87.32 Favored 'Trans proline' 0 C--N 1.303 -1.824 0 C-N-CA 122.785 2.323 . . . . 0.0 112.278 -179.883 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 37.1 t -65.05 -16.09 63.07 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.36 179.038 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 49.6 t-80 -90.51 -43.43 10.24 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.472 179.646 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -126.21 77.2 72.12 Favored Pre-proline 0 CA--C 1.53 0.178 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.21 179.213 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -80.62 126.52 6.02 Favored 'Trans proline' 0 C--N 1.303 -1.847 0 C-N-CA 122.611 2.208 . . . . 0.0 112.261 -179.588 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 5.6 p -103.97 170.89 7.65 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.362 179.609 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -133.46 146.71 51.4 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.589 -179.665 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 86.9 m -127.82 122.42 32.63 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.434 179.733 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 25.4 m -96.06 122.55 39.0 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.013 0.435 . . . . 0.0 110.556 -179.758 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 57.5 m -112.29 128.13 56.18 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.514 -179.894 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 8.6 p -110.42 140.82 27.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.506 179.928 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -127.27 136.78 52.45 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.566 179.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . 0.619 ' CZ ' ' CE1' ' A' ' 125' ' ' PHE . 50.7 p90 -170.15 160.2 7.86 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.385 179.85 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 51.56 21.38 1.27 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.511 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 77.08 21.22 74.25 Favored Glycine 0 CA--C 1.522 0.503 0 N-CA-C 111.098 -0.801 . . . . 0.0 111.098 179.732 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -131.99 151.59 51.64 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.786 0.327 . . . . 0.0 110.614 179.909 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 8.5 p -121.38 127.84 75.79 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-O 120.965 0.412 . . . . 0.0 110.842 -179.65 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 125' ' ' PHE . . . . . 0.619 ' CE1' ' CZ ' ' A' ' 120' ' ' PHE . 26.4 m-85 -112.63 120.48 41.69 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.367 179.56 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 43.5 t -80.09 132.16 35.9 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.707 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -80.26 -172.42 44.68 Favored Glycine 0 CA--C 1.525 0.688 0 N-CA-C 110.77 -0.932 . . . . 0.0 110.77 179.808 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . 0.42 ' O ' ' CG ' ' A' ' 128' ' ' GLU . 8.9 pt-20 -96.46 131.69 42.78 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.612 0.244 . . . . 0.0 110.475 -179.833 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -54.06 142.09 26.38 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.373 179.541 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -165.43 157.9 15.46 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.559 179.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 51.0 tttm -86.65 33.56 0.64 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.597 179.704 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 4.8 t -159.64 152.19 21.3 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.509 -179.712 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -81.84 -33.56 30.6 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.001 0.429 . . . . 0.0 110.978 179.896 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -58.28 -54.25 49.16 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.892 -178.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 4.0 tp -65.08 -38.75 91.78 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.66 179.938 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -57.7 -55.03 40.2 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.833 -179.358 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -60.84 -41.59 96.09 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.434 -179.752 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 78.9 mmm -62.61 -41.39 98.95 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.552 -179.472 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 20.2 m -64.4 -38.46 91.1 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.632 -179.946 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -64.73 -43.77 92.33 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.595 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -72.21 -24.99 61.48 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.456 179.671 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 63.0 tttp -70.31 -47.16 62.41 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.046 -179.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 7.7 p -70.55 -37.34 69.58 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.83 -179.542 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -64.06 -46.3 84.96 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.662 -179.857 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 145' ' ' PHE . . . . . . . . . . . . . 66.0 t80 -58.33 -43.44 88.25 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.553 -179.734 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 146' ' ' MET . . . . . . . . . . . . . 59.2 ttp -61.06 -37.41 82.54 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.577 -179.536 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 35.8 t -70.55 -45.59 65.17 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.955 -179.86 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 148' ' ' ILE . . . . . . . . . . . . . 93.9 mt -55.01 -31.52 25.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.617 -179.459 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 10.2 mtpm? -61.62 -41.6 97.7 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.671 179.752 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 150' ' ' ASN . . . . . . . . . . . . . 33.8 t30 41.12 -103.75 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.722 -179.98 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.219 -0.795 0 CA-C-O 118.0 -1.445 . . . . 0.0 110.923 -179.957 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 15.0 t . . . . . 0 N--CA 1.49 1.535 0 N-CA-C 109.365 -0.606 . . . . 0.0 109.365 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . 0.51 ' C ' ' H ' ' A' ' 84' ' ' LYS . . . -153.37 95.79 1.97 Allowed 'General case' 0 N--CA 1.451 -0.404 0 CA-C-O 121.06 0.457 . . . . 0.0 110.318 -179.975 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 2.1 m-85 -46.13 -15.87 0.03 OUTLIER 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.172 179.728 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.51 ' H ' ' C ' ' A' ' 82' ' ' ALA . 65.0 mttp -63.67 -40.26 96.39 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.169 179.509 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 63.6 t30 -65.95 -48.78 70.19 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.777 -179.467 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 6.4 tt -60.8 -40.98 94.68 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.791 -179.5 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 34.3 mt -56.11 -36.8 68.6 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.295 -179.591 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 89.4 mt-30 -69.81 -35.69 75.04 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.57 179.432 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 14.6 mm-40 -61.71 -49.7 75.41 Favored 'General case' 0 C--N 1.333 -0.11 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.107 -178.836 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 28.6 pt -65.02 -34.46 70.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.633 179.916 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -54.61 -50.44 68.05 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.529 -179.335 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 78.7 mt-30 -65.32 -42.32 93.09 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.851 -179.944 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 69.2 mmtt -61.35 -47.42 85.97 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.549 -179.512 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 80.9 mm-40 -68.15 -20.16 64.86 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.419 179.943 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 1.2 t 72.76 19.67 3.88 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.596 -179.825 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 75.3 m -80.43 -117.4 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.242 -179.898 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 40.9 tp -143.27 125.27 15.26 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.652 179.691 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . 0.475 ' H ' ' CD1' ' A' ' 98' ' ' LEU . 9.9 mp -44.36 142.65 2.24 Favored Pre-proline 0 N--CA 1.452 -0.359 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.871 -179.812 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_endo -69.63 145.42 57.84 Favored 'Trans proline' 0 C--N 1.311 -1.442 0 C-N-CA 122.524 2.149 . . . . 0.0 112.008 -179.781 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 92.6 t80 -127.2 128.73 46.57 Favored 'General case' 0 C--O 1.235 0.321 0 N-CA-C 109.544 -0.539 . . . . 0.0 109.544 179.643 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 85.6 m-85 -96.23 144.48 26.39 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.939 -179.596 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -143.74 145.4 32.37 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.439 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 98.0 m -122.83 127.67 49.37 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.466 -179.913 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -105.5 135.22 47.28 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.174 179.78 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 18.8 p -114.42 119.29 36.38 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-O 120.876 0.369 . . . . 0.0 110.414 179.592 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 11.4 p -160.66 163.96 32.11 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.403 179.934 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 122.24 168.78 13.34 Favored Glycine 0 CA--C 1.523 0.536 0 N-CA-C 110.888 -0.885 . . . . 0.0 110.888 179.659 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 24.9 Cg_endo -62.43 151.02 85.26 Favored 'Trans proline' 0 C--N 1.301 -1.928 0 C-N-CA 122.78 2.32 . . . . 0.0 112.143 179.63 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 77.7 p -63.99 -17.58 63.44 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.327 179.002 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 66.0 m80 -90.42 -43.14 10.49 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.501 179.628 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -125.04 78.02 66.58 Favored Pre-proline 0 N--CA 1.464 0.243 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.357 179.637 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' PRO . . . . . 0.4 ' O ' ' CG2' ' A' ' 113' ' ' THR . 56.8 Cg_endo -76.28 164.44 31.01 Favored 'Trans proline' 0 C--N 1.303 -1.866 0 C-N-CA 122.711 2.274 . . . . 0.0 112.279 -179.995 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' THR . . . . . 0.4 ' CG2' ' O ' ' A' ' 112' ' ' PRO . 33.8 p -156.83 152.01 26.33 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.641 179.555 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -131.68 144.14 50.79 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.335 -179.628 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 93.0 m -130.33 125.73 35.42 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.46 179.438 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 46.1 t -97.19 122.91 40.74 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.612 -179.827 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' THR . . . . . 0.408 ' CG2' ' CG2' ' A' ' 124' ' ' VAL . 54.3 m -114.81 131.45 56.81 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.357 -179.834 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 9.9 p -111.75 141.83 26.01 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.285 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.267 -179.949 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 79.3 tt0 -125.79 133.77 51.92 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.623 -179.672 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . 0.627 ' CZ ' ' CE1' ' A' ' 125' ' ' PHE . 45.9 p90 -166.53 157.56 12.68 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.368 179.466 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 52.61 24.86 3.33 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.518 179.719 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 72.64 22.82 78.78 Favored Glycine 0 CA--C 1.521 0.466 0 N-CA-C 111.083 -0.807 . . . . 0.0 111.083 179.913 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 62.9 mttp -131.66 151.66 51.45 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.807 0.337 . . . . 0.0 110.331 179.826 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . 0.408 ' CG2' ' CG2' ' A' ' 117' ' ' THR . 12.2 p -122.21 128.47 75.53 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.227 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.768 -179.7 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 125' ' ' PHE . . . . . 0.627 ' CE1' ' CZ ' ' A' ' 120' ' ' PHE . 27.0 m-85 -112.93 123.35 50.12 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.434 179.919 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 4.2 p -79.37 126.76 31.23 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.195 179.843 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -82.65 -172.53 48.32 Favored Glycine 0 CA--C 1.525 0.676 0 N-CA-C 110.97 -0.852 . . . . 0.0 110.97 -179.664 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . 0.459 ' CG ' ' N ' ' A' ' 129' ' ' GLU . 67.5 tt0 -78.7 167.09 21.73 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-O 120.759 0.314 . . . . 0.0 110.491 179.972 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . 0.459 ' N ' ' CG ' ' A' ' 128' ' ' GLU . 3.0 pp20? -109.61 145.31 36.64 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.979 0.419 . . . . 0.0 110.343 178.952 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -174.19 170.41 3.72 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.617 179.663 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -86.28 36.13 0.68 Allowed 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.238 178.849 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 5.1 t -156.41 148.66 23.33 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.893 0.378 . . . . 0.0 110.538 -179.637 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -82.54 -33.14 28.28 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.103 179.591 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 69.5 mmtt -58.82 -52.66 64.76 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.01 -178.213 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 10.3 tp -63.78 -39.76 95.03 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.466 -0.333 . . . . 0.0 110.973 -179.531 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -60.31 -54.78 41.57 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.53 -179.142 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -59.19 -44.43 92.19 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.708 -179.456 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 38.3 ttm -60.63 -41.8 95.64 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.478 -179.775 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 38.1 m -65.04 -35.17 80.3 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.754 179.763 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -62.7 -45.57 92.14 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.759 -179.733 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -72.41 -23.12 61.04 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.667 -179.771 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -71.6 -50.15 33.64 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.327 179.876 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 6.9 p -66.67 -41.01 87.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.696 -179.508 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -61.43 -43.56 98.65 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.479 -179.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 145' ' ' PHE . . . . . . . . . . . . . 65.4 t80 -60.2 -41.87 93.91 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.4 -179.832 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 146' ' ' MET . . . . . . . . . . . . . 89.9 mmm -63.85 -39.92 95.36 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.018 -179.349 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 9.1 t -67.48 -44.94 77.32 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.077 179.916 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 148' ' ' ILE . . . . . . . . . . . . . 78.7 mt -54.08 -33.5 24.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.582 -179.26 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 55.5 mtpt -60.97 -42.05 97.58 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.532 -179.908 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 150' ' ' ASN . . . . . . . . . . . . . 58.7 t-20 -86.61 108.95 18.84 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.443 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.777 0 CA-C-O 117.979 -1.456 . . . . 0.0 110.985 179.967 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 4.4 m . . . . . 0 N--CA 1.491 1.596 0 N-CA-C 109.319 -0.623 . . . . 0.0 109.319 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . 0.51 ' C ' ' H ' ' A' ' 84' ' ' LYS . . . -153.14 95.85 2.0 Allowed 'General case' 0 N--CA 1.451 -0.403 0 CA-C-O 121.079 0.466 . . . . 0.0 110.059 179.994 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -46.49 -16.36 0.03 OUTLIER 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.08 179.609 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.51 ' H ' ' C ' ' A' ' 82' ' ' ALA . 99.4 mttt -63.97 -41.96 97.4 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.314 179.328 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 35.9 t30 -64.79 -43.67 92.44 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.357 -179.523 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 2.6 tp -60.95 -43.36 98.81 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.6 -179.241 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 74.4 mt -55.83 -35.85 66.85 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.309 -179.767 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 88.6 mt-30 -71.01 -34.58 71.48 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.546 179.64 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -62.36 -48.08 81.34 Favored 'General case' 0 C--N 1.334 -0.08 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.044 -179.013 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 22.1 pt -65.2 -35.71 76.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.691 -179.996 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -59.17 -50.66 73.2 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.559 -179.648 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 56.0 tt0 -65.3 -44.93 86.34 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.859 -179.668 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -63.34 -47.58 81.59 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.702 -179.808 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . 0.445 ' O ' ' CB ' ' A' ' 95' ' ' SER . 16.0 mm-40 -72.64 -16.38 61.71 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.292 -179.832 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' SER . . . . . 0.445 ' CB ' ' O ' ' A' ' 94' ' ' GLU . 0.7 OUTLIER 79.69 11.36 1.27 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.516 -179.91 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 9.7 p -80.89 165.28 21.96 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.458 -179.911 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 57.5 tp -67.39 126.11 28.26 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.647 -179.974 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . 0.428 ' N ' ' CD1' ' A' ' 98' ' ' LEU . 10.5 mp -46.4 148.37 1.66 Allowed Pre-proline 0 N--CA 1.45 -0.43 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.75 179.887 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -70.63 143.96 48.09 Favored 'Trans proline' 0 C--N 1.31 -1.474 0 C-N-CA 122.764 2.31 . . . . 0.0 111.996 179.63 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 91.5 t80 -129.97 131.37 45.9 Favored 'General case' 0 C--O 1.234 0.261 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 179.57 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 79.5 m-85 -98.72 146.17 26.16 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.823 -179.444 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -144.18 145.7 32.26 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.503 -179.883 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 94.4 m -123.97 129.76 51.47 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.423 -179.939 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -113.23 141.05 47.43 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.147 179.933 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 13.4 p -115.15 120.79 40.95 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-O 120.874 0.368 . . . . 0.0 110.627 179.452 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 35.6 p -159.02 164.67 35.3 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.425 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 122.8 164.97 12.27 Favored Glycine 0 CA--C 1.522 0.473 0 N-CA-C 110.834 -0.906 . . . . 0.0 110.834 179.721 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 20.4 Cg_endo -60.9 151.46 77.53 Favored 'Trans proline' 0 C--N 1.3 -1.98 0 C-N-CA 122.854 2.369 . . . . 0.0 112.16 179.344 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 91.2 p -63.68 -18.41 63.96 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.186 179.326 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 99.2 m-70 -89.9 -43.25 10.73 Favored 'General case' 0 CA--C 1.519 -0.234 0 CA-C-O 120.889 0.376 . . . . 0.0 110.538 179.409 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -124.2 77.75 60.31 Favored Pre-proline 0 CA--C 1.532 0.267 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.378 179.445 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' PRO . . . . . 0.401 ' O ' ' CG2' ' A' ' 113' ' ' THR . 59.7 Cg_endo -75.41 162.73 35.63 Favored 'Trans proline' 0 C--N 1.305 -1.743 0 C-N-CA 122.572 2.181 . . . . 0.0 112.295 179.836 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' THR . . . . . 0.401 ' CG2' ' O ' ' A' ' 112' ' ' PRO . 25.4 p -157.51 153.63 27.33 Favored 'General case' 0 CA--C 1.515 -0.378 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.629 179.488 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -130.75 143.14 50.53 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.287 -179.877 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 97.5 m -130.5 126.17 36.19 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.575 179.454 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 29.1 t -97.5 123.19 41.28 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.408 -179.922 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 117' ' ' THR . . . . . 0.427 ' CG2' ' CG2' ' A' ' 124' ' ' VAL . 51.7 m -112.97 129.14 56.59 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.196 -179.805 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 9.4 p -111.87 142.02 25.55 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.305 179.993 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 81.6 tt0 -124.64 132.71 53.4 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.767 179.908 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . 0.635 ' CZ ' ' CE1' ' A' ' 125' ' ' PHE . 48.3 p90 -167.3 158.57 11.92 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.51 179.168 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 54.12 21.47 3.02 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.605 179.685 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 75.52 21.88 76.43 Favored Glycine 0 CA--C 1.522 0.481 0 N-CA-C 111.075 -0.81 . . . . 0.0 111.075 -179.947 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -132.73 153.0 51.61 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.652 0.263 . . . . 0.0 110.575 179.872 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . 0.427 ' CG2' ' CG2' ' A' ' 117' ' ' THR . 14.2 p -121.4 126.81 75.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-O 120.91 0.386 . . . . 0.0 110.558 -179.826 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 125' ' ' PHE . . . . . 0.635 ' CE1' ' CZ ' ' A' ' 120' ' ' PHE . 41.9 m-85 -111.44 121.3 44.84 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.314 179.646 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 5.9 p -83.26 137.78 33.86 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.416 180.0 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -86.15 -169.07 45.54 Favored Glycine 0 CA--C 1.521 0.454 0 N-CA-C 110.654 -0.978 . . . . 0.0 110.654 179.826 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -97.88 132.88 43.07 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-O 120.653 0.263 . . . . 0.0 110.788 -179.91 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 98.4 mt-10 -56.55 146.98 23.32 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 120.924 0.392 . . . . 0.0 110.416 179.221 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -169.77 161.75 9.29 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.652 -179.962 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 77.5 tttt -88.84 33.03 0.78 Allowed 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.173 0.511 . . . . 0.0 110.311 179.532 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 2.5 t -159.28 150.6 20.12 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.789 -179.683 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -81.06 -32.83 33.83 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.933 179.758 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . 0.423 ' N ' ' CD ' ' A' ' 134' ' ' LYS . 4.5 mptp? -58.5 -51.87 68.03 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.644 -178.628 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 3.5 tp -65.8 -39.72 91.19 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-O 120.845 0.355 . . . . 0.0 110.824 179.916 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -57.79 -55.17 38.3 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.572 -179.157 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -59.24 -43.35 92.4 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.398 -179.433 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 47.8 ttp -61.4 -44.66 96.77 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.443 -179.573 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 18.1 m -62.08 -39.97 94.23 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.748 -179.854 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -62.88 -46.44 87.84 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.702 -179.946 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -71.88 -23.72 61.55 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.547 179.895 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 64.4 tttp -70.54 -48.73 54.02 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.261 179.78 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 7.6 p -69.16 -37.97 77.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.69 -179.542 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -63.19 -45.86 89.76 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.642 -179.622 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 145' ' ' PHE . . . . . . . . . . . . . 60.7 t80 -60.24 -43.01 96.45 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.566 -179.326 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 146' ' ' MET . . . . . . . . . . . . . 62.7 ttp -61.63 -39.63 91.97 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.95 -179.73 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 33.1 t -67.04 -43.6 82.36 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.901 -179.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 148' ' ' ILE . . . . . . . . . . . . . 89.6 mt -57.28 -31.82 39.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.695 -179.411 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 53.9 mtpt -63.05 -41.85 99.57 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.819 179.864 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 150' ' ' ASN . . . . . . . . . . . . . 45.1 t30 -64.03 -40.13 95.63 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.506 -179.98 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.775 0 CA-C-O 117.957 -1.468 . . . . 0.0 110.921 -179.901 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 13.0 t . . . . . 0 N--CA 1.489 1.494 0 N-CA-C 109.455 -0.572 . . . . 0.0 109.455 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . 0.498 ' C ' ' H ' ' A' ' 84' ' ' LYS . . . -153.36 95.97 1.99 Allowed 'General case' 0 N--CA 1.449 -0.51 0 CA-C-O 121.082 0.468 . . . . 0.0 110.274 -179.877 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -47.01 -16.38 0.04 OUTLIER 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.914 -0.585 . . . . 0.0 109.804 179.603 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.498 ' H ' ' C ' ' A' ' 82' ' ' ALA . 69.1 mttm -63.73 -42.51 97.89 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.686 -0.688 . . . . 0.0 109.993 179.86 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 89.5 m-20 -63.12 -44.49 95.49 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.525 -179.748 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 6.2 tt -63.71 -40.95 98.04 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.832 -179.879 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 39.4 mt -56.79 -36.19 69.57 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.092 -179.703 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 88.3 mt-30 -71.63 -31.36 66.78 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.59 179.672 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -66.07 -47.26 74.89 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.301 -179.386 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 30.4 pt -66.88 -34.96 73.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-O 120.929 0.395 . . . . 0.0 110.463 179.957 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -58.32 -49.89 75.58 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.706 -179.416 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 89.0 mt-30 -65.67 -44.24 86.87 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.754 179.809 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 64.4 tttp -62.28 -47.94 82.12 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.621 -179.745 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 98.1 mt-10 -74.92 -2.91 29.09 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.508 179.995 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 2.7 t 67.79 6.31 5.0 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.603 -179.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 7.6 p -75.03 160.72 30.18 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.261 -179.873 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 51.7 tp -67.15 129.8 41.05 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.879 -179.521 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 10.3 mp -45.47 155.01 0.48 Allowed Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.2 179.258 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -65.1 171.65 8.61 Favored 'Trans proline' 0 C--N 1.307 -1.637 0 C-N-CA 122.826 2.351 . . . . 0.0 111.737 179.621 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 29.0 t80 -144.27 122.57 12.29 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.124 179.191 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 -103.59 132.96 49.39 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.416 -179.682 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -144.07 145.1 31.95 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.328 179.883 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 97.7 m -126.2 133.53 51.5 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.656 -179.672 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -124.28 149.08 46.91 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.339 179.925 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 20.3 p -108.06 135.4 49.48 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-O 120.864 0.364 . . . . 0.0 110.706 179.814 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 26.5 m -162.73 161.71 26.46 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.499 179.905 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 119.3 179.19 16.68 Favored Glycine 0 CA--C 1.522 0.479 0 N-CA-C 110.668 -0.973 . . . . 0.0 110.668 179.884 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 28.6 Cg_endo -60.91 151.51 77.2 Favored 'Trans proline' 0 C--N 1.302 -1.91 0 C-N-CA 122.87 2.38 . . . . 0.0 112.392 -179.664 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 37.5 t -63.56 -18.86 64.31 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.172 179.433 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 52.3 t-80 -90.31 -37.0 14.35 Favored 'General case' 0 CA--C 1.519 -0.243 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.118 179.55 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -124.35 81.14 59.06 Favored Pre-proline 0 N--CA 1.465 0.32 0 CA-C-O 121.124 0.488 . . . . 0.0 110.11 179.427 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -84.33 117.32 2.12 Favored 'Trans proline' 0 C--N 1.303 -1.855 0 C-N-CA 122.55 2.167 . . . . 0.0 112.487 -179.215 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 48.2 p -105.37 170.06 8.1 Favored 'General case' 0 CA--C 1.517 -0.326 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.197 179.741 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -130.57 142.27 50.46 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.396 -179.842 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 86.3 m -121.0 119.1 31.56 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.285 179.68 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 21.5 m -97.9 122.12 40.64 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.122 -179.988 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 62.2 m -112.9 132.16 55.43 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.347 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 10.9 p -112.67 138.9 40.22 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.261 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.197 -179.87 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 84.0 tt0 -125.28 134.01 52.43 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.81 -179.714 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . 0.605 ' CZ ' ' CE1' ' A' ' 125' ' ' PHE . 48.7 p90 -166.61 158.73 13.52 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.615 179.442 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 52.73 23.01 2.5 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.828 0.347 . . . . 0.0 110.467 179.843 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 74.98 22.27 77.06 Favored Glycine 0 CA--C 1.521 0.44 0 N-CA-C 111.118 -0.793 . . . . 0.0 111.118 179.786 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 63.5 mttp -132.3 152.6 51.31 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 110.355 -0.239 . . . . 0.0 110.355 -179.892 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 7.2 p -118.99 124.61 73.47 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.23 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.69 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 125' ' ' PHE . . . . . 0.605 ' CE1' ' CZ ' ' A' ' 120' ' ' PHE . 50.5 m-85 -108.5 119.8 40.58 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.07 179.79 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 73.4 m -82.49 134.26 35.21 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.383 -179.91 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -91.2 -167.15 40.94 Favored Glycine 0 CA--C 1.524 0.63 0 N-CA-C 110.673 -0.971 . . . . 0.0 110.673 179.846 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . 0.473 ' H ' ' CB ' ' A' ' 139' ' ' SER . 35.7 tt0 -98.0 133.89 41.85 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-O 120.968 0.413 . . . . 0.0 110.658 179.716 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 -63.35 151.75 39.96 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.324 179.71 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -171.78 164.36 6.51 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.733 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 61.7 pttt -88.39 32.64 0.77 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.665 179.184 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 3.9 t -156.14 148.13 23.19 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.929 0.395 . . . . 0.0 110.361 179.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 99.9 mttt -81.81 -17.14 48.57 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.642 -0.708 . . . . 0.0 109.896 179.738 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -73.29 -56.86 4.51 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.815 -179.702 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 4.3 tp -65.46 -41.34 93.48 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.344 -179.491 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -56.53 -55.12 37.81 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.832 -178.959 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -60.71 -40.29 91.71 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.789 0.328 . . . . 0.0 110.586 -179.729 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 56.7 mtt -61.63 -42.75 99.32 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.46 -179.817 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 139' ' ' SER . . . . . 0.473 ' CB ' ' H ' ' A' ' 128' ' ' GLU . 74.1 m -61.38 -41.03 96.45 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.44 -0.345 . . . . 0.0 110.873 -179.885 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -63.02 -45.76 90.8 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.935 0.398 . . . . 0.0 110.937 -179.927 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -71.07 -24.22 62.28 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.711 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 52.7 tttp -71.95 -49.98 32.85 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.931 0.396 . . . . 0.0 111.254 179.828 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 7.4 p -68.29 -38.96 80.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.712 -179.67 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -64.44 -48.3 75.84 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.878 -179.647 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 145' ' ' PHE . . . . . 0.422 ' CD1' ' C ' ' A' ' 145' ' ' PHE . 30.7 t80 -58.76 -44.45 90.59 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.922 -179.594 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 146' ' ' MET . . . . . . . . . . . . . 61.6 ttp -60.82 -38.34 85.08 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.881 -179.286 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 6.6 t -67.95 -41.23 82.81 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.879 179.538 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 148' ' ' ILE . . . . . . . . . . . . . 80.8 mt -57.51 -42.85 81.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 115.681 -0.691 . . . . 0.0 111.147 -178.953 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 17.1 ptmt -81.59 -26.6 34.79 Favored 'General case' 0 C--N 1.324 -0.506 0 C-N-CA 120.821 -0.352 . . . . 0.0 110.76 -179.783 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 150' ' ' ASN . . . . . . . . . . . . . 59.3 t-20 -62.89 -41.27 99.35 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.381 -179.602 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.781 0 CA-C-O 118.06 -1.411 . . . . 0.0 110.941 179.827 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 7.9 m . . . . . 0 N--CA 1.49 1.546 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . 0.5 ' C ' ' H ' ' A' ' 84' ' ' LYS . . . -154.06 95.9 1.9 Allowed 'General case' 0 N--CA 1.452 -0.347 0 CA-C-O 121.062 0.458 . . . . 0.0 110.051 179.992 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -47.01 -15.79 0.04 OUTLIER 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.93 179.748 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.5 ' H ' ' C ' ' A' ' 82' ' ' ALA . 99.6 mttt -64.13 -42.0 97.0 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.733 -0.667 . . . . 0.0 109.901 179.679 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 92.5 m-20 -64.23 -46.27 84.53 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.786 -179.79 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 6.3 tt -62.35 -40.79 97.56 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.828 -179.848 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 33.4 mt -57.21 -36.72 71.22 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.05 -179.642 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -70.78 -33.42 70.74 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.932 -0.577 . . . . 0.0 110.537 179.592 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 97.6 mt-10 -63.99 -48.51 76.13 Favored 'General case' 0 N--CA 1.462 0.152 0 C-N-CA 120.694 -0.402 . . . . 0.0 111.1 -179.29 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 29.4 pt -68.55 -34.77 67.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.75 -179.996 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -57.72 -51.01 71.3 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.853 -179.535 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 69.3 tp60 -67.46 -41.5 84.58 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.539 179.937 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 65.8 tttm -60.97 -47.35 86.83 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.45 -179.505 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 96.1 mt-10 -72.85 -3.25 24.4 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.466 179.919 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 4.7 t 64.99 5.78 3.1 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.615 179.984 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' SER . . . . . 0.695 ' HG ' ' H ' ' A' ' 97' ' ' LEU . 29.3 t -61.86 -127.85 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.243 179.774 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . 0.695 ' H ' ' HG ' ' A' ' 96' ' ' SER . 94.1 mt -139.35 126.43 21.14 Favored 'General case' 0 CA--C 1.517 -0.3 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.548 179.977 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . 0.454 ' H ' ' CD1' ' A' ' 98' ' ' LEU . 10.2 mp -45.87 142.35 3.8 Favored Pre-proline 0 C--N 1.326 -0.435 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.658 -179.001 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -71.48 144.06 44.28 Favored 'Trans proline' 0 N--CA 1.494 1.546 0 C-N-CA 122.623 2.215 . . . . 0.0 112.241 179.757 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 87.4 t80 -123.28 126.62 47.23 Favored 'General case' 0 CA--C 1.513 -0.461 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 179.937 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 94.6 m-85 -95.18 142.05 28.06 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.393 -178.969 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -143.84 144.87 31.95 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 110.104 -0.332 . . . . 0.0 110.104 179.691 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 93.0 m -122.45 128.0 50.33 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.394 -179.936 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -114.58 142.77 46.0 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.223 179.848 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 29.4 p -103.68 132.4 49.98 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-O 120.787 0.327 . . . . 0.0 110.244 179.802 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 29.8 p -160.49 165.74 30.38 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.132 -179.837 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 115.4 -176.41 16.59 Favored Glycine 0 CA--C 1.524 0.615 0 N-CA-C 111.141 -0.784 . . . . 0.0 111.141 179.786 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 29.4 Cg_endo -64.35 156.83 57.74 Favored 'Trans proline' 0 C--N 1.308 -1.565 0 C-N-CA 122.862 2.375 . . . . 0.0 112.272 -179.909 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 26.6 m -69.98 -19.54 63.34 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.14 179.313 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 74.6 m80 -88.84 -39.35 13.91 Favored 'General case' 0 CA--C 1.518 -0.269 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.405 179.894 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -125.17 78.23 66.98 Favored Pre-proline 0 CA--C 1.534 0.344 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.257 179.221 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -80.81 126.38 5.83 Favored 'Trans proline' 0 C--N 1.305 -1.755 0 C-N-CA 122.344 2.029 . . . . 0.0 112.362 -179.725 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 4.3 p -110.36 173.64 6.23 Favored 'General case' 0 CA--C 1.513 -0.463 0 CA-C-O 120.951 0.405 . . . . 0.0 109.952 179.667 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 1.1 m-85 -134.14 148.28 50.93 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.491 -179.599 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 96.6 m -128.32 124.59 36.86 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.144 179.365 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 32.6 p -95.19 120.03 34.73 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.314 -179.649 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 117' ' ' THR . . . . . 0.42 ' CG2' ' CG2' ' A' ' 124' ' ' VAL . 99.8 m -107.92 126.57 52.84 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.17 179.856 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 11.6 p -109.33 137.35 41.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.203 -179.719 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 77.5 tt0 -123.82 131.8 53.66 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.822 -179.808 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . 0.615 ' CZ ' ' CE1' ' A' ' 125' ' ' PHE . 44.6 p90 -164.98 156.7 15.24 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.48 179.696 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 52.24 24.55 2.88 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.86 0.362 . . . . 0.0 110.617 179.832 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 73.54 22.22 78.71 Favored Glycine 0 CA--C 1.524 0.649 0 N-CA-C 111.139 -0.785 . . . . 0.0 111.139 179.787 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -131.99 152.25 51.24 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 110.319 -0.252 . . . . 0.0 110.319 -179.969 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . 0.42 ' CG2' ' CG2' ' A' ' 117' ' ' THR . 14.9 p -122.01 128.35 75.59 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.194 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.76 -179.649 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 125' ' ' PHE . . . . . 0.615 ' CE1' ' CZ ' ' A' ' 120' ' ' PHE . 24.5 m-85 -112.35 122.87 48.93 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.285 179.873 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 8.8 m -79.61 127.39 32.11 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.123 179.996 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -85.2 -171.84 48.57 Favored Glycine 0 CA--C 1.528 0.853 0 N-CA-C 110.891 -0.884 . . . . 0.0 110.891 -179.938 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . 0.467 ' CG ' ' N ' ' A' ' 129' ' ' GLU . 70.5 tt0 -80.25 167.8 19.85 Favored 'General case' 0 N--CA 1.445 -0.7 0 CA-C-O 120.664 0.269 . . . . 0.0 110.362 -179.915 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . 0.485 ' N ' ' CD ' ' A' ' 129' ' ' GLU . 1.3 pm0 -107.66 142.61 37.36 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.129 0.49 . . . . 0.0 110.138 179.242 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -172.11 166.64 6.1 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.856 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 63.2 mttp -86.12 35.2 0.63 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.35 178.932 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 3.1 t -153.13 146.41 24.79 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.865 179.951 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 99.7 mttt -83.65 -21.65 32.41 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.802 179.692 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -69.26 -54.92 12.23 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.99 -179.187 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 4.0 tp -65.41 -40.19 93.09 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.888 -179.596 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -57.55 -54.99 40.56 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.621 -179.174 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -60.83 -41.39 95.66 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.804 0.335 . . . . 0.0 110.627 -179.741 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 33.3 tpp -60.23 -42.73 95.83 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.359 -179.727 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 38.5 m -64.45 -36.81 85.37 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.847 -179.937 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -62.33 -46.46 88.6 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.971 0.415 . . . . 0.0 110.573 -179.822 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -70.38 -23.92 62.86 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.504 179.826 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -71.99 -50.61 27.25 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.291 -179.896 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 7.4 p -68.11 -40.97 83.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.763 -179.531 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -64.76 -46.88 80.29 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.667 -179.834 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 145' ' ' PHE . . . . . 0.45 ' CD1' ' C ' ' A' ' 145' ' ' PHE . 27.3 t80 -58.31 -45.93 87.1 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.931 -179.487 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 146' ' ' MET . . . . . . . . . . . . . 47.4 tpp -61.24 -38.02 85.14 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.863 -179.323 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 19.1 m -67.4 -41.03 85.58 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.106 -179.874 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 148' ' ' ILE . . . . . . . . . . . . . 81.1 mt -56.78 -42.53 77.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.608 -179.363 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 17.9 ptmt -86.22 -28.27 23.96 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.846 0.355 . . . . 0.0 110.787 179.9 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 150' ' ' ASN . . . . . . . . . . . . . 59.6 t30 -91.44 106.97 18.88 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.42 -179.724 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.754 0 CA-C-O 117.942 -1.477 . . . . 0.0 110.973 -179.852 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 12.4 p . . . . . 0 N--CA 1.49 1.575 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . 0.496 ' C ' ' H ' ' A' ' 84' ' ' LYS . . . -153.66 96.71 2.04 Favored 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 179.969 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 2.8 m-85 -48.26 -16.46 0.1 Allowed 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.432 -0.804 . . . . 0.0 109.533 179.62 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.496 ' H ' ' C ' ' A' ' 82' ' ' ALA . 63.9 mttp -63.8 -43.34 96.58 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.465 -0.789 . . . . 0.0 109.891 -179.978 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 41.8 t30 -63.33 -44.1 95.89 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.711 -179.135 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 6.1 tt -61.51 -41.69 97.67 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.982 -179.416 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 65.1 mt -57.44 -36.52 71.5 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.197 0.522 . . . . 0.0 109.626 -179.638 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 88.9 mt-30 -70.39 -35.59 73.57 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.541 178.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 80.9 mm-40 -63.3 -48.44 78.07 Favored 'General case' 0 N--CA 1.462 0.138 0 C-N-CA 120.664 -0.414 . . . . 0.0 111.494 -179.054 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 14.6 pt -63.7 -43.69 98.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 C-N-CA 120.858 -0.337 . . . . 0.0 110.491 -179.791 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . 0.515 ' O ' ' N ' ' A' ' 95' ' ' SER . . . -64.31 -47.69 78.47 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.814 -179.651 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 3.5 tm0? -65.76 -46.51 78.51 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.81 -179.55 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 55.7 mtpt -62.43 -44.78 95.62 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.869 -179.743 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 96.1 mt-10 -91.73 -0.44 57.55 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.225 -179.663 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' SER . . . . . 0.515 ' N ' ' O ' ' A' ' 91' ' ' ALA . 13.8 m 41.33 81.36 0.03 OUTLIER 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.535 -179.658 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' SER . . . . . 0.434 ' O ' ' CB ' ' A' ' 97' ' ' LEU . 75.5 p -139.64 36.19 2.01 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.776 -179.578 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . 0.434 ' CB ' ' O ' ' A' ' 96' ' ' SER . 0.2 OUTLIER 79.59 93.98 0.05 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.939 0.399 . . . . 0.0 110.779 179.749 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . 0.426 ' N ' ' CD1' ' A' ' 98' ' ' LEU . 10.5 mp -45.74 147.65 1.53 Allowed Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.284 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -68.53 140.95 49.1 Favored 'Trans proline' 0 N--CA 1.495 1.612 0 C-N-CA 122.707 2.271 . . . . 0.0 111.844 -179.859 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 87.0 t80 -126.88 130.04 49.38 Favored 'General case' 0 CA--C 1.511 -0.521 0 N-CA-C 108.417 -0.957 . . . . 0.0 108.417 179.795 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 94.8 m-85 -97.53 143.61 28.06 Favored 'General case' 0 C--N 1.322 -0.597 0 C-N-CA 120.723 -0.391 . . . . 0.0 110.35 -178.972 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -142.61 144.4 32.81 Favored 'General case' 0 N--CA 1.464 0.243 0 N-CA-C 109.986 -0.376 . . . . 0.0 109.986 179.611 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 90.1 m -124.53 130.24 52.1 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.456 -179.971 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -119.54 146.95 45.01 Favored 'General case' 0 N--CA 1.467 0.409 0 N-CA-C 109.851 -0.426 . . . . 0.0 109.851 179.492 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 32.2 p -110.36 138.34 46.87 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 110.175 -0.306 . . . . 0.0 110.175 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 44.3 t -167.4 154.2 8.34 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 110.032 -0.358 . . . . 0.0 110.032 179.85 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 126.08 -175.75 17.6 Favored Glycine 0 CA--C 1.529 0.915 0 N-CA-C 111.307 -0.717 . . . . 0.0 111.307 179.554 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -61.37 153.06 68.42 Favored 'Trans proline' 0 N--CA 1.495 1.599 0 C-N-CA 122.59 2.193 . . . . 0.0 112.366 179.881 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 92.9 p -67.3 -16.53 64.32 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.661 -0.7 . . . . 0.0 109.927 179.202 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 52.7 t-80 -91.79 -41.97 10.37 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-O 120.894 0.378 . . . . 0.0 110.301 -179.942 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -123.95 79.64 57.61 Favored Pre-proline 0 CA--C 1.535 0.373 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.225 179.383 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_endo -83.17 122.68 3.34 Favored 'Trans proline' 0 N--CA 1.491 1.348 0 C-N-CA 122.699 2.266 . . . . 0.0 112.232 179.949 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 63.6 p -102.82 167.31 9.95 Favored 'General case' 0 CA--C 1.515 -0.399 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.003 179.896 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 1.2 m-85 -130.9 144.42 51.45 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.121 -179.897 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 115' ' ' THR . . . . . 0.437 ' OG1' ' OE1' ' A' ' 129' ' ' GLU . 46.5 m -123.82 120.26 32.08 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.659 -0.497 . . . . 0.0 109.659 179.395 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 41.2 t -95.21 121.41 36.83 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.229 -179.821 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 70.6 m -115.83 129.82 56.59 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.29 -0.413 . . . . 0.0 109.932 -179.91 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 12.9 p -113.77 145.74 19.25 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.259 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.164 -179.75 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -127.29 133.41 50.16 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.584 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . 0.619 ' CZ ' ' CE1' ' A' ' 125' ' ' PHE . 49.3 p90 -166.3 159.79 15.23 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.525 179.179 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 52.89 19.37 1.3 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.694 0.283 . . . . 0.0 110.761 179.423 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 77.5 21.3 72.84 Favored Glycine 0 CA--C 1.526 0.742 0 N-CA-C 111.249 -0.74 . . . . 0.0 111.249 179.76 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -131.69 151.54 51.56 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 110.192 -0.299 . . . . 0.0 110.192 179.765 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 6.7 p -121.02 127.71 75.97 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.171 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.643 -179.478 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 125' ' ' PHE . . . . . 0.619 ' CE1' ' CZ ' ' A' ' 120' ' ' PHE . 27.5 m-85 -109.44 154.48 22.57 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.664 179.915 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 37.2 p -117.79 132.99 56.38 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.624 -179.998 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -83.81 -169.79 45.66 Favored Glycine 0 CA--C 1.52 0.394 0 N-CA-C 110.624 -0.99 . . . . 0.0 110.624 179.668 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . 0.447 ' H ' ' CB ' ' A' ' 139' ' ' SER . 7.1 pt-20 -94.51 127.75 40.65 Favored 'General case' 0 CA--C 1.529 0.152 0 CA-C-O 120.553 0.216 . . . . 0.0 111.025 -179.373 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . 0.437 ' OE1' ' OG1' ' A' ' 115' ' ' THR . 79.8 mm-40 -53.81 143.73 20.25 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 120.457 -0.497 . . . . 0.0 110.209 179.832 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -169.63 161.62 9.5 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.772 179.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 22.4 pttp -88.61 33.99 0.76 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.416 179.652 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 4.8 t -154.74 147.86 24.78 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.621 179.493 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 99.7 mttt -79.98 -33.41 39.46 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.877 179.639 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 62.9 mttp -59.9 -54.68 43.29 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.037 -178.826 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 3.7 tp -64.81 -38.86 92.39 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.914 0.387 . . . . 0.0 110.388 179.924 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -57.16 -54.94 41.07 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.568 -179.406 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -64.14 -41.01 97.35 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.714 -179.218 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 93.0 mtp -62.41 -41.44 98.69 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.208 -179.826 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 139' ' ' SER . . . . . 0.447 ' CB ' ' H ' ' A' ' 128' ' ' GLU . 68.8 m -66.7 -36.55 82.77 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.724 179.39 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -65.17 -45.84 83.26 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.953 0.406 . . . . 0.0 110.65 179.553 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -72.36 -24.27 61.25 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.419 179.856 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -70.01 -48.68 57.12 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.048 179.757 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 7.2 p -67.98 -37.37 78.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.705 -179.94 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 144' ' ' ALA . . . . . 0.438 ' O ' ' OG ' ' A' ' 147' ' ' SER . . . -65.52 -46.41 79.72 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.903 0.382 . . . . 0.0 110.722 -179.952 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 145' ' ' PHE . . . . . . . . . . . . . 85.6 t80 -60.72 -41.52 95.45 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.797 -179.986 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 146' ' ' MET . . . . . . . . . . . . . 75.4 mmm -60.69 -38.47 85.09 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.627 -179.461 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 147' ' ' SER . . . . . 0.438 ' OG ' ' O ' ' A' ' 144' ' ' ALA . 58.5 p -70.76 -39.81 73.02 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 120.75 -0.38 . . . . 0.0 111.089 179.429 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 148' ' ' ILE . . . . . . . . . . . . . 84.3 mt -58.5 -26.78 31.82 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.242 0 CA-C-O 120.715 0.293 . . . . 0.0 110.622 -179.608 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 36.5 mtmt -58.99 -41.91 88.76 Favored 'General case' 0 C--N 1.323 -0.577 0 C-N-CA 120.326 -0.55 . . . . 0.0 110.576 -179.413 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 150' ' ' ASN . . . . . . . . . . . . . 19.4 t-20 -63.49 -41.39 98.56 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.591 179.854 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.75 0 CA-C-O 118.083 -1.398 . . . . 0.0 110.984 -179.915 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 4.7 t . . . . . 0 N--CA 1.491 1.607 0 N-CA-C 109.232 -0.655 . . . . 0.0 109.232 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . 0.498 ' C ' ' H ' ' A' ' 84' ' ' LYS . . . -154.08 97.08 2.02 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-O 121.13 0.49 . . . . 0.0 109.759 -179.869 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -47.63 -16.09 0.06 Allowed 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.72 179.971 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.498 ' H ' ' C ' ' A' ' 82' ' ' ALA . 64.7 mttp -63.88 -42.11 97.58 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.617 -0.719 . . . . 0.0 109.804 179.716 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 13.7 m120 -63.73 -46.19 86.48 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.884 -179.403 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 7.1 tt -62.64 -39.67 94.59 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.556 -179.724 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 33.7 mt -57.74 -38.97 76.25 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 -179.689 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 78.7 mt-30 -69.26 -35.11 75.75 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.645 179.122 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 95.7 mt-10 -62.99 -48.73 77.58 Favored 'General case' 0 N--CA 1.466 0.327 0 C-N-CA 120.761 -0.376 . . . . 0.0 111.166 -179.121 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 29.8 pt -66.42 -34.77 72.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.683 -179.968 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -55.71 -49.09 73.93 Favored 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 120.737 -0.385 . . . . 0.0 110.667 -179.37 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 52.9 tt0 -67.97 -43.49 78.86 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.846 -179.857 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 66.0 tttm -61.82 -48.52 80.2 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.899 0.381 . . . . 0.0 110.555 -179.487 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 80.2 mm-40 -76.84 2.62 14.04 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.576 -179.764 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 4.3 t 64.42 8.04 4.01 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.78 179.766 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 18.7 m -75.21 158.46 32.92 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.437 179.732 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . 0.476 ' N ' ' CD1' ' A' ' 97' ' ' LEU . 9.4 mp -69.29 131.68 45.24 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.998 0.428 . . . . 0.0 110.393 -179.459 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . 0.42 ' N ' ' CD1' ' A' ' 98' ' ' LEU . 10.3 mp -46.16 148.23 1.59 Allowed Pre-proline 0 C--N 1.326 -0.426 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.601 -179.727 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -73.07 142.69 34.84 Favored 'Trans proline' 0 N--CA 1.496 1.65 0 C-N-CA 122.828 2.352 . . . . 0.0 111.992 179.541 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 94.6 t80 -124.93 127.4 47.0 Favored 'General case' 0 CA--C 1.51 -0.564 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 179.798 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 84.1 m-85 -96.93 145.98 25.39 Favored 'General case' 0 C--N 1.324 -0.512 0 C-N-CA 120.726 -0.39 . . . . 0.0 110.303 -178.885 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -142.37 143.53 32.75 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.51 -0.314 . . . . 0.0 110.266 179.712 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 97.3 m -125.83 133.03 52.11 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.305 179.809 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -127.17 152.28 47.56 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.176 179.765 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 33.3 p -108.22 135.01 50.26 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-O 120.823 0.344 . . . . 0.0 110.133 -179.891 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 99.5 p -160.08 164.41 33.11 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.461 -179.805 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 117.47 -175.5 15.73 Favored Glycine 0 CA--C 1.527 0.835 0 N-CA-C 111.171 -0.772 . . . . 0.0 111.171 179.618 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 25.0 Cg_endo -62.15 152.3 76.73 Favored 'Trans proline' 0 N--CA 1.497 1.713 0 C-N-CA 122.863 2.376 . . . . 0.0 112.461 179.895 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 89.7 p -67.46 -17.31 64.65 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.016 179.284 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 55.1 t-80 -89.6 -42.73 11.23 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.209 179.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -123.93 78.07 58.1 Favored Pre-proline 0 CA--C 1.535 0.391 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.112 179.331 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -79.07 127.95 7.98 Favored 'Trans proline' 0 N--CA 1.49 1.27 0 C-N-CA 122.347 2.031 . . . . 0.0 112.435 179.768 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 52.0 p -110.19 172.87 6.61 Favored 'General case' 0 CA--C 1.519 -0.249 0 CA-C-N 115.793 -0.639 . . . . 0.0 109.86 179.629 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 1.7 m-85 -130.47 143.9 51.06 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.503 -179.377 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 97.9 m -124.59 120.91 33.27 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.265 -0.425 . . . . 0.0 109.965 179.307 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 12.9 t -102.14 128.82 48.46 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.239 179.917 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 97.5 m -129.6 141.44 50.95 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.322 -179.87 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 14.2 p -117.77 152.09 19.75 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.227 0 CA-C-N 116.044 -0.525 . . . . 0.0 109.76 179.86 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -129.03 136.98 51.03 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.004 0.43 . . . . 0.0 110.308 -179.895 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . 0.62 ' CZ ' ' CE1' ' A' ' 125' ' ' PHE . 55.0 p90 -169.31 161.42 10.01 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.791 -0.641 . . . . 0.0 110.744 179.14 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 52.87 19.21 1.24 Allowed 'General case' 0 N--CA 1.462 0.166 0 CA-C-O 120.771 0.32 . . . . 0.0 110.712 179.39 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 75.86 20.44 77.92 Favored Glycine 0 CA--C 1.526 0.723 0 N-CA-C 111.05 -0.82 . . . . 0.0 111.05 179.774 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 97.2 mttt -131.82 151.5 51.63 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.955 0.407 . . . . 0.0 110.145 -179.703 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . 0.48 ' C ' ' CD1' ' A' ' 125' ' ' PHE . 7.7 p -103.54 160.29 4.62 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.229 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.606 -179.325 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 125' ' ' PHE . . . . . 0.62 ' CE1' ' CZ ' ' A' ' 120' ' ' PHE . 85.8 m-85 -151.63 105.69 3.17 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.154 179.817 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 34.2 t -88.48 151.92 22.22 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.499 179.7 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -99.93 -159.36 28.5 Favored Glycine 0 N--CA 1.464 0.54 0 N-CA-C 110.652 -0.979 . . . . 0.0 110.652 179.454 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . 0.463 ' H ' ' CB ' ' A' ' 139' ' ' SER . 5.7 pt-20 -101.89 135.87 42.7 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-O 120.434 0.159 . . . . 0.0 110.801 -179.381 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -55.05 145.62 20.18 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 120.599 -0.441 . . . . 0.0 110.258 179.384 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -167.13 159.31 12.87 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.881 -179.999 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 48.0 tttp -88.58 32.18 0.8 Allowed 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.209 179.682 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 5.8 t -157.8 150.46 22.75 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.613 179.677 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -79.67 -35.98 38.36 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.054 179.619 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -56.45 -55.12 37.61 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.005 -178.926 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 4.3 tp -65.18 -40.4 94.22 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.269 -179.724 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -55.84 -54.44 44.56 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.501 -179.221 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -60.69 -40.25 91.51 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.897 0.38 . . . . 0.0 110.335 -179.593 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 51.4 ttp -60.16 -48.45 81.68 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.296 -179.722 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 139' ' ' SER . . . . . 0.463 ' CB ' ' H ' ' A' ' 128' ' ' GLU . 57.1 m -60.72 -35.47 76.41 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.7 179.92 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -68.82 -49.28 59.8 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.888 0.375 . . . . 0.0 110.825 179.727 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -60.07 -25.61 65.52 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.645 -179.559 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 30.7 mmtm -68.04 -43.33 78.98 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.87 179.311 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 3.3 t -62.39 -45.42 98.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.576 -179.116 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -63.12 -49.14 75.58 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-O 120.875 0.369 . . . . 0.0 111.012 -179.755 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 145' ' ' PHE . . . . . . . . . . . . . 49.7 t80 -61.53 -44.52 96.9 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.84 -179.367 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 146' ' ' MET . . . . . . . . . . . . . 72.6 mmm -64.36 -40.26 95.5 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.794 0.33 . . . . 0.0 110.883 -179.537 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 16.3 m -69.78 -41.85 74.58 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.935 179.934 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 148' ' ' ILE . . . . . . . . . . . . . 48.1 mt -56.49 -32.58 36.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.369 -179.78 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 55.4 mtpt -61.74 -41.98 98.37 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 120.618 -0.433 . . . . 0.0 110.486 -179.989 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 150' ' ' ASN . . . . . . . . . . . . . 99.0 m-20 -63.44 -40.61 97.6 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.475 179.857 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.701 0 CA-C-O 117.919 -1.489 . . . . 0.0 110.868 179.856 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 4.2 m . . . . . 0 N--CA 1.492 1.663 0 N-CA-C 109.315 -0.624 . . . . 0.0 109.315 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . 0.514 ' C ' ' H ' ' A' ' 84' ' ' LYS . . . -154.13 96.57 1.96 Allowed 'General case' 0 N--CA 1.449 -0.504 0 CA-C-O 121.167 0.508 . . . . 0.0 110.155 -179.882 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 2.2 m-85 -46.61 -16.04 0.03 OUTLIER 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.033 179.605 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.514 ' H ' ' C ' ' A' ' 82' ' ' ALA . 68.6 mttm -65.06 -42.37 94.27 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.004 179.604 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 89.9 m-20 -63.72 -45.77 88.46 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.478 -179.66 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 6.4 tt -61.98 -41.55 98.15 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.793 -179.741 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 37.6 mt -56.76 -37.04 70.52 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.115 -179.618 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 88.1 mt-30 -71.97 -32.68 67.51 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.415 179.737 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 78.5 mm-40 -65.01 -46.6 80.72 Favored 'General case' 0 CA--C 1.522 -0.102 0 C-N-CA 120.761 -0.375 . . . . 0.0 111.087 -179.048 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . 0.419 HG13 ' N ' ' A' ' 91' ' ' ALA . 18.1 pt -65.2 -44.45 95.25 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.703 -179.804 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . 0.504 ' O ' ' N ' ' A' ' 95' ' ' SER . . . -68.14 -47.77 67.18 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.538 -179.446 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 58.3 tt0 -64.78 -46.25 82.87 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.689 -179.809 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 66.3 tttm -61.67 -47.17 86.55 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.675 -179.923 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 80.9 mm-40 -92.94 8.47 39.65 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.408 -179.953 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' SER . . . . . 0.504 ' N ' ' O ' ' A' ' 91' ' ' ALA . 5.9 p 41.14 42.67 1.71 Allowed 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 120.848 0.356 . . . . 0.0 110.497 -179.882 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 18.7 p -92.74 39.43 1.04 Allowed 'General case' 0 CA--C 1.513 -0.466 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.788 -179.518 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 43.3 mt 69.4 100.4 0.06 Allowed 'General case' 0 CA--C 1.52 -0.21 0 O-C-N 123.451 0.469 . . . . 0.0 110.907 179.888 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 10.0 mp -44.85 155.06 0.41 Allowed Pre-proline 0 N--CA 1.452 -0.34 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.676 179.852 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_endo -64.8 170.17 10.49 Favored 'Trans proline' 0 C--N 1.305 -1.713 0 C-N-CA 122.791 2.328 . . . . 0.0 111.901 179.529 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 36.9 t80 -144.97 116.79 8.22 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.446 178.966 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 98.5 m-85 -98.77 131.95 44.51 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.918 0.39 . . . . 0.0 110.287 179.976 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -141.63 143.17 33.5 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.357 179.842 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 95.9 m -123.1 128.77 50.56 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.316 179.954 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -105.2 134.41 48.35 Favored 'General case' 0 CA--C 1.522 -0.108 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.271 179.714 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 19.4 p -115.21 123.95 50.16 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-O 120.897 0.379 . . . . 0.0 110.463 179.828 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' SER . . . . . 0.418 ' HG ' ' N ' ' A' ' 107' ' ' GLY . 35.1 t -167.41 151.96 6.89 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.352 179.945 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . 0.418 ' N ' ' HG ' ' A' ' 106' ' ' SER . . . 132.69 168.43 11.99 Favored Glycine 0 CA--C 1.522 0.491 0 N-CA-C 110.934 -0.867 . . . . 0.0 110.934 179.714 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 22.0 Cg_endo -61.46 151.38 80.12 Favored 'Trans proline' 0 C--N 1.303 -1.825 0 C-N-CA 122.814 2.342 . . . . 0.0 112.122 179.421 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 5.9 m -65.04 -17.42 64.44 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.031 -0.532 . . . . 0.0 110.254 179.395 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 93.4 m-70 -90.83 -41.91 10.94 Favored 'General case' 0 CA--C 1.52 -0.203 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.441 179.817 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -124.36 77.85 61.47 Favored Pre-proline 0 CA--C 1.531 0.248 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.356 179.508 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -76.46 160.72 35.13 Favored 'Trans proline' 0 C--N 1.304 -1.801 0 C-N-CA 122.681 2.254 . . . . 0.0 112.492 179.884 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 24.5 p -155.8 150.3 25.95 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.56 179.423 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -132.59 146.05 51.59 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.352 179.98 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 91.6 m -126.12 121.33 32.56 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 116.175 -0.466 . . . . 0.0 109.878 179.197 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 116' ' ' SER . . . . . 0.516 ' HG ' ' C ' ' A' ' 136' ' ' ALA . 10.4 p -95.76 121.75 37.81 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.601 179.927 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 52.6 m -115.77 130.67 56.94 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.044 179.944 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 9.8 p -112.59 143.79 21.62 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.267 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.208 179.994 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 84.0 tt0 -129.59 138.07 51.06 Favored 'General case' 0 CA--C 1.52 -0.189 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.632 -179.98 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . 0.627 ' CZ ' ' CE1' ' A' ' 125' ' ' PHE . 49.9 p90 -170.19 160.32 7.86 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.527 179.5 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 52.35 19.11 1.04 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.883 0.373 . . . . 0.0 110.559 179.419 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 79.55 20.37 69.04 Favored Glycine 0 CA--C 1.522 0.487 0 N-CA-C 111.353 -0.699 . . . . 0.0 111.353 179.697 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -131.9 150.8 52.05 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.661 0.267 . . . . 0.0 110.384 -179.96 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 7.8 p -119.59 126.41 75.3 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.312 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.972 -179.848 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 125' ' ' PHE . . . . . 0.627 ' CE1' ' CZ ' ' A' ' 120' ' ' PHE . 33.6 m-85 -110.83 118.2 35.49 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.112 179.805 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 11.3 p -76.64 125.25 28.92 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.479 -179.863 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -78.31 -172.67 40.67 Favored Glycine 0 CA--C 1.525 0.666 0 N-CA-C 110.904 -0.878 . . . . 0.0 110.904 179.914 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 18.9 mm-40 -79.62 169.81 17.46 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.649 0.262 . . . . 0.0 110.813 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . 0.498 ' CD ' ' H ' ' A' ' 129' ' ' GLU . 1.3 pm0 -109.33 139.17 44.62 Favored 'General case' 0 N--CA 1.464 0.262 0 N-CA-C 109.721 -0.474 . . . . 0.0 109.721 179.516 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -173.2 169.54 4.52 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.729 -179.994 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 22.6 pttp -86.86 36.34 0.72 Allowed 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.282 178.598 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 1.7 t -154.39 147.75 24.98 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.972 0.415 . . . . 0.0 110.665 -179.854 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -84.08 -25.61 29.66 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.027 179.594 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -66.22 -49.33 67.61 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.32 -178.496 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 4.2 tp -65.18 -42.59 93.49 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.573 -179.296 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 136' ' ' ALA . . . . . 0.516 ' C ' ' HG ' ' A' ' 116' ' ' SER . . . -62.81 -54.92 31.52 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.391 -179.125 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -57.31 -46.24 83.41 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.739 0.304 . . . . 0.0 110.572 -179.965 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 36.8 ttm -62.98 -39.34 94.41 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.259 -179.969 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 37.5 m -63.01 -38.85 92.86 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.831 179.8 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -62.4 -40.62 97.1 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.622 -179.909 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -68.38 -27.15 65.98 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.911 -179.807 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 92.6 mttt -72.12 -51.1 23.03 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.802 179.233 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 7.2 p -66.6 -41.28 88.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.742 -179.625 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -64.07 -46.54 83.88 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.59 -179.798 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 145' ' ' PHE . . . . . . . . . . . . . 71.2 t80 -60.52 -42.66 96.89 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.41 -179.74 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 146' ' ' MET . . . . . 0.451 ' C ' ' SD ' ' A' ' 146' ' ' MET . 14.9 tmm? -61.63 -38.66 88.49 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.8 -179.742 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 6.8 t -69.22 -44.58 71.74 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.916 0.389 . . . . 0.0 110.976 179.874 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 148' ' ' ILE . . . . . 0.42 HG23 HD11 ' A' ' 148' ' ' ILE . 86.4 mt -56.17 -31.1 31.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.737 -179.466 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 55.0 mtpt -62.26 -42.29 99.2 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.69 -179.939 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 150' ' ' ASN . . . . . . . . . . . . . 62.3 t30 -94.8 103.73 15.63 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.436 -179.917 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.776 0 CA-C-O 118.041 -1.422 . . . . 0.0 110.924 -179.968 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 35.6 m . . . . . 0 N--CA 1.492 1.626 0 N-CA-C 109.43 -0.582 . . . . 0.0 109.43 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . 0.511 ' C ' ' H ' ' A' ' 84' ' ' LYS . . . -153.67 95.95 1.95 Allowed 'General case' 0 N--CA 1.449 -0.504 0 CA-C-O 121.26 0.552 . . . . 0.0 110.026 179.795 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -46.68 -16.3 0.03 OUTLIER 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.71 -0.677 . . . . 0.0 109.831 179.674 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.511 ' H ' ' C ' ' A' ' 82' ' ' ALA . 68.6 mttm -63.89 -41.98 97.57 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.953 179.709 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 65.7 t30 -66.38 -46.44 76.69 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.599 179.91 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 2.6 tp -60.59 -42.69 97.25 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.374 -179.482 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 34.1 mt -56.54 -34.81 67.42 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.152 -179.497 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 99.2 mt-30 -71.74 -35.58 70.17 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.42 179.38 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 94.9 mt-10 -61.7 -48.95 78.44 Favored 'General case' 0 C--O 1.231 0.09 0 CA-C-O 120.913 0.387 . . . . 0.0 111.107 -178.887 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 21.8 pt -62.3 -36.76 76.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.506 -179.929 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -58.18 -47.6 82.91 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.572 -179.518 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 76.1 mm-40 -64.55 -49.09 72.59 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.707 179.973 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 19.3 tptm -62.18 -48.07 81.68 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.724 -179.457 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -71.88 -15.37 62.11 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.429 -179.984 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 1.9 p 74.54 15.52 3.36 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.473 -179.723 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 11.2 p -84.26 161.91 20.32 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.676 -179.984 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 60.2 mt -61.62 124.68 21.37 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.493 -179.948 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . 0.455 ' N ' ' CD1' ' A' ' 98' ' ' LEU . 9.4 mp -49.09 147.93 4.55 Favored Pre-proline 0 C--N 1.326 -0.436 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.706 -179.513 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_endo -68.45 140.11 47.08 Favored 'Trans proline' 0 C--N 1.311 -1.405 0 C-N-CA 122.508 2.138 . . . . 0.0 112.009 179.452 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 85.9 t80 -132.36 133.84 44.46 Favored 'General case' 0 CA--C 1.517 -0.322 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 179.819 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 45.0 m-85 -103.35 149.32 24.87 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.35 -179.303 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -152.27 93.5 1.82 Allowed 'General case' 0 C--O 1.234 0.265 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.175 179.883 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -70.93 138.95 50.5 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.178 179.848 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -126.59 152.77 46.18 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.209 179.945 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 43.4 p -105.93 134.6 48.79 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-O 120.819 0.342 . . . . 0.0 110.414 179.798 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 51.0 p -161.7 161.0 29.24 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.229 179.902 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 116.83 -176.9 16.49 Favored Glycine 0 CA--C 1.523 0.584 0 N-CA-C 110.889 -0.884 . . . . 0.0 110.889 179.789 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -62.43 152.59 76.19 Favored 'Trans proline' 0 C--N 1.307 -1.644 0 C-N-CA 122.627 2.218 . . . . 0.0 112.298 -179.717 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 78.7 p -67.66 -15.35 63.6 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 109.46 -0.57 . . . . 0.0 109.46 178.833 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 77.2 m80 -90.13 -43.76 10.24 Favored 'General case' 0 CA--C 1.519 -0.242 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.546 179.981 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -124.89 78.67 65.2 Favored Pre-proline 0 N--CA 1.462 0.17 0 CA-C-N 116.018 -0.537 . . . . 0.0 109.636 179.011 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -82.0 126.91 5.22 Favored 'Trans proline' 0 C--N 1.306 -1.686 0 C-N-CA 122.467 2.112 . . . . 0.0 112.168 -179.716 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 3.9 p -108.16 172.9 6.57 Favored 'General case' 0 CA--C 1.516 -0.339 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.078 179.756 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 1.2 m-85 -131.1 145.46 52.0 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.448 -179.743 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 89.7 m -128.98 123.8 33.37 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.035 179.368 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 116' ' ' SER . . . . . 0.414 ' OG ' ' O ' ' A' ' 136' ' ' ALA . 93.6 p -92.06 119.37 31.69 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.731 -179.865 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 91.2 m -106.22 123.54 48.2 Favored 'General case' 0 N--CA 1.465 0.301 0 N-CA-C 109.991 -0.374 . . . . 0.0 109.991 179.921 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 7.5 p -109.7 137.81 40.15 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.301 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.144 -179.946 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 82.8 tt0 -123.47 131.29 53.6 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.707 -179.907 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . 0.626 ' CZ ' ' CE1' ' A' ' 125' ' ' PHE . 47.2 p90 -166.53 157.34 12.49 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.428 179.504 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 53.93 21.72 2.98 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.915 0.388 . . . . 0.0 110.494 179.667 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 75.45 21.51 77.28 Favored Glycine 0 CA--C 1.522 0.499 0 N-CA-C 111.024 -0.83 . . . . 0.0 111.024 -179.991 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -132.51 152.95 51.39 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.536 0.208 . . . . 0.0 110.509 179.944 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 12.0 p -122.49 128.27 75.33 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.232 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.776 -179.914 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 125' ' ' PHE . . . . . 0.626 ' CE1' ' CZ ' ' A' ' 120' ' ' PHE . 25.5 m-85 -114.02 123.46 49.75 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.257 179.673 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 96.0 p -83.29 137.36 34.02 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.531 -179.912 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -85.12 -171.48 48.28 Favored Glycine 0 CA--C 1.521 0.424 0 N-CA-C 110.711 -0.955 . . . . 0.0 110.711 179.93 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . 0.42 ' O ' ' CG ' ' A' ' 128' ' ' GLU . 9.7 pt-20 -92.74 127.57 38.29 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-O 121.003 0.43 . . . . 0.0 110.858 -179.823 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . 0.53 ' CD ' ' H ' ' A' ' 129' ' ' GLU . 1.2 pm0 -54.64 145.34 19.3 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 121.066 0.46 . . . . 0.0 110.695 179.305 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -171.66 163.15 6.53 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.645 179.884 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 51.8 tttm -89.2 33.91 0.8 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.986 0.422 . . . . 0.0 110.301 179.447 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -154.43 143.05 20.77 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.667 -179.644 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -78.91 -45.65 20.11 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.247 179.938 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 43.9 pttt -53.32 -46.71 69.56 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.539 -179.433 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 4.1 tp -66.69 -42.11 87.01 Favored 'General case' 0 N--CA 1.443 -0.78 0 CA-C-O 120.741 0.305 . . . . 0.0 110.942 -179.756 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 136' ' ' ALA . . . . . 0.414 ' O ' ' OG ' ' A' ' 116' ' ' SER . . . -59.55 -51.96 67.62 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.48 -179.381 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 95.6 mt-10 -55.77 -44.0 77.26 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.384 -179.667 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 47.9 ttp -61.54 -42.54 98.97 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.266 -179.739 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 23.3 m -63.16 -39.01 93.43 Favored 'General case' 0 CA--C 1.519 -0.221 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.954 -179.841 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -64.27 -44.89 90.32 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.009 0.433 . . . . 0.0 110.589 -179.788 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -72.16 -24.17 61.39 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.389 179.934 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 63.4 tttp -71.11 -48.89 49.68 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.293 179.867 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 7.5 p -68.34 -37.75 78.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.698 -179.734 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -62.9 -44.59 95.67 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.781 -179.544 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 145' ' ' PHE . . . . . . . . . . . . . 60.6 t80 -59.9 -43.12 95.02 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.739 -179.39 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 146' ' ' MET . . . . . . . . . . . . . 47.1 ttp -61.26 -39.43 90.34 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.732 0.301 . . . . 0.0 110.848 -179.242 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 12.2 t -67.44 -44.62 78.25 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.966 -179.999 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 148' ' ' ILE . . . . . . . . . . . . . 91.4 mt -56.22 -33.47 37.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.695 -179.665 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 56.0 mtpt -61.8 -40.88 96.77 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.797 -179.929 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 150' ' ' ASN . . . . . . . . . . . . . 60.8 t30 -84.66 109.26 17.87 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.413 -179.82 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.221 -0.71 0 CA-C-O 117.971 -1.461 . . . . 0.0 110.911 179.973 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 6.7 t . . . . . 0 N--CA 1.49 1.57 0 N-CA-C 109.476 -0.565 . . . . 0.0 109.476 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . 0.51 ' C ' ' H ' ' A' ' 84' ' ' LYS . . . -154.31 95.75 1.85 Allowed 'General case' 0 N--CA 1.449 -0.483 0 CA-C-O 121.075 0.464 . . . . 0.0 110.086 179.993 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 -46.7 -16.06 0.03 OUTLIER 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.027 179.533 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.51 ' H ' ' C ' ' A' ' 82' ' ' ALA . 99.4 mttt -64.72 -41.07 96.25 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.844 -0.617 . . . . 0.0 110.125 179.69 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 14.3 m120 -66.71 -47.2 73.1 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.692 -179.823 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 5.8 tt -60.82 -42.96 98.72 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.723 -179.406 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 33.8 mt -55.86 -35.23 66.22 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.259 -179.56 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 88.8 mt-30 -70.71 -34.0 71.45 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.303 179.459 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 80.9 mm-40 -63.95 -49.98 70.42 Favored 'General case' 0 C--O 1.231 0.098 0 C-N-CA 120.608 -0.437 . . . . 0.0 111.188 -178.807 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 30.8 pt -63.37 -35.39 72.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.515 179.982 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -58.53 -48.88 79.38 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.666 -179.187 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 87.6 mt-30 -66.09 -43.94 85.83 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.776 179.932 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 88.9 tttt -63.47 -48.32 78.14 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.478 -179.84 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . 0.41 ' O ' ' OG ' ' A' ' 95' ' ' SER . 98.4 mt-10 -72.87 -10.11 59.44 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.31 -179.937 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' SER . . . . . 0.41 ' OG ' ' O ' ' A' ' 94' ' ' GLU . 2.0 p 74.08 8.53 4.7 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.462 -179.881 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 10.0 p -77.66 164.14 25.57 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.322 179.93 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . 0.469 ' N ' ' CD1' ' A' ' 97' ' ' LEU . 9.6 mp -68.31 128.23 35.81 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.981 0.42 . . . . 0.0 110.422 -179.555 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . 0.417 ' N ' ' CD1' ' A' ' 98' ' ' LEU . 10.7 mp -46.39 148.54 1.6 Allowed Pre-proline 0 N--CA 1.448 -0.54 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.822 -179.846 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_endo -69.02 140.3 45.08 Favored 'Trans proline' 0 C--N 1.311 -1.42 0 C-N-CA 122.649 2.232 . . . . 0.0 112.072 179.834 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 49.9 t80 -132.27 132.39 42.99 Favored 'General case' 0 C--O 1.235 0.338 0 N-CA-C 109.696 -0.483 . . . . 0.0 109.696 179.823 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 33.7 m-85 -101.94 149.08 24.58 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.755 -179.578 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -142.27 91.38 2.33 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-O 120.991 0.424 . . . . 0.0 111.349 179.918 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 43.6 m -71.52 133.19 45.64 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.085 179.655 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -138.17 161.31 37.16 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 110.136 -0.32 . . . . 0.0 110.136 -179.969 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 37.4 p -100.72 134.96 42.91 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-O 120.906 0.384 . . . . 0.0 110.508 179.743 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' SER . . . . . 0.415 ' O ' ' OG1' ' A' ' 113' ' ' THR . 34.1 p -160.75 163.64 32.15 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.473 -179.899 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 119.83 -165.13 13.49 Favored Glycine 0 CA--C 1.526 0.723 0 N-CA-C 111.128 -0.789 . . . . 0.0 111.128 179.583 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_endo -70.2 150.72 65.96 Favored 'Trans proline' 0 C--N 1.306 -1.668 0 C-N-CA 122.61 2.207 . . . . 0.0 112.453 -179.422 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 77.8 p -68.47 -20.02 64.59 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.243 178.729 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 73.0 m80 -85.23 -37.88 19.58 Favored 'General case' 0 CA--C 1.518 -0.251 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.413 179.706 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -126.91 78.29 73.96 Favored Pre-proline 0 N--CA 1.465 0.291 0 CA-C-O 121.18 0.515 . . . . 0.0 110.396 178.76 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -62.63 122.46 10.82 Favored 'Trans proline' 0 C--N 1.301 -1.966 0 C-N-CA 122.315 2.01 . . . . 0.0 112.367 -179.693 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 113' ' ' THR . . . . . 0.415 ' OG1' ' O ' ' A' ' 106' ' ' SER . 40.8 p -111.69 173.96 6.1 Favored 'General case' 0 CA--C 1.515 -0.391 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.198 179.638 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 1.6 m-85 -130.28 144.37 51.33 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.506 -179.579 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 86.1 m -131.26 127.55 38.03 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.479 179.514 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 10.5 t -97.73 122.01 40.31 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.419 -179.934 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 98.5 m -107.78 127.7 53.94 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.183 -179.95 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 7.4 p -111.82 139.24 37.16 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.303 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.239 -179.945 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 84.1 tt0 -124.27 131.21 53.51 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.53 179.736 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . 0.612 ' CZ ' ' CE1' ' A' ' 125' ' ' PHE . 45.2 p90 -167.84 159.1 11.31 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.177 179.249 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 54.57 20.84 3.05 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.145 0.498 . . . . 0.0 109.767 -179.908 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 72.73 23.56 77.68 Favored Glycine 0 CA--C 1.521 0.448 0 N-CA-C 110.937 -0.865 . . . . 0.0 110.937 -179.77 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 62.9 mttp -132.6 152.25 51.69 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.587 0.232 . . . . 0.0 110.382 -179.884 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 12.7 p -120.19 127.26 75.89 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.167 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.926 -179.742 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 125' ' ' PHE . . . . . 0.612 ' CE1' ' CZ ' ' A' ' 120' ' ' PHE . 39.2 m-85 -112.74 119.88 39.57 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.079 179.312 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 6.8 m -82.26 138.43 34.6 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.638 -179.998 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -86.65 -168.21 44.56 Favored Glycine 0 CA--C 1.523 0.532 0 N-CA-C 110.646 -0.981 . . . . 0.0 110.646 179.724 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -98.87 133.26 43.41 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.819 0.342 . . . . 0.0 110.522 -179.87 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -57.33 148.09 23.93 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.072 0.463 . . . . 0.0 110.545 179.068 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -170.78 162.74 7.72 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.811 179.818 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 97.2 mttt -88.35 32.79 0.76 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.369 179.22 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 3.1 t -158.43 151.4 22.56 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.741 179.877 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 68.9 mttm -81.56 -36.32 29.22 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.083 0.468 . . . . 0.0 110.442 179.508 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 30.7 mmtp -53.42 -54.28 39.08 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.828 -178.979 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 4.4 tp -64.89 -40.5 95.2 Favored 'General case' 0 N--CA 1.446 -0.639 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.066 -179.906 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -55.64 -54.63 41.81 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.659 -179.172 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 97.3 mt-10 -60.96 -40.01 91.73 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.733 0.302 . . . . 0.0 110.404 -179.458 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 48.2 ttp -62.48 -46.68 87.35 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.735 -179.595 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 68.8 m -61.95 -39.07 90.85 Favored 'General case' 0 CA--C 1.518 -0.269 0 CA-C-N 116.554 -0.294 . . . . 0.0 110.965 -179.356 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -63.66 -46.05 87.37 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.981 0.419 . . . . 0.0 110.563 -179.879 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -72.35 -23.5 61.15 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.563 -179.973 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 66.2 tttm -70.35 -48.63 55.53 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.054 0.454 . . . . 0.0 111.428 179.713 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 6.9 p -67.94 -36.41 75.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.614 -179.631 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -64.07 -45.01 90.64 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.614 -179.334 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 145' ' ' PHE . . . . . . . . . . . . . 62.1 t80 -60.46 -41.92 95.13 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.505 -179.615 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 146' ' ' MET . . . . . . . . . . . . . 47.9 ttp -63.74 -40.04 95.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.689 -179.648 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 67.8 m -68.27 -43.64 77.35 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.913 -179.885 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 148' ' ' ILE . . . . . 0.411 HG22 HD13 ' A' ' 148' ' ' ILE . 78.5 mt -55.77 -31.85 30.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.704 -179.686 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 54.3 mtpt -62.43 -39.39 93.15 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.462 179.85 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 150' ' ' ASN . . . . . . . . . . . . . 98.8 m-20 -64.33 -39.83 94.67 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.362 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.221 -0.703 0 CA-C-O 118.028 -1.429 . . . . 0.0 110.941 -179.862 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 12.7 p . . . . . 0 N--CA 1.489 1.503 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . 0.519 ' C ' ' H ' ' A' ' 84' ' ' LYS . . . -153.82 96.34 1.97 Allowed 'General case' 0 N--CA 1.45 -0.461 0 CA-C-O 121.245 0.545 . . . . 0.0 109.968 -179.913 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -47.48 -15.99 0.06 Allowed 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.616 -0.72 . . . . 0.0 109.777 179.633 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.519 ' H ' ' C ' ' A' ' 82' ' ' ALA . 99.3 mttt -64.59 -41.84 95.98 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.038 179.958 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 57.0 t-20 -65.01 -46.47 81.27 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.615 -179.625 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 5.8 tt -61.21 -41.8 97.48 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.896 -179.665 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 34.9 mt -57.01 -37.18 71.33 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.223 -0.444 . . . . 0.0 109.939 -179.565 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 87.0 mt-30 -71.29 -34.78 70.96 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.413 179.395 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -63.0 -46.6 86.89 Favored 'General case' 0 N--CA 1.462 0.158 0 C-N-CA 120.727 -0.389 . . . . 0.0 111.412 -179.163 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . 0.417 HG13 ' N ' ' A' ' 91' ' ' ALA . 17.5 pt -64.93 -44.15 96.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.891 -179.876 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . 0.474 ' O ' ' N ' ' A' ' 95' ' ' SER . . . -67.21 -47.68 70.15 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.955 -179.643 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 52.0 tt0 -66.85 -45.08 79.31 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.83 -179.921 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 88.9 tttt -62.87 -46.98 85.32 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.577 -179.865 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 70.0 mm-40 -90.85 2.1 56.42 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.328 -179.645 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' SER . . . . . 0.474 ' N ' ' O ' ' A' ' 91' ' ' ALA . 3.2 t 40.99 78.01 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.488 179.911 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' SER . . . . . 0.416 ' O ' ' CB ' ' A' ' 97' ' ' LEU . 67.0 p -136.44 38.59 2.68 Favored 'General case' 0 CA--C 1.513 -0.462 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.485 -179.702 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . 0.416 ' CB ' ' O ' ' A' ' 96' ' ' SER . 3.2 tp 78.15 94.47 0.06 Allowed 'General case' 0 N--CA 1.454 -0.254 0 CA-C-O 120.896 0.379 . . . . 0.0 111.026 179.514 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . 0.403 ' N ' ' CD1' ' A' ' 98' ' ' LEU . 10.8 mp -44.99 148.8 0.93 Allowed Pre-proline 0 C--N 1.326 -0.428 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.484 -179.784 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_endo -68.99 138.3 39.94 Favored 'Trans proline' 0 N--CA 1.495 1.591 0 C-N-CA 122.53 2.154 . . . . 0.0 112.174 -179.879 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 90.8 t80 -125.56 127.32 46.19 Favored 'General case' 0 CA--C 1.513 -0.463 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 179.991 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 92.8 m-85 -93.78 141.26 28.7 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.5 -179.182 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -136.7 138.0 40.57 Favored 'General case' 0 CA--C 1.514 -0.424 0 N-CA-C 110.064 -0.347 . . . . 0.0 110.064 179.619 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 25.2 m -120.31 126.6 50.94 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.455 -179.963 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -127.31 153.57 46.01 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.092 179.654 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 33.7 p -102.69 133.41 47.77 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-O 120.879 0.371 . . . . 0.0 110.196 179.836 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 50.8 p -162.7 166.36 24.51 Favored 'General case' 0 CA--C 1.515 -0.403 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.273 -179.745 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 120.58 -163.2 14.26 Favored Glycine 0 CA--C 1.527 0.79 0 N-CA-C 111.153 -0.779 . . . . 0.0 111.153 179.572 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 40.9 Cg_endo -69.53 147.42 64.28 Favored 'Trans proline' 0 N--CA 1.494 1.533 0 C-N-CA 122.59 2.193 . . . . 0.0 112.335 -179.324 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 78.8 p -68.5 -16.69 63.97 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.848 179.092 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 95.8 m-70 -86.01 -41.32 14.94 Favored 'General case' 0 CA--C 1.516 -0.364 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.181 179.998 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -126.96 78.33 74.11 Favored Pre-proline 0 N--CA 1.467 0.418 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.264 178.562 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_exo -59.92 125.68 18.33 Favored 'Trans proline' 0 C--N 1.304 -1.78 0 C-N-CA 122.465 2.11 . . . . 0.0 112.395 -179.693 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 69.1 p -111.57 173.83 6.16 Favored 'General case' 0 CA--C 1.514 -0.416 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.097 179.825 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 -132.1 146.66 52.19 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.651 -179.714 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 86.4 m -129.55 124.38 33.72 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.023 179.446 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 60.3 m -94.75 121.93 36.85 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.538 -179.953 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 117' ' ' THR . . . . . 0.427 ' CG2' ' CG2' ' A' ' 124' ' ' VAL . 81.3 m -112.92 127.29 56.16 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.218 -179.891 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 11.9 p -112.89 144.91 19.62 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.23 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.015 -179.792 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 82.9 tt0 -126.28 133.03 51.54 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.695 -179.867 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . 0.628 ' CZ ' ' CE1' ' A' ' 125' ' ' PHE . 48.7 p90 -166.73 157.96 12.59 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.508 179.478 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 53.38 19.98 1.81 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.871 0.367 . . . . 0.0 110.755 179.599 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 77.51 21.43 72.48 Favored Glycine 0 CA--C 1.524 0.655 0 N-CA-C 111.131 -0.788 . . . . 0.0 111.131 179.872 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -132.67 152.04 51.8 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 110.198 -0.297 . . . . 0.0 110.198 179.917 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . 0.427 ' CG2' ' CG2' ' A' ' 117' ' ' THR . 13.1 p -120.69 127.69 75.96 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.301 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.861 -179.804 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 125' ' ' PHE . . . . . 0.628 ' CE1' ' CZ ' ' A' ' 120' ' ' PHE . 53.0 m-85 -113.08 120.12 40.2 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.159 179.879 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 72.0 m -83.32 138.78 33.4 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.468 179.955 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -85.0 -169.38 45.92 Favored Glycine 0 CA--C 1.52 0.379 0 N-CA-C 110.591 -1.004 . . . . 0.0 110.591 179.871 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . 0.411 ' OE2' ' OG ' ' A' ' 139' ' ' SER . 6.6 pt-20 -97.34 132.99 42.54 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-O 120.839 0.352 . . . . 0.0 110.95 -179.711 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 98.1 mt-10 -55.38 146.0 20.8 Favored 'General case' 0 C--N 1.32 -0.717 0 C-N-CA 120.508 -0.477 . . . . 0.0 110.484 179.522 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -169.53 160.4 9.04 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.524 -179.997 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 29.3 ttpt -91.12 32.48 1.02 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.044 0.449 . . . . 0.0 110.479 179.789 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 132' ' ' THR . . . . . 0.415 ' HG1' ' CG ' ' A' ' 134' ' ' LYS . 0.4 OUTLIER -151.49 140.9 21.51 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.573 -179.75 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 28.6 ttmt -74.66 -47.08 33.86 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.352 179.885 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . 0.415 ' CG ' ' HG1' ' A' ' 132' ' ' THR . 47.1 pttt -53.7 -46.22 70.66 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.509 -179.252 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 4.7 tp -65.32 -39.44 92.45 Favored 'General case' 0 N--CA 1.444 -0.768 0 CA-C-O 120.811 0.338 . . . . 0.0 110.977 -179.678 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -57.68 -52.06 66.97 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.745 -179.311 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 69.9 mm-40 -57.85 -41.26 82.02 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.866 0.365 . . . . 0.0 110.608 -179.75 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 94.8 mtp -63.81 -41.39 97.88 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.575 -179.789 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 139' ' ' SER . . . . . 0.411 ' OG ' ' OE2' ' A' ' 128' ' ' GLU . 15.2 m -64.05 -39.2 93.54 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-N 116.544 -0.298 . . . . 0.0 110.72 -179.687 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -65.69 -44.38 86.36 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.819 -179.896 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -71.74 -24.79 61.84 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.568 179.983 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 38.1 ttmt -71.24 -48.56 50.39 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.201 179.773 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 7.1 p -70.11 -37.81 73.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.799 -179.626 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -63.89 -47.08 82.06 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-O 120.838 0.352 . . . . 0.0 110.801 -179.764 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 145' ' ' PHE . . . . . . . . . . . . . 63.7 t80 -60.55 -43.47 97.19 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.795 179.935 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 146' ' ' MET . . . . . . . . . . . . . 63.9 ttp -60.24 -38.64 84.05 Favored 'General case' 0 C--N 1.327 -0.407 0 O-C-N 123.331 0.394 . . . . 0.0 111.077 -179.433 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 48.8 m -72.26 -42.61 65.4 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.165 179.81 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 148' ' ' ILE . . . . . . . . . . . . . 71.9 mt -54.87 -25.33 15.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.63 -179.695 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 36.6 mtmt -59.31 -41.24 88.57 Favored 'General case' 0 C--N 1.319 -0.728 0 C-N-CA 120.573 -0.451 . . . . 0.0 110.556 -179.617 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 150' ' ' ASN . . . . . . . . . . . . . 9.7 m120 -63.68 -40.62 97.28 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.591 179.85 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.67 0 CA-C-O 117.912 -1.493 . . . . 0.0 110.9 -179.934 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 20.3 m . . . . . 0 N--CA 1.49 1.536 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . 0.511 ' C ' ' H ' ' A' ' 84' ' ' LYS . . . -154.04 95.75 1.88 Allowed 'General case' 0 N--CA 1.45 -0.45 0 CA-C-O 120.895 0.379 . . . . 0.0 110.379 179.85 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 -46.63 -15.83 0.03 OUTLIER 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.203 179.509 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.511 ' H ' ' C ' ' A' ' 82' ' ' ALA . 63.8 mttp -64.45 -41.64 96.43 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.182 179.311 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 14.6 m120 -65.29 -47.14 77.68 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.522 -179.33 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 7.0 tt -59.74 -43.65 94.16 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.692 -179.126 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 59.0 mt -55.93 -35.56 66.76 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.523 -179.937 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 88.9 mt-30 -70.84 -34.98 72.24 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.425 179.496 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -63.78 -48.12 78.22 Favored 'General case' 0 C--O 1.23 0.054 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.001 -178.794 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 29.8 pt -66.48 -35.09 74.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.606 179.919 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -58.05 -49.65 76.17 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.36 -179.398 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 56.8 tt0 -65.19 -44.26 88.96 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.707 -179.656 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 65.2 tttm -63.43 -47.15 83.12 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.557 -179.938 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -76.47 -0.45 23.0 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.351 -179.825 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 3.9 t 65.49 7.4 4.33 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.653 -179.813 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 26.0 m -75.15 158.03 33.69 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.483 -179.93 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . 0.437 ' N ' ' CD1' ' A' ' 97' ' ' LEU . 10.2 mp -64.39 128.19 34.7 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.398 -179.789 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . 0.446 ' N ' ' CD1' ' A' ' 98' ' ' LEU . 10.2 mp -50.13 148.02 6.52 Favored Pre-proline 0 N--CA 1.451 -0.396 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.609 179.764 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -71.08 142.96 43.35 Favored 'Trans proline' 0 C--N 1.311 -1.401 0 C-N-CA 122.772 2.314 . . . . 0.0 112.173 179.539 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 74.4 t80 -130.72 132.96 45.66 Favored 'General case' 0 C--O 1.233 0.237 0 N-CA-C 109.809 -0.441 . . . . 0.0 109.809 -179.994 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 39.0 m-85 -103.81 149.53 24.96 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.655 -179.734 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -150.02 92.99 1.95 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.924 0.392 . . . . 0.0 111.025 -179.908 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' THR . . . . . 0.417 ' OG1' ' NZ ' ' A' ' 133' ' ' LYS . 0.0 OUTLIER -70.4 136.99 50.07 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.195 179.911 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -128.25 153.32 47.08 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 120.866 0.365 . . . . 0.0 110.244 179.873 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 35.0 p -103.86 135.71 44.89 Favored 'General case' 0 N--CA 1.455 -0.208 0 CA-C-O 120.912 0.387 . . . . 0.0 110.642 179.9 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 24.8 m -163.1 161.81 25.41 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.447 179.987 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 116.68 -175.07 15.55 Favored Glycine 0 CA--C 1.522 0.52 0 N-CA-C 111.035 -0.826 . . . . 0.0 111.035 179.592 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_endo -64.66 152.22 82.72 Favored 'Trans proline' 0 C--N 1.301 -1.962 0 C-N-CA 122.725 2.283 . . . . 0.0 112.251 -179.904 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 78.1 p -66.39 -19.29 65.76 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.351 178.93 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 57.7 t-80 -86.84 -43.65 12.31 Favored 'General case' 0 CA--C 1.52 -0.188 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.541 179.821 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -124.66 77.75 63.9 Favored Pre-proline 0 N--CA 1.463 0.211 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.261 179.19 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -78.94 128.5 8.44 Favored 'Trans proline' 0 C--N 1.305 -1.716 0 C-N-CA 122.595 2.197 . . . . 0.0 112.375 -179.452 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 2.9 p -109.68 173.7 6.2 Favored 'General case' 0 CA--C 1.517 -0.305 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.321 179.485 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -131.25 143.89 50.9 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.526 -179.657 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 88.3 m -127.13 125.5 41.3 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.642 179.489 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 7.3 t -97.27 120.4 37.56 Favored 'General case' 0 CA--C 1.518 -0.258 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.389 -179.958 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 94.9 m -105.93 127.37 53.09 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.163 179.916 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 8.8 p -110.2 137.14 43.82 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.271 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.272 -179.901 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 9.1 tm-20 -124.16 130.42 52.52 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.613 -179.909 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . 0.626 ' CZ ' ' CE1' ' A' ' 125' ' ' PHE . 45.4 p90 -164.93 158.12 16.8 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.566 179.006 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 53.61 23.42 3.56 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.606 179.819 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 73.85 22.49 78.06 Favored Glycine 0 CA--C 1.521 0.461 0 N-CA-C 110.881 -0.888 . . . . 0.0 110.881 179.874 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -133.25 153.81 51.22 Favored 'General case' 0 CA--C 1.516 -0.337 0 CA-C-O 120.889 0.376 . . . . 0.0 110.606 179.789 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 7.2 p -122.2 128.61 75.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.862 -179.75 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 125' ' ' PHE . . . . . 0.626 ' CE1' ' CZ ' ' A' ' 120' ' ' PHE . 26.1 m-85 -113.33 122.33 47.09 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.249 179.408 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 4.8 p -81.97 136.64 35.26 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.512 -179.898 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -88.86 -170.26 45.23 Favored Glycine 0 CA--C 1.522 0.51 0 N-CA-C 110.785 -0.926 . . . . 0.0 110.785 179.902 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . 0.433 ' H ' ' CB ' ' A' ' 139' ' ' SER . 14.9 tt0 -96.55 133.98 40.34 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-O 120.872 0.368 . . . . 0.0 110.71 179.581 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -58.93 149.39 27.27 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.501 179.209 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -171.17 160.78 6.46 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.613 179.982 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -86.59 33.55 0.64 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.624 179.011 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 4.6 t -158.42 150.82 21.92 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.579 179.833 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . 0.417 ' NZ ' ' OG1' ' A' ' 103' ' ' THR . 68.4 mttm -82.41 -21.85 35.59 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.741 179.66 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -68.92 -54.79 13.52 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.774 -179.106 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 4.3 tp -63.61 -41.67 98.3 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 116.51 -0.314 . . . . 0.0 111.046 -179.635 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -55.46 -54.91 38.0 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.497 -179.365 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -61.01 -38.31 85.64 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.46 179.847 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 48.0 ttp -62.85 -42.7 99.85 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.387 -179.512 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 139' ' ' SER . . . . . 0.433 ' CB ' ' H ' ' A' ' 128' ' ' GLU . 63.3 m -65.23 -38.65 91.05 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.893 -179.781 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -63.42 -46.44 86.36 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.962 0.411 . . . . 0.0 110.717 -179.892 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -71.21 -22.98 61.94 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.449 179.95 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . 0.458 ' HZ3' ' CE ' ' A' ' 146' ' ' MET . 65.7 tttm -71.62 -49.27 41.72 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.327 179.674 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 6.4 p -67.45 -39.03 81.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.652 -179.4 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -61.96 -44.91 95.77 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.564 -179.3 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 145' ' ' PHE . . . . . . . . . . . . . 60.2 t80 -58.48 -42.74 88.2 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.522 -179.261 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 146' ' ' MET . . . . . 0.458 ' CE ' ' HZ3' ' A' ' 142' ' ' LYS . 56.3 mtt -63.74 -39.62 94.72 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.943 -179.604 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 68.1 m -67.18 -45.69 76.19 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.974 -179.946 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 148' ' ' ILE . . . . . . . . . . . . . 81.5 mt -52.56 -36.24 21.99 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.54 -179.509 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 54.7 mtpt -59.12 -42.75 91.35 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.782 -179.484 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 150' ' ' ASN . . . . . . . . . . . . . 94.6 m-20 -62.93 -40.12 96.68 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.362 179.803 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.743 0 CA-C-O 117.896 -1.502 . . . . 0.0 110.847 179.933 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 82' ' ' ALA . . . . . 0.489 ' O ' ' N ' ' A' ' 84' ' ' LYS . . . . . . . . 0 N--CA 1.453 -0.296 0 CA-C-O 120.795 0.331 . . . . 0.0 110.548 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 1.9 m-85 -45.41 -16.37 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.336 179.887 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.489 ' N ' ' O ' ' A' ' 82' ' ' ALA . 67.8 mttm -64.41 -40.13 95.18 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.11 179.677 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 13.6 m120 -66.08 -47.47 74.13 Favored 'General case' 0 N--CA 1.457 -0.098 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.485 -179.658 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 6.5 tt -60.95 -42.06 97.49 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.549 -179.319 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 34.7 mt -55.78 -37.32 68.42 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.062 -179.576 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 86.6 mt-30 -71.32 -36.69 71.68 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.981 0.419 . . . . 0.0 110.511 179.577 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 70.6 mm-40 -59.63 -49.26 78.44 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.994 -179.222 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 30.3 pt -64.29 -32.3 56.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.637 179.576 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -55.85 -49.3 73.69 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.178 -179.404 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 59.4 tt0 -67.14 -49.76 63.71 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.914 -179.683 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 65.4 tttm -58.95 -50.78 72.78 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.534 -179.335 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 94' ' ' GLU . . . . . 0.467 ' O ' ' CB ' ' A' ' 95' ' ' SER . 97.6 mt-10 -69.95 -15.76 63.1 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.6 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 95' ' ' SER . . . . . 0.467 ' CB ' ' O ' ' A' ' 94' ' ' GLU . 0.7 OUTLIER 79.17 9.91 1.64 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.433 -179.731 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 20.7 m -77.61 162.86 26.74 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.531 -179.793 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.574 HD12 ' N ' ' A' ' 97' ' ' LEU . 9.7 mp -70.22 127.49 32.97 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.683 -179.959 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.593 ' N ' HD12 ' A' ' 98' ' ' LEU . 10.1 mp -45.31 120.58 4.7 Favored Pre-proline 0 N--CA 1.452 -0.358 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.488 179.756 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -49.34 149.02 9.81 Favored 'Trans proline' 0 C--N 1.308 -1.563 0 C-N-CA 122.941 2.428 . . . . 0.0 112.866 179.404 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 85.1 t80 -130.73 133.48 46.08 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-O 121.119 0.485 . . . . 0.0 110.598 -179.32 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 88.2 m-85 -96.41 143.74 27.17 Favored 'General case' 0 N--CA 1.463 0.182 0 C-N-CA 120.745 -0.382 . . . . 0.0 111.251 -179.346 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -146.41 147.58 31.42 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.999 0.428 . . . . 0.0 110.93 -179.698 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -133.55 143.31 48.63 Favored 'General case' 0 CA--C 1.516 -0.348 0 CA-C-O 120.82 0.343 . . . . 0.0 110.463 179.594 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -120.68 146.83 46.03 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 120.882 0.373 . . . . 0.0 110.342 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 21.1 p -115.4 126.96 55.03 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.51 179.767 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 47.6 t -165.46 156.2 13.71 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.58 179.879 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 127.83 166.06 11.98 Favored Glycine 0 CA--C 1.524 0.602 0 N-CA-C 111.208 -0.757 . . . . 0.0 111.208 179.678 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 108' ' ' PRO . . . . . 0.57 ' HG2' ' HB3' ' A' ' 111' ' ' ALA . 29.1 Cg_endo -61.46 152.45 72.95 Favored 'Trans proline' 0 C--N 1.301 -1.957 0 C-N-CA 122.736 2.29 . . . . 0.0 112.467 179.67 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 78.1 p -64.27 -19.65 65.54 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.279 179.509 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 70.0 m80 -90.03 -38.73 13.39 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.298 179.699 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 111' ' ' ALA . . . . . 0.57 ' HB3' ' HG2' ' A' ' 108' ' ' PRO . . . -125.21 79.0 66.61 Favored Pre-proline 0 C--O 1.234 0.268 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.216 179.581 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 112' ' ' PRO . . . . . 0.502 ' O ' HG23 ' A' ' 113' ' ' THR . 57.3 Cg_endo -76.33 158.11 37.04 Favored 'Trans proline' 0 C--N 1.3 -2.007 0 C-N-CA 122.883 2.388 . . . . 0.0 112.111 179.657 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 113' ' ' THR . . . . . 0.502 HG23 ' O ' ' A' ' 112' ' ' PRO . 25.2 p -156.48 150.96 25.57 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.612 179.648 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -133.91 147.34 51.09 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.375 179.941 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 92.3 m -129.79 124.72 34.05 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.368 179.567 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 11.2 t -99.57 125.93 45.46 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.246 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 81.2 m -122.95 136.21 54.78 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.661 -179.527 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 12.3 p -114.83 147.89 17.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 120.962 0.41 . . . . 0.0 110.322 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 85.2 tt0 -127.23 134.32 50.11 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.415 -179.9 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 120' ' ' PHE . . . . . 0.623 ' CZ ' ' CE1' ' A' ' 125' ' ' PHE . 49.6 p90 -167.84 159.95 12.0 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.336 179.431 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 54.25 20.7 2.74 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.485 179.462 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 75.62 22.37 75.27 Favored Glycine 0 CA--C 1.522 0.526 0 N-CA-C 110.767 -0.933 . . . . 0.0 110.767 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -131.94 152.5 51.04 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-O 120.876 0.369 . . . . 0.0 110.567 179.839 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 124' ' ' VAL . . . . . 0.521 ' O ' HG13 ' A' ' 124' ' ' VAL . 7.4 p -120.35 126.61 75.45 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.289 0 CA-C-O 120.916 0.388 . . . . 0.0 110.532 -179.907 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 125' ' ' PHE . . . . . 0.623 ' CE1' ' CZ ' ' A' ' 120' ' ' PHE . 35.6 m-85 -111.42 120.01 40.73 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.294 -0.412 . . . . 0.0 109.913 179.623 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 5.2 p -83.35 137.75 33.82 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.498 -179.777 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -84.71 -168.87 45.06 Favored Glycine 0 CA--C 1.521 0.423 0 N-CA-C 110.618 -0.993 . . . . 0.0 110.618 179.908 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 128' ' ' GLU . . . . . 0.585 ' H ' ' CB ' ' A' ' 139' ' ' SER . 8.4 pt-20 -98.68 132.97 43.65 Favored 'General case' 0 C--N 1.33 -0.266 0 O-C-N 122.701 -0.293 . . . . 0.0 110.699 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -54.13 144.71 18.96 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.224 179.258 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -169.76 159.92 8.36 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.319 -179.729 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 25.7 pttm -90.9 33.65 0.93 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.527 179.702 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 3.4 t -158.05 149.35 21.24 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.586 -179.612 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -79.65 -32.76 41.63 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.213 179.579 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -59.17 -52.97 63.43 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.005 -178.893 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 4.0 tp -65.32 -40.2 93.43 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.292 -179.992 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -56.35 -54.91 39.97 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.357 -179.597 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -57.92 -39.93 79.18 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.515 -179.83 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 50.7 ttp -63.47 -41.52 98.6 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.767 -179.753 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 139' ' ' SER . . . . . 0.585 ' CB ' ' H ' ' A' ' 128' ' ' GLU . 78.0 p -63.95 -35.73 81.66 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.777 -179.53 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -67.64 -47.03 70.73 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.785 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -71.24 -25.47 62.5 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.93 179.934 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -70.94 -49.36 46.44 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.184 179.832 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 143' ' ' VAL . . . . . 0.452 HG13 ' N ' ' A' ' 144' ' ' ALA . 8.3 p -68.39 -40.05 81.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.885 -179.8 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 144' ' ' ALA . . . . . 0.452 ' N ' HG13 ' A' ' 143' ' ' VAL . . . -62.21 -46.3 89.48 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.941 -179.471 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 145' ' ' PHE . . . . . . . . . . . . . 74.9 t80 -60.26 -42.08 94.58 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.925 0.393 . . . . 0.0 110.621 179.993 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 146' ' ' MET . . . . . . . . . . . . . 33.5 ttm -62.37 -39.58 93.65 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.044 -179.829 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 35.9 t -68.66 -43.45 76.16 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.99 -179.783 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 148' ' ' ILE . . . . . . . . . . . . . 85.4 mt -56.98 -29.94 32.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.796 -179.598 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 25.0 mtpp . . . . . 0 C--N 1.325 -0.483 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.766 -179.944 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 82' ' ' ALA . . . . . 0.493 ' C ' ' N ' ' A' ' 84' ' ' LYS . . . . . . . . 0 N--CA 1.451 -0.422 0 CA-C-O 121.166 0.508 . . . . 0.0 110.332 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 3.0 m-85 -47.43 -15.5 0.05 OUTLIER 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.788 -0.642 . . . . 0.0 109.766 179.452 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.493 ' N ' ' C ' ' A' ' 82' ' ' ALA . 99.4 mttt -63.74 -39.95 95.52 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.05 179.795 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 85' ' ' ASN . . . . . 0.566 ' ND2' ' OE2' ' A' ' 89' ' ' GLU . 4.4 t30 -66.19 -46.5 77.1 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.675 -0.693 . . . . 0.0 111.049 -179.689 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 6.0 tt -60.54 -42.64 96.94 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.677 -179.547 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 56.9 mt -56.22 -35.06 66.91 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.117 179.794 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 88.6 mt-30 -74.68 -37.46 62.67 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.08 179.26 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 89' ' ' GLU . . . . . 0.566 ' OE2' ' ND2' ' A' ' 85' ' ' ASN . 97.6 mt-10 -63.32 -50.34 70.43 Favored 'General case' 0 C--O 1.232 0.142 0 C-N-CA 120.776 -0.369 . . . . 0.0 111.415 -179.173 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.462 HD12 ' N ' ' A' ' 91' ' ' ALA . 2.2 pp -66.21 -41.73 89.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.304 179.78 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 91' ' ' ALA . . . . . 0.462 ' N ' HD12 ' A' ' 90' ' ' ILE . . . -57.18 -48.7 78.07 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.527 -179.871 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 88.6 mt-30 -71.8 -41.33 68.4 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.802 179.779 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 88.9 tttt -60.88 -49.27 78.13 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.551 -179.576 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 94' ' ' GLU . . . . . 0.429 ' C ' ' H ' ' A' ' 96' ' ' SER . 98.0 mt-10 -75.95 9.21 2.55 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.379 179.947 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 95' ' ' SER . . . . . 0.436 ' O ' ' O ' ' A' ' 96' ' ' SER . 13.9 t 55.06 9.03 0.28 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.571 179.955 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 96' ' ' SER . . . . . 0.436 ' O ' ' O ' ' A' ' 95' ' ' SER . 5.4 t -59.89 -130.82 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.226 179.724 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 92.3 mt -134.85 124.73 25.51 Favored 'General case' 0 CA--C 1.515 -0.388 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.588 179.895 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.544 ' N ' HD12 ' A' ' 98' ' ' LEU . 10.7 mp -44.94 151.29 0.65 Allowed Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.439 -179.385 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_endo -66.88 170.88 11.96 Favored 'Trans proline' 0 C--N 1.308 -1.559 0 C-N-CA 122.836 2.357 . . . . 0.0 111.931 -179.896 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 32.8 t80 -143.82 114.76 7.79 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.178 179.246 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 97.7 m-85 -96.2 129.93 43.39 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.933 0.397 . . . . 0.0 110.253 -179.948 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -147.44 147.86 30.66 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.427 -179.81 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 1.5 t -136.3 146.16 46.31 Favored 'General case' 0 CA--C 1.518 -0.252 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.563 179.866 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -121.35 146.17 47.13 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.156 179.935 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 12.1 p -114.64 126.2 54.62 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-O 120.978 0.418 . . . . 0.0 110.39 179.839 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 52.8 p -160.72 164.17 31.83 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.275 179.817 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 119.64 163.8 12.41 Favored Glycine 0 CA--C 1.525 0.698 0 N-CA-C 111.005 -0.838 . . . . 0.0 111.005 179.681 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 22.4 Cg_endo -61.15 151.75 76.6 Favored 'Trans proline' 0 C--N 1.304 -1.811 0 C-N-CA 122.938 2.425 . . . . 0.0 112.127 179.537 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 38.8 t -62.94 -19.35 64.17 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.209 179.193 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 58.3 m170 -89.39 -44.09 10.43 Favored 'General case' 0 CA--C 1.517 -0.301 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.499 179.91 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -124.56 77.56 63.21 Favored Pre-proline 0 N--CA 1.467 0.387 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.156 179.244 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 112' ' ' PRO . . . . . 0.457 ' O ' HG23 ' A' ' 113' ' ' THR . 72.9 Cg_endo -77.33 165.09 28.15 Favored 'Trans proline' 0 C--N 1.306 -1.672 0 C-N-CA 122.661 2.24 . . . . 0.0 112.367 -179.694 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 113' ' ' THR . . . . . 0.457 HG23 ' O ' ' A' ' 112' ' ' PRO . 38.8 p -156.17 151.4 26.6 Favored 'General case' 0 CA--C 1.516 -0.352 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.314 179.929 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -132.49 145.79 51.44 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.442 -179.853 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 88.7 m -133.45 128.15 34.84 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.184 -0.462 . . . . 0.0 109.991 179.63 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 27.6 t -102.19 129.76 48.66 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.471 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 65.4 m -119.09 132.63 56.03 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.032 -179.908 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 12.8 p -113.64 146.15 18.6 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.214 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.104 -179.597 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 81.2 tt0 -131.07 139.2 49.86 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.724 179.929 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 120' ' ' PHE . . . . . 0.626 ' CZ ' ' CE1' ' A' ' 125' ' ' PHE . 52.4 p90 -168.89 160.26 10.09 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.576 179.739 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 51.87 22.42 1.74 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.992 0.425 . . . . 0.0 110.683 179.697 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 75.88 22.74 73.82 Favored Glycine 0 CA--C 1.524 0.65 0 N-CA-C 111.132 -0.787 . . . . 0.0 111.132 179.825 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -132.19 151.02 52.02 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 110.089 -0.337 . . . . 0.0 110.089 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 124' ' ' VAL . . . . . 0.446 ' O ' HG13 ' A' ' 124' ' ' VAL . 6.5 p -118.23 125.06 73.99 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.225 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.93 -179.644 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 125' ' ' PHE . . . . . 0.626 ' CE1' ' CZ ' ' A' ' 120' ' ' PHE . 63.0 m-85 -110.14 117.53 33.96 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 116.185 -0.461 . . . . 0.0 109.888 179.903 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 6.0 p -80.6 132.12 35.59 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.503 -179.909 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -84.69 -167.64 43.24 Favored Glycine 0 CA--C 1.52 0.391 0 N-CA-C 110.614 -0.995 . . . . 0.0 110.614 179.689 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 128' ' ' GLU . . . . . 0.441 ' H ' ' CB ' ' A' ' 139' ' ' SER . 4.6 pt-20 -90.77 -178.6 5.3 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.835 0.35 . . . . 0.0 110.182 -179.905 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 129' ' ' GLU . . . . . 0.539 ' N ' ' OE1' ' A' ' 129' ' ' GLU . 55.1 mp0 -110.8 145.7 37.69 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.235 178.995 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -170.24 163.35 8.91 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.689 -179.936 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 62.1 mttp -85.83 35.31 0.62 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.37 179.354 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 7.5 t -157.54 150.54 23.32 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.676 179.887 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 63.2 mttp -82.06 -34.73 29.3 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.824 179.398 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 134' ' ' LYS . . . . . 0.405 ' N ' ' CD ' ' A' ' 134' ' ' LYS . 13.6 mptt -56.66 -54.34 47.18 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.84 -178.789 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 11.6 tp -63.34 -38.43 91.12 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.559 -179.696 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -58.13 -54.48 46.51 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.808 -179.574 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 81.1 mm-40 -58.75 -42.74 89.59 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.797 0.332 . . . . 0.0 110.403 -179.674 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 26.1 ttm -61.48 -41.41 97.21 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.664 179.882 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 139' ' ' SER . . . . . 0.441 ' CB ' ' H ' ' A' ' 128' ' ' GLU . 15.7 m -58.81 -39.93 82.6 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.786 -179.699 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -64.88 -42.23 95.0 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.93 0.395 . . . . 0.0 111.046 -179.897 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -69.66 -28.81 66.2 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.95 179.97 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 85.5 mttt -71.73 -49.79 36.09 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.79 179.694 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 143' ' ' VAL . . . . . 0.484 HG13 ' N ' ' A' ' 144' ' ' ALA . 7.3 p -67.34 -42.52 87.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.737 -179.581 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 144' ' ' ALA . . . . . 0.484 ' N ' HG13 ' A' ' 143' ' ' VAL . . . -63.16 -46.47 87.04 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.901 -179.81 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 145' ' ' PHE . . . . . . . . . . . . . 69.6 t80 -60.21 -42.69 95.68 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.534 -179.757 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 146' ' ' MET . . . . . . . . . . . . . 54.6 ttp -61.43 -37.57 84.01 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.631 -179.487 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 37.6 t -71.29 -44.28 65.48 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.962 0.41 . . . . 0.0 111.133 179.858 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 148' ' ' ILE . . . . . . . . . . . . . 90.6 mt -55.95 -30.44 28.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.525 -179.752 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 53.3 mtpt . . . . . 0 C--N 1.323 -0.55 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.789 179.888 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 82' ' ' ALA . . . . . 0.493 ' C ' ' N ' ' A' ' 84' ' ' LYS . . . . . . . . 0 N--CA 1.447 -0.589 0 CA-C-O 121.253 0.549 . . . . 0.0 110.187 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 2.2 m-85 -46.46 -16.09 0.03 OUTLIER 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 115.845 -0.616 . . . . 0.0 109.929 179.633 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.493 ' N ' ' C ' ' A' ' 82' ' ' ALA . 68.4 mttm -63.9 -39.74 94.89 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.089 179.67 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 45.2 t30 -66.58 -47.07 73.92 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.679 -179.838 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 7.0 tt -61.76 -41.34 97.56 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.812 -179.905 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 32.3 mt -55.79 -36.24 67.18 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.139 -0.482 . . . . 0.0 109.856 -179.527 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 90.5 mt-30 -72.29 -36.05 68.85 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.294 179.29 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 70.3 mm-40 -60.34 -47.3 86.64 Favored 'General case' 0 C--O 1.233 0.216 0 C-N-CA 120.779 -0.368 . . . . 0.0 111.043 -179.131 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 28.0 pt -65.08 -32.89 60.23 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.499 179.869 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -55.49 -49.28 72.95 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.541 -179.604 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 27.9 mm100 -67.92 -49.46 61.74 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.301 -0.408 . . . . 0.0 111.116 179.798 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -58.88 -51.25 70.85 Favored 'General case' 0 C--N 1.331 -0.203 0 C-N-CA 120.702 -0.399 . . . . 0.0 110.786 -179.379 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 94' ' ' GLU . . . . . 0.406 ' O ' ' CB ' ' A' ' 95' ' ' SER . 80.4 mm-40 -68.97 -13.75 62.64 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.666 179.748 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 95' ' ' SER . . . . . 0.406 ' CB ' ' O ' ' A' ' 94' ' ' GLU . 1.0 OUTLIER 75.45 10.37 3.52 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.287 -179.861 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 8.6 p -79.71 166.2 22.04 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.659 -179.518 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 70.3 mt -72.7 133.8 44.76 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.932 0.396 . . . . 0.0 110.739 -179.706 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.516 ' N ' HD12 ' A' ' 98' ' ' LEU . 11.0 mp -44.81 152.92 0.51 Allowed Pre-proline 0 C--N 1.327 -0.405 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.71 -179.651 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_endo -61.17 170.0 5.55 Favored 'Trans proline' 0 N--CA 1.496 1.654 0 C-N-CA 122.847 2.365 . . . . 0.0 111.889 179.964 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 42.6 t80 -145.9 117.92 8.28 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.454 179.172 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 101' ' ' TYR . . . . . 0.471 ' CE2' ' NZ ' ' A' ' 84' ' ' LYS . 96.9 m-85 -102.79 136.62 42.28 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.898 0.38 . . . . 0.0 110.349 179.949 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -145.98 146.68 31.1 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.455 -179.803 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 92.2 m -124.31 130.86 53.25 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.314 179.926 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -111.35 139.8 46.45 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.529 -0.305 . . . . 0.0 110.224 179.825 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 22.7 p -117.22 122.71 44.76 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-O 121.019 0.438 . . . . 0.0 110.803 179.499 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 51.8 p -162.52 162.6 27.45 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.325 179.893 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 126.4 165.45 11.99 Favored Glycine 0 CA--C 1.523 0.54 0 N-CA-C 111.118 -0.793 . . . . 0.0 111.118 179.511 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -60.54 150.9 79.1 Favored 'Trans proline' 0 C--N 1.304 -1.796 0 C-N-CA 122.787 2.325 . . . . 0.0 112.036 179.378 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 99.0 p -63.2 -16.74 61.1 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.416 179.379 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 84.6 t60 -92.66 -43.4 9.11 Favored 'General case' 0 CA--C 1.519 -0.23 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.627 179.759 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -124.24 78.16 60.45 Favored Pre-proline 0 CA--C 1.531 0.219 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.527 179.807 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 112' ' ' PRO . . . . . 0.473 ' O ' HG23 ' A' ' 113' ' ' THR . 70.2 Cg_endo -76.43 163.22 32.49 Favored 'Trans proline' 0 C--N 1.305 -1.718 0 C-N-CA 122.669 2.246 . . . . 0.0 112.192 -179.949 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 113' ' ' THR . . . . . 0.473 HG23 ' O ' ' A' ' 112' ' ' PRO . 31.0 p -156.61 151.32 25.81 Favored 'General case' 0 CA--C 1.514 -0.431 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.132 179.375 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -131.27 144.52 51.35 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.022 -0.535 . . . . 0.0 109.734 -179.801 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 115' ' ' THR . . . . . 0.424 ' OG1' ' OE1' ' A' ' 129' ' ' GLU . 72.4 m -130.33 125.5 34.84 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.932 0.396 . . . . 0.0 110.16 179.822 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 11.7 t -96.94 122.4 39.88 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.018 179.779 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 52.2 m -114.24 130.62 56.64 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.131 179.911 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 10.8 p -113.33 143.51 22.88 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.234 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.908 -179.953 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 80.9 tt0 -128.05 135.32 49.7 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.64 179.957 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 120' ' ' PHE . . . . . 0.622 ' CZ ' ' CE1' ' A' ' 125' ' ' PHE . 52.6 p90 -167.26 158.5 11.93 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.5 179.709 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 54.64 21.56 3.51 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.857 0.361 . . . . 0.0 110.594 179.587 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 76.0 22.59 73.81 Favored Glycine 0 CA--C 1.521 0.468 0 N-CA-C 110.869 -0.893 . . . . 0.0 110.869 179.927 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -132.34 151.99 51.61 Favored 'General case' 0 C--N 1.328 -0.338 0 O-C-N 122.768 -0.254 . . . . 0.0 110.413 -179.976 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 124' ' ' VAL . . . . . 0.428 ' O ' HG13 ' A' ' 124' ' ' VAL . 7.1 p -121.34 127.77 75.8 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.555 -179.782 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 125' ' ' PHE . . . . . 0.622 ' CE1' ' CZ ' ' A' ' 120' ' ' PHE . 24.1 m-85 -113.11 120.3 40.81 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.163 179.782 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 84.4 p -81.21 136.07 35.81 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.544 179.895 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -83.82 -169.89 45.79 Favored Glycine 0 CA--C 1.524 0.629 0 N-CA-C 110.689 -0.964 . . . . 0.0 110.689 179.806 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 128' ' ' GLU . . . . . 0.491 ' H ' ' CB ' ' A' ' 139' ' ' SER . 12.2 tt0 -99.1 134.18 42.31 Favored 'General case' 0 N--CA 1.448 -0.525 0 CA-C-O 121.014 0.435 . . . . 0.0 110.715 179.596 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 129' ' ' GLU . . . . . 0.424 ' OE1' ' OG1' ' A' ' 115' ' ' THR . 70.4 mm-40 -56.06 146.05 23.9 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.385 179.109 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -169.5 159.95 8.82 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.517 -179.936 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 52.4 mtpt -88.97 33.07 0.79 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.63 179.462 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 3.6 t -158.49 150.17 21.18 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.688 179.835 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 55.8 mtmt -82.58 -21.44 35.24 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.785 179.364 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 59.5 mttp -69.59 -53.95 16.39 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.788 -179.447 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 4.1 tp -64.3 -40.24 95.54 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-O 120.789 0.328 . . . . 0.0 111.002 -179.796 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -57.29 -54.29 48.41 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.355 -179.111 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 75.8 mm-40 -56.51 -40.87 75.73 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.854 0.359 . . . . 0.0 110.512 -179.869 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 51.8 mtt -62.99 -41.39 99.55 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.967 -179.616 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 139' ' ' SER . . . . . 0.491 ' CB ' ' H ' ' A' ' 128' ' ' GLU . 68.7 m -62.92 -40.74 98.51 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 121.04 -0.264 . . . . 0.0 111.19 -179.95 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -62.37 -45.82 91.44 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.102 0.477 . . . . 0.0 110.59 -179.583 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -69.83 -25.49 63.77 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.936 179.991 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 142' ' ' LYS . . . . . 0.513 ' O ' ' SD ' ' A' ' 146' ' ' MET . 37.5 ttpt -71.43 -49.72 38.88 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.042 0.449 . . . . 0.0 111.597 -179.992 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 143' ' ' VAL . . . . . 0.424 HG13 ' N ' ' A' ' 144' ' ' ALA . 7.6 p -67.33 -39.62 83.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.067 -179.693 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 144' ' ' ALA . . . . . 0.424 ' N ' HG13 ' A' ' 143' ' ' VAL . . . -63.28 -46.48 86.62 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-N 116.339 -0.392 . . . . 0.0 111.079 -179.098 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 145' ' ' PHE . . . . . . . . . . . . . 65.6 t80 -59.84 -42.28 93.24 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.484 -0.325 . . . . 0.0 110.573 -179.71 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 146' ' ' MET . . . . . 0.581 ' SD ' ' N ' ' A' ' 146' ' ' MET . 0.0 OUTLIER -63.07 -39.34 94.44 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.764 -179.601 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 72.8 p -67.76 -42.1 82.29 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.989 -179.858 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 148' ' ' ILE . . . . . . . . . . . . . 93.3 mt -59.05 -30.85 44.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.78 -179.675 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 54.9 mtpt . . . . . 0 C--N 1.328 -0.344 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.802 -179.996 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 82' ' ' ALA . . . . . 0.486 ' C ' ' N ' ' A' ' 84' ' ' LYS . . . . . . . . 0 N--CA 1.45 -0.44 0 CA-C-O 121.118 0.485 . . . . 0.0 109.723 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -47.58 -16.35 0.06 Allowed 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.526 -0.761 . . . . 0.0 109.761 179.792 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.486 ' N ' ' C ' ' A' ' 82' ' ' ALA . 51.9 mtmt -63.73 -41.08 98.11 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.027 179.843 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 34.1 t30 -64.68 -47.91 76.65 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.934 -179.517 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 6.3 tt -61.92 -39.69 92.93 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.885 -179.684 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.513 HD23 HD11 ' A' ' 90' ' ' ILE . 29.9 mt -56.75 -38.71 72.8 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 -179.628 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 84.5 mt-30 -68.96 -36.2 77.64 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.682 179.214 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 80.7 mm-40 -61.74 -48.14 82.04 Favored 'General case' 0 C--O 1.232 0.154 0 C-N-CA 120.67 -0.412 . . . . 0.0 111.355 -179.066 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.513 HD11 HD23 ' A' ' 87' ' ' LEU . 27.2 pt -65.0 -35.15 74.79 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.501 179.804 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -58.83 -49.88 76.07 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.687 -179.516 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 68.4 tp60 -66.77 -47.33 72.51 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.992 -179.738 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -61.48 -47.83 83.85 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.607 -179.31 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 94' ' ' GLU . . . . . 0.432 ' O ' ' CB ' ' A' ' 95' ' ' SER . 80.3 mm-40 -71.68 -14.42 62.03 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.575 179.806 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 95' ' ' SER . . . . . 0.432 ' CB ' ' O ' ' A' ' 94' ' ' GLU . 0.7 OUTLIER 78.94 9.11 1.85 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.383 -179.996 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 17.5 m -77.81 164.39 25.25 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.504 179.918 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 69.2 mt -69.68 129.24 39.07 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.495 -179.654 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.569 ' N ' HD12 ' A' ' 98' ' ' LEU . 10.3 mp -45.63 147.93 1.4 Allowed Pre-proline 0 CA--C 1.533 0.321 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.54 -179.491 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -69.77 140.76 43.45 Favored 'Trans proline' 0 N--CA 1.494 1.513 0 C-N-CA 122.74 2.293 . . . . 0.0 111.767 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 88.9 t80 -125.95 128.77 48.03 Favored 'General case' 0 CA--C 1.511 -0.529 0 N-CA-C 108.542 -0.91 . . . . 0.0 108.542 -179.966 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 88.5 m-85 -97.51 145.32 26.34 Favored 'General case' 0 C--N 1.324 -0.53 0 C-N-CA 120.706 -0.398 . . . . 0.0 110.321 -179.07 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -144.19 145.67 32.23 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 110.174 -0.306 . . . . 0.0 110.174 179.651 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 96.8 m -125.97 132.11 52.12 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.499 179.927 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -125.45 151.85 45.69 Favored 'General case' 0 N--CA 1.467 0.391 0 N-CA-C 109.999 -0.371 . . . . 0.0 109.999 179.798 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 22.1 p -110.4 135.38 51.19 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-O 120.834 0.349 . . . . 0.0 110.258 179.85 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 30.3 p -161.33 163.06 31.02 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.26 179.903 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 120.07 -176.09 16.08 Favored Glycine 0 CA--C 1.527 0.836 0 N-CA-C 111.328 -0.709 . . . . 0.0 111.328 179.556 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -61.75 153.44 67.63 Favored 'Trans proline' 0 N--CA 1.495 1.59 0 C-N-CA 122.655 2.236 . . . . 0.0 112.276 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 6.5 m -68.3 -16.26 63.88 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.735 -0.666 . . . . 0.0 109.97 179.156 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 55.4 t-80 -90.81 -43.63 9.94 Favored 'General case' 0 CA--C 1.518 -0.253 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.442 179.774 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -124.4 78.52 61.52 Favored Pre-proline 0 CA--C 1.533 0.303 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.413 179.271 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -81.08 129.74 7.02 Favored 'Trans proline' 0 C--N 1.313 -1.31 0 C-N-CA 122.464 2.109 . . . . 0.0 112.466 179.835 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 72.2 p -111.2 173.44 6.34 Favored 'General case' 0 CA--C 1.515 -0.388 0 CA-C-N 115.885 -0.598 . . . . 0.0 109.895 179.926 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -130.81 145.19 51.91 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.444 -179.768 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 88.4 m -125.25 120.36 31.02 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.198 -0.455 . . . . 0.0 109.821 179.493 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 116' ' ' SER . . . . . 0.422 ' O ' ' HB2' ' A' ' 140' ' ' ALA . 35.9 t -95.66 122.77 38.78 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.36 -179.837 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 117' ' ' THR . . . . . 0.517 HG22 ' N ' ' A' ' 118' ' ' VAL . 54.0 m -107.17 159.89 15.99 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.029 179.937 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 118' ' ' VAL . . . . . 0.517 ' N ' HG22 ' A' ' 117' ' ' THR . 14.7 p -141.25 137.94 33.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.187 -0.46 . . . . 0.0 109.965 179.664 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 81.2 tt0 -121.82 127.15 50.23 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.634 179.848 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 120' ' ' PHE . . . . . 0.403 ' CZ ' ' CE1' ' A' ' 125' ' ' PHE . 42.1 p90 -159.6 154.57 24.82 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.519 179.225 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 52.18 25.66 3.44 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.888 0.375 . . . . 0.0 110.902 179.557 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 72.75 23.68 77.46 Favored Glycine 0 CA--C 1.522 0.501 0 N-CA-C 111.002 -0.839 . . . . 0.0 111.002 179.849 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 45.7 mmtt -130.93 150.57 52.03 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 110.224 -0.288 . . . . 0.0 110.224 -179.78 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 124' ' ' VAL . . . . . 0.431 ' O ' HG13 ' A' ' 124' ' ' VAL . 6.2 p -120.59 125.74 74.45 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.627 -179.987 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 125' ' ' PHE . . . . . 0.403 ' CE1' ' CZ ' ' A' ' 120' ' ' PHE . 41.9 m-85 -112.05 120.6 42.4 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.262 179.774 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 43.1 t -82.29 137.11 34.91 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.515 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -84.76 -169.63 46.07 Favored Glycine 0 CA--C 1.521 0.466 0 N-CA-C 110.559 -1.017 . . . . 0.0 110.559 179.802 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -99.28 136.06 39.78 Favored 'General case' 0 CA--C 1.532 0.264 0 O-C-N 122.769 -0.254 . . . . 0.0 111.068 -179.577 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 18.4 pt-20 -54.29 142.59 25.9 Favored 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 120.403 -0.519 . . . . 0.0 110.138 179.589 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -162.94 155.74 19.1 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.602 179.835 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 51.2 tttm -90.49 31.09 1.05 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.302 179.918 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 7.4 t -159.06 149.53 19.57 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.765 179.798 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -73.7 -40.61 63.48 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.188 179.388 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -53.36 -55.17 27.07 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.949 -178.75 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 12.1 tp -64.32 -39.44 93.92 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.785 0.326 . . . . 0.0 110.845 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -57.08 -55.18 38.1 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.678 -179.305 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -59.86 -42.12 92.96 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.841 0.353 . . . . 0.0 110.46 -179.54 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 41.5 tpp -60.19 -46.32 90.13 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.371 -179.606 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 37.1 m -61.3 -37.04 81.78 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.009 -179.812 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 140' ' ' ALA . . . . . 0.422 ' HB2' ' O ' ' A' ' 116' ' ' SER . . . -63.97 -47.57 79.86 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.936 0.398 . . . . 0.0 110.725 179.781 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -73.2 -23.48 60.4 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.742 179.901 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -70.81 -49.58 44.82 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.227 179.968 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 143' ' ' VAL . . . . . 0.468 HG13 ' N ' ' A' ' 144' ' ' ALA . 7.1 p -68.87 -41.49 82.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.786 -179.767 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 144' ' ' ALA . . . . . 0.468 ' N ' HG13 ' A' ' 143' ' ' VAL . . . -63.72 -46.09 86.99 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.698 -179.857 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 145' ' ' PHE . . . . . . . . . . . . . 84.7 t80 -60.56 -43.41 97.3 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.809 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 146' ' ' MET . . . . . . . . . . . . . 79.8 mmm -63.02 -37.56 87.69 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.476 -179.773 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 37.8 m -72.29 -43.14 64.67 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 120.784 -0.366 . . . . 0.0 111.044 179.569 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 148' ' ' ILE . . . . . . . . . . . . . 71.5 mt -55.87 -27.3 22.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 C-N-CA 120.956 -0.298 . . . . 0.0 110.78 -179.559 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 41.6 mttt . . . . . 0 C--N 1.325 -0.488 0 C-N-CA 120.653 -0.419 . . . . 0.0 111.242 179.662 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 82' ' ' ALA . . . . . 0.49 ' C ' ' N ' ' A' ' 84' ' ' LYS . . . . . . . . 0 N--CA 1.452 -0.35 0 CA-C-O 121.143 0.497 . . . . 0.0 110.019 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -47.07 -15.75 0.04 OUTLIER 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.689 -0.687 . . . . 0.0 109.885 179.551 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.49 ' N ' ' C ' ' A' ' 82' ' ' ALA . 99.4 mttt -64.44 -40.51 95.87 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.08 179.759 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 85' ' ' ASN . . . . . 0.414 ' O ' ' OE2' ' A' ' 89' ' ' GLU . 94.5 m-20 -65.12 -47.82 75.81 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.843 -179.769 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 6.3 tt -60.68 -40.54 92.53 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.908 -179.631 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.608 HD23 HD11 ' A' ' 90' ' ' ILE . 38.2 mt -56.6 -37.68 70.98 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.269 -0.423 . . . . 0.0 109.995 -179.779 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 87.4 mt-30 -69.83 -36.97 76.03 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.429 179.526 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 89' ' ' GLU . . . . . 0.521 ' OE1' ' N ' ' A' ' 89' ' ' GLU . 0.3 OUTLIER -61.63 -48.85 79.01 Favored 'General case' 0 C--O 1.233 0.22 0 C-N-CA 120.774 -0.37 . . . . 0.0 111.037 -178.932 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.608 HD11 HD23 ' A' ' 87' ' ' LEU . 19.2 pt -63.74 -40.47 89.17 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.663 -179.693 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 91' ' ' ALA . . . . . 0.401 ' N ' HG13 ' A' ' 90' ' ' ILE . . . -59.57 -48.88 79.93 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.657 -179.78 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 58.6 tt0 -68.71 -41.98 78.35 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.722 179.717 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 65.1 tttm -61.7 -49.5 76.2 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.693 -179.73 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 94' ' ' GLU . . . . . 0.419 ' O ' ' CB ' ' A' ' 95' ' ' SER . 98.1 mt-10 -66.6 -19.58 65.8 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.456 179.627 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 95' ' ' SER . . . . . 0.419 ' CB ' ' O ' ' A' ' 94' ' ' GLU . 1.1 t 76.02 21.21 1.58 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.013 -179.654 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 12.8 p -79.56 -114.73 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.283 -179.874 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 54.4 tp -141.03 126.55 18.83 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.398 179.747 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.561 ' N ' HD12 ' A' ' 98' ' ' LEU . 10.4 mp -44.91 143.94 2.1 Favored Pre-proline 0 C--N 1.327 -0.375 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.704 -179.503 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -70.26 139.35 38.31 Favored 'Trans proline' 0 N--CA 1.495 1.601 0 C-N-CA 122.508 2.139 . . . . 0.0 111.899 -179.897 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 86.8 t80 -128.05 129.08 46.09 Favored 'General case' 0 CA--C 1.514 -0.422 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 -179.527 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 81.6 m-85 -96.53 146.14 25.07 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.588 -179.126 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -147.35 148.14 31.04 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.242 179.967 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 1.2 t -130.67 138.22 49.94 Favored 'General case' 0 CA--C 1.519 -0.217 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.666 179.75 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -123.02 150.77 42.62 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.289 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 30.1 p -108.79 136.5 48.26 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-O 120.863 0.363 . . . . 0.0 110.152 179.757 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 38.6 t -164.01 160.97 22.4 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.22 -179.812 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 119.43 -179.13 16.67 Favored Glycine 0 CA--C 1.522 0.521 0 N-CA-C 111.21 -0.756 . . . . 0.0 111.21 179.908 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_endo -61.07 148.57 92.44 Favored 'Trans proline' 0 C--N 1.308 -1.57 0 C-N-CA 122.828 2.352 . . . . 0.0 112.139 -179.881 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 32.7 t -63.5 -16.63 61.26 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.819 -0.628 . . . . 0.0 109.872 179.124 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 61.3 t-80 -89.22 -44.0 10.59 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.396 179.872 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -125.58 77.81 68.97 Favored Pre-proline 0 N--CA 1.465 0.286 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.38 179.124 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -81.42 128.97 6.41 Favored 'Trans proline' 0 C--N 1.306 -1.677 0 C-N-CA 122.467 2.111 . . . . 0.0 112.253 179.931 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 4.4 p -108.77 173.07 6.48 Favored 'General case' 0 CA--C 1.515 -0.38 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.049 179.712 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -133.62 147.42 51.48 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.493 -179.455 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 85.6 m -129.11 123.1 31.32 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.137 179.602 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 35.0 t -96.74 125.17 41.01 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.25 -179.861 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 98.2 m -121.86 133.8 54.88 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.289 -179.74 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 13.8 p -118.51 152.3 20.66 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.208 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.255 -179.622 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -131.01 139.15 49.94 Favored 'General case' 0 CA--C 1.52 -0.185 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.592 -179.803 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 120' ' ' PHE . . . . . 0.626 ' CZ ' ' CE1' ' A' ' 125' ' ' PHE . 54.1 p90 -166.71 159.04 13.57 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.718 179.964 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 51.72 24.28 2.35 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.873 0.368 . . . . 0.0 110.519 179.701 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 73.21 23.02 78.37 Favored Glycine 0 CA--C 1.524 0.613 0 N-CA-C 111.009 -0.836 . . . . 0.0 111.009 179.829 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -131.22 150.41 52.16 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.885 0.374 . . . . 0.0 110.322 -179.893 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 124' ' ' VAL . . . . . 0.541 HG22 ' N ' ' A' ' 125' ' ' PHE . 14.9 p -104.73 160.38 5.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.792 -179.461 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 125' ' ' PHE . . . . . 0.626 ' CE1' ' CZ ' ' A' ' 120' ' ' PHE . 85.8 m-85 -153.4 108.92 3.24 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.413 179.908 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 69.1 m -84.29 142.24 30.37 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.799 -179.984 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -85.85 -167.3 43.29 Favored Glycine 0 CA--C 1.519 0.317 0 N-CA-C 110.536 -1.026 . . . . 0.0 110.536 179.783 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 128' ' ' GLU . . . . . 0.416 ' H ' ' CB ' ' A' ' 139' ' ' SER . 5.3 pt-20 -99.38 134.52 42.14 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-O 120.803 0.335 . . . . 0.0 110.902 -179.676 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 97.3 mt-10 -51.2 138.63 20.12 Favored 'General case' 0 C--N 1.322 -0.599 0 C-N-CA 120.489 -0.485 . . . . 0.0 110.296 179.642 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -160.53 155.03 23.61 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.661 -179.964 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 40.9 tttp -88.19 32.33 0.77 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.987 0.422 . . . . 0.0 110.334 179.867 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 4.9 t -160.57 153.95 22.0 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.531 179.875 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -79.68 -37.35 36.01 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.019 179.854 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -56.63 -54.41 46.35 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.991 -178.948 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 4.9 tp -63.99 -39.17 93.52 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-O 120.654 0.264 . . . . 0.0 110.76 -179.807 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -59.25 -54.44 46.82 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.712 -179.502 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 99.1 mt-10 -57.15 -44.98 83.94 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.714 0.293 . . . . 0.0 110.677 -179.535 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 72.3 mtm -62.78 -41.04 99.07 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.528 -179.75 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 139' ' ' SER . . . . . 0.416 ' CB ' ' H ' ' A' ' 128' ' ' GLU . 20.4 m -60.0 -39.26 85.15 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 120.999 -0.281 . . . . 0.0 110.585 -179.938 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -64.43 -42.29 96.1 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.962 0.41 . . . . 0.0 110.672 -179.842 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -69.49 -27.52 65.28 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.684 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 65.7 mttm -71.63 -49.85 36.17 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.379 179.83 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 143' ' ' VAL . . . . . 0.441 HG13 ' N ' ' A' ' 144' ' ' ALA . 7.5 p -67.56 -41.11 85.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.622 -179.763 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 144' ' ' ALA . . . . . 0.441 ' N ' HG13 ' A' ' 143' ' ' VAL . . . -64.01 -45.97 86.61 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.804 0.335 . . . . 0.0 110.473 -179.986 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 145' ' ' PHE . . . . . . . . . . . . . 70.9 t80 -60.89 -43.98 97.76 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.606 -179.737 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 146' ' ' MET . . . . . . . . . . . . . 48.8 ttp -60.96 -38.78 87.11 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.688 -179.653 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 37.7 t -67.61 -42.27 82.65 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.927 0.394 . . . . 0.0 111.193 -179.996 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 148' ' ' ILE . . . . . . . . . . . . . 93.7 mt -60.85 -29.16 44.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.076 -179.386 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 53.6 mtpt . . . . . 0 C--N 1.324 -0.525 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.139 179.973 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 82' ' ' ALA . . . . . 0.491 ' C ' ' N ' ' A' ' 84' ' ' LYS . . . . . . . . 0 N--CA 1.45 -0.44 0 CA-C-O 121.135 0.493 . . . . 0.0 110.344 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 -46.55 -15.29 0.03 OUTLIER 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.109 179.302 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.491 ' N ' ' C ' ' A' ' 82' ' ' ALA . 99.4 mttt -64.87 -40.63 95.44 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.118 179.342 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 66.3 t30 -66.11 -48.24 71.52 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.549 -0.751 . . . . 0.0 110.803 -179.632 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 6.5 tt -60.21 -42.37 94.98 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.809 -179.33 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.475 HD23 HD11 ' A' ' 90' ' ' ILE . 38.1 mt -55.7 -35.96 66.64 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.118 -179.561 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 88.7 mt-30 -71.59 -36.12 70.75 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.401 179.328 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 81.1 mm-40 -61.11 -48.96 79.25 Favored 'General case' 0 N--CA 1.462 0.146 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.793 -179.041 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.475 HD11 HD23 ' A' ' 87' ' ' LEU . 26.8 pt -66.11 -35.87 76.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.584 179.802 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -59.43 -50.34 74.31 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.518 -179.511 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 87.8 mt-30 -70.65 -43.76 68.52 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.804 179.845 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -60.32 -50.91 71.73 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.67 -179.595 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 -69.35 -2.61 11.33 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.29 179.848 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 1.5 m 62.3 16.67 8.68 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.367 -179.996 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 96' ' ' SER . . . . . 0.468 ' OG ' ' N ' ' A' ' 97' ' ' LEU . 66.7 p -73.08 -124.82 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.25 -179.72 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.468 ' N ' ' OG ' ' A' ' 96' ' ' SER . 89.6 mt -137.62 128.35 26.98 Favored 'General case' 0 CA--C 1.52 -0.197 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.701 -179.831 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.485 ' N ' HD12 ' A' ' 98' ' ' LEU . 11.1 mp -44.77 152.25 0.56 Allowed Pre-proline 0 N--CA 1.452 -0.332 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.714 -179.734 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -64.69 169.7 11.07 Favored 'Trans proline' 0 C--N 1.308 -1.579 0 C-N-CA 122.879 2.386 . . . . 0.0 112.194 -179.917 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 55.5 t80 -145.05 114.53 7.16 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.417 179.236 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 93.2 m-85 -99.33 133.64 43.33 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.306 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -145.5 146.51 31.49 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.405 -179.694 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 88.9 m -126.36 132.19 51.62 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.235 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -117.13 145.23 43.93 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.247 -0.433 . . . . 0.0 109.888 179.651 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 17.6 p -114.42 125.48 53.89 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-O 120.813 0.34 . . . . 0.0 110.605 179.761 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 106' ' ' SER . . . . . 0.464 ' O ' ' O ' ' A' ' 113' ' ' THR . 34.6 p -164.04 160.77 22.09 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.553 179.974 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 130.4 170.57 12.73 Favored Glycine 0 CA--C 1.52 0.372 0 N-CA-C 110.814 -0.915 . . . . 0.0 110.814 179.533 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 27.2 Cg_endo -63.31 149.1 92.16 Favored 'Trans proline' 0 C--N 1.302 -1.877 0 C-N-CA 122.772 2.314 . . . . 0.0 111.905 179.471 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 50.2 m -65.16 -16.32 63.38 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.059 -0.518 . . . . 0.0 110.07 178.965 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 52.6 t-80 -88.96 -41.94 12.08 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.354 179.366 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -126.93 78.82 73.52 Favored Pre-proline 0 N--CA 1.464 0.251 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.557 178.711 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 112' ' ' PRO . . . . . 0.482 ' O ' HG23 ' A' ' 113' ' ' THR . 24.4 Cg_exo -62.43 158.24 41.82 Favored 'Trans proline' 0 C--N 1.301 -1.958 0 C-N-CA 122.723 2.282 . . . . 0.0 112.363 -180.0 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 113' ' ' THR . . . . . 0.482 HG23 ' O ' ' A' ' 112' ' ' PRO . 23.7 p -155.83 150.97 26.6 Favored 'General case' 0 CA--C 1.517 -0.29 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.864 179.719 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -131.59 145.51 51.74 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.304 -179.955 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 99.3 m -126.11 119.72 28.3 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.561 179.338 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 59.8 p -94.23 122.0 36.32 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.351 -179.894 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 117' ' ' THR . . . . . 0.479 HG22 ' N ' ' A' ' 118' ' ' VAL . 91.5 m -105.88 157.03 17.77 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.195 179.808 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 118' ' ' VAL . . . . . 0.479 ' N ' HG22 ' A' ' 117' ' ' THR . 9.9 p -140.45 138.13 36.36 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.459 179.566 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 119' ' ' GLU . . . . . 0.428 ' OE2' ' N ' ' A' ' 123' ' ' LYS . 5.2 tm-20 -124.58 130.84 53.2 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.735 179.73 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 120' ' ' PHE . . . . . 0.622 ' CZ ' ' CE1' ' A' ' 125' ' ' PHE . 49.8 p90 -164.84 156.76 15.62 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.52 179.225 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 53.45 21.23 2.34 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.767 0.318 . . . . 0.0 110.609 179.565 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 76.56 22.32 72.92 Favored Glycine 0 CA--C 1.523 0.534 0 N-CA-C 110.983 -0.847 . . . . 0.0 110.983 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 123' ' ' LYS . . . . . 0.428 ' N ' ' OE2' ' A' ' 119' ' ' GLU . 51.8 mtpt -132.67 151.81 51.86 Favored 'General case' 0 CA--C 1.517 -0.293 0 O-C-N 122.75 -0.265 . . . . 0.0 110.487 179.832 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 124' ' ' VAL . . . . . 0.492 ' O ' HG13 ' A' ' 124' ' ' VAL . 12.7 p -122.13 128.7 75.63 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.159 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.872 -179.669 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 125' ' ' PHE . . . . . 0.622 ' CE1' ' CZ ' ' A' ' 120' ' ' PHE . 22.2 m-85 -116.05 123.27 47.51 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.3 179.707 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 66.1 m -81.99 136.11 35.3 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.486 179.893 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -80.46 -171.37 43.51 Favored Glycine 0 CA--C 1.522 0.485 0 N-CA-C 110.665 -0.974 . . . . 0.0 110.665 179.834 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 128' ' ' GLU . . . . . 0.667 ' H ' ' CB ' ' A' ' 139' ' ' SER . 13.6 tt0 -94.89 130.16 41.6 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-O 120.931 0.396 . . . . 0.0 110.668 179.643 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 129' ' ' GLU . . . . . 0.403 ' H ' ' CD ' ' A' ' 129' ' ' GLU . 56.4 mp0 -56.22 144.18 30.83 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 116.04 -0.527 . . . . 0.0 109.978 179.087 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -172.96 166.78 5.09 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.78 -179.661 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 22.6 pttp -93.3 33.38 1.22 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.567 179.022 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 132' ' ' THR . . . . . 0.436 ' HG1' ' HG2' ' A' ' 134' ' ' LYS . 0.3 OUTLIER -153.66 142.82 21.39 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.512 -179.826 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 58.1 mttp -79.27 -45.03 20.54 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.195 0.522 . . . . 0.0 110.729 179.779 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 134' ' ' LYS . . . . . 0.436 ' HG2' ' HG1' ' A' ' 132' ' ' THR . 16.3 pttp -53.63 -46.5 70.52 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.932 -179.4 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 4.4 tp -66.33 -41.84 89.02 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.677 179.871 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -60.21 -53.07 62.04 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 -179.451 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 96.1 mt-10 -54.19 -40.67 67.78 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 -179.727 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 50.1 mtt -61.34 -42.47 98.74 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.217 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 139' ' ' SER . . . . . 0.667 ' CB ' ' H ' ' A' ' 128' ' ' GLU . 90.9 p -60.09 -38.75 83.86 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.658 -179.316 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -65.54 -44.24 87.47 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.999 0.428 . . . . 0.0 110.818 -179.619 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -69.31 -30.16 68.16 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.719 -179.462 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 57.5 mttp -71.94 -51.15 23.47 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.905 0.383 . . . . 0.0 111.56 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 143' ' ' VAL . . . . . 0.54 HG13 ' N ' ' A' ' 144' ' ' ALA . 11.3 p -66.15 -43.32 92.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.555 -179.207 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 144' ' ' ALA . . . . . 0.54 ' N ' HG13 ' A' ' 143' ' ' VAL . . . -61.67 -46.15 90.96 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.625 -179.584 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 145' ' ' PHE . . . . . . . . . . . . . 64.6 t80 -60.67 -42.27 96.72 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.528 -179.598 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 146' ' ' MET . . . . . . . . . . . . . 59.6 mtt -62.8 -39.16 93.4 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.816 -179.638 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 78.1 p -69.21 -42.1 76.2 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.847 0.356 . . . . 0.0 110.904 -179.709 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 148' ' ' ILE . . . . . . . . . . . . . 87.2 mt -59.05 -29.23 40.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.769 -179.646 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 55.2 mtpt . . . . . 0 C--N 1.325 -0.457 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.669 179.688 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 82' ' ' ALA . . . . . 0.479 ' C ' ' N ' ' A' ' 84' ' ' LYS . . . . . . . . 0 N--CA 1.448 -0.543 0 CA-C-O 121.209 0.528 . . . . 0.0 109.679 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 2.8 m-85 -48.02 -16.58 0.09 Allowed 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.542 -0.754 . . . . 0.0 109.716 179.857 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.479 ' N ' ' C ' ' A' ' 82' ' ' ALA . 60.5 mttp -64.3 -42.73 96.23 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.479 -0.782 . . . . 0.0 109.932 179.916 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 89.5 m-20 -63.57 -45.66 89.43 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.9 -179.376 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 6.0 tt -61.21 -41.57 97.08 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.777 -179.388 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.478 HD23 HD11 ' A' ' 90' ' ' ILE . 56.3 mt -57.92 -38.11 75.28 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.111 -0.495 . . . . 0.0 109.77 179.962 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 87.4 mt-30 -70.22 -35.3 73.79 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.355 179.102 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 96.2 mt-10 -63.41 -48.58 77.22 Favored 'General case' 0 N--CA 1.462 0.161 0 C-N-CA 120.668 -0.413 . . . . 0.0 111.426 -179.022 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.478 HD11 HD23 ' A' ' 87' ' ' LEU . 15.3 pt -62.82 -44.31 99.44 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 116.449 -0.342 . . . . 0.0 110.765 -179.542 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 91' ' ' ALA . . . . . 0.482 ' O ' ' N ' ' A' ' 95' ' ' SER . . . -68.81 -45.48 71.12 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.015 -179.622 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -63.27 -47.7 81.25 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.62 -179.417 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -63.34 -42.52 98.95 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.766 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -92.81 7.56 43.23 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.449 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 95' ' ' SER . . . . . 0.482 ' N ' ' O ' ' A' ' 91' ' ' ALA . 14.2 m 39.49 47.15 1.54 Allowed 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 120.91 0.386 . . . . 0.0 110.641 -179.936 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 60.2 p -100.48 44.7 1.0 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.435 -179.273 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.563 HD12 ' N ' ' A' ' 97' ' ' LEU . 9.9 mp 64.66 93.17 0.06 Allowed 'General case' 0 N--CA 1.461 0.092 0 CA-C-O 121.042 0.449 . . . . 0.0 110.705 -179.445 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.569 ' N ' HD12 ' A' ' 98' ' ' LEU . 10.3 mp -45.59 146.69 1.7 Allowed Pre-proline 0 CA--C 1.532 0.278 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.324 -179.712 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -70.28 145.42 54.09 Favored 'Trans proline' 0 N--CA 1.493 1.452 0 C-N-CA 122.496 2.131 . . . . 0.0 111.863 -179.8 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 84.4 t80 -127.76 131.59 49.63 Favored 'General case' 0 CA--C 1.514 -0.436 0 N-CA-C 108.771 -0.825 . . . . 0.0 108.771 179.972 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 95.7 m-85 -97.52 143.18 28.48 Favored 'General case' 0 C--N 1.324 -0.521 0 C-N-CA 120.741 -0.384 . . . . 0.0 110.474 -179.191 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -143.85 145.28 32.21 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.075 179.681 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 98.6 m -122.57 127.21 49.15 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.514 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -123.24 150.91 42.86 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 110.007 -0.368 . . . . 0.0 110.007 179.785 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 35.1 p -106.85 137.42 44.92 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-O 120.761 0.315 . . . . 0.0 110.23 179.97 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 31.2 m -161.75 163.35 29.65 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.253 179.965 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 118.04 -178.34 16.84 Favored Glycine 0 CA--C 1.527 0.82 0 N-CA-C 111.281 -0.728 . . . . 0.0 111.281 179.535 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 108' ' ' PRO . . . . . 0.637 ' HG2' ' HB3' ' A' ' 111' ' ' ALA . 19.7 Cg_endo -61.4 154.42 59.01 Favored 'Trans proline' 0 N--CA 1.497 1.715 0 C-N-CA 122.702 2.268 . . . . 0.0 112.337 179.964 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 28.3 m -67.68 -18.16 64.83 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.627 -0.715 . . . . 0.0 109.978 179.29 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 94.9 m-70 -91.95 -36.54 13.38 Favored 'General case' 0 CA--C 1.52 -0.179 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.164 179.735 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 111' ' ' ALA . . . . . 0.637 ' HB3' ' HG2' ' A' ' 108' ' ' PRO . . . -124.21 79.77 59.31 Favored Pre-proline 0 CA--C 1.538 0.519 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.077 179.232 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -81.45 121.39 3.81 Favored 'Trans proline' 0 N--CA 1.489 1.24 0 C-N-CA 122.481 2.121 . . . . 0.0 112.194 -179.917 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 4.9 p -109.26 172.8 6.64 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.004 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 -132.2 146.76 52.24 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.167 -179.765 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 88.5 m -131.52 126.95 36.22 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.152 -0.476 . . . . 0.0 109.86 179.138 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 68.2 m -94.4 121.23 35.71 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.367 -179.834 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 117' ' ' THR . . . . . 0.421 ' CG2' ' CG2' ' A' ' 124' ' ' VAL . 98.6 m -108.95 125.33 51.92 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.385 -179.869 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 11.0 p -110.55 139.66 33.12 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.3 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.004 -179.945 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 84.1 tt0 -123.25 130.35 52.63 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.619 179.925 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 120' ' ' PHE . . . . . 0.584 ' CZ ' ' CE1' ' A' ' 125' ' ' PHE . 47.7 p90 -163.72 157.45 19.13 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.533 179.214 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 52.59 21.85 1.98 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.788 0.328 . . . . 0.0 110.86 179.503 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 75.7 21.89 76.0 Favored Glycine 0 CA--C 1.523 0.568 0 N-CA-C 111.185 -0.766 . . . . 0.0 111.185 179.836 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 61.0 mttp -131.66 151.2 51.81 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 120.723 0.297 . . . . 0.0 110.303 179.898 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 124' ' ' VAL . . . . . 0.457 ' O ' HG13 ' A' ' 124' ' ' VAL . 13.6 p -123.03 129.77 74.86 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.27 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.763 -179.572 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 125' ' ' PHE . . . . . 0.584 ' CE1' ' CZ ' ' A' ' 120' ' ' PHE . 18.5 m-85 -117.56 123.34 46.01 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.167 179.979 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 12.3 p -83.66 141.55 31.42 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.594 -179.976 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -86.18 -169.62 46.12 Favored Glycine 0 CA--C 1.523 0.584 0 N-CA-C 110.704 -0.959 . . . . 0.0 110.704 179.847 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 128' ' ' GLU . . . . . 0.626 ' H ' ' CB ' ' A' ' 139' ' ' SER . 5.8 pt-20 -93.86 128.89 40.38 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-O 120.765 0.317 . . . . 0.0 111.056 -179.564 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -55.15 144.14 25.11 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 120.45 -0.5 . . . . 0.0 110.172 179.703 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -170.63 163.67 8.18 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.931 179.837 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 31.0 mtmm -89.71 32.84 0.86 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.366 179.226 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 4.0 t -156.43 149.5 24.16 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.601 179.493 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 58.8 mttp -80.57 -31.8 36.76 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.921 179.708 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 134' ' ' LYS . . . . . 0.496 ' O ' ' SD ' ' A' ' 138' ' ' MET . 25.9 mtpp -59.19 -51.18 71.09 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.038 -178.901 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 11.6 tp -64.76 -39.3 93.4 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-O 120.838 0.351 . . . . 0.0 110.936 -179.654 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -59.36 -54.81 42.48 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.8 -179.351 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 80.6 mm-40 -58.15 -43.61 87.46 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 120.847 -0.341 . . . . 0.0 110.436 -179.382 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 138' ' ' MET . . . . . 0.571 ' N ' ' SD ' ' A' ' 138' ' ' MET . 0.0 OUTLIER -62.02 -41.98 98.67 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.458 -179.979 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 139' ' ' SER . . . . . 0.626 ' CB ' ' H ' ' A' ' 128' ' ' GLU . 77.4 p -65.06 -36.16 83.48 Favored 'General case' 0 C--N 1.329 -0.317 0 C-N-CA 120.922 -0.311 . . . . 0.0 111.022 -179.934 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -65.83 -47.32 75.38 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.047 0.451 . . . . 0.0 110.645 179.94 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -71.7 -24.41 61.81 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.738 -179.907 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -70.62 -49.35 48.53 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.246 179.812 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 143' ' ' VAL . . . . . 0.405 HG13 ' N ' ' A' ' 144' ' ' ALA . 7.1 p -68.37 -38.9 80.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.88 -179.545 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 144' ' ' ALA . . . . . 0.405 ' N ' HG13 ' A' ' 143' ' ' VAL . . . -64.08 -44.95 90.8 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.82 0.343 . . . . 0.0 110.95 -179.612 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 145' ' ' PHE . . . . . . . . . . . . . 64.7 t80 -57.11 -44.21 83.03 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.472 -179.713 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 146' ' ' MET . . . . . . . . . . . . . 63.3 mtt -63.79 -38.98 93.13 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.88 179.907 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 78.0 p -67.91 -44.98 75.68 Favored 'General case' 0 C--N 1.332 -0.189 0 C-N-CA 120.702 -0.399 . . . . 0.0 110.936 -179.752 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 148' ' ' ILE . . . . . . . . . . . . . 82.2 mt -52.1 -39.14 25.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.085 -179.521 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 32.6 mttm . . . . . 0 C--N 1.326 -0.444 0 C-N-CA 120.593 -0.443 . . . . 0.0 110.932 179.424 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 82' ' ' ALA . . . . . 0.477 ' C ' ' N ' ' A' ' 84' ' ' LYS . . . . . . . . 0 N--CA 1.447 -0.576 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 3.9 m-85 -48.56 -15.77 0.09 Allowed 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.515 -0.766 . . . . 0.0 109.575 179.709 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.477 ' N ' ' C ' ' A' ' 82' ' ' ALA . 99.6 mttt -63.02 -39.47 94.84 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.758 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 93.0 m-20 -63.1 -44.84 94.54 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.739 -179.912 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 7.2 tt -71.92 -33.72 68.49 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.667 -179.515 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 17.7 mt -59.63 -41.71 91.07 Favored 'General case' 0 CA--C 1.52 -0.206 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.424 -178.839 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 10.5 pt20 -73.04 -29.43 62.98 Favored 'General case' 0 C--N 1.316 -0.866 0 C-N-CA 120.424 -0.51 . . . . 0.0 110.509 179.191 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 92.2 mt-10 -65.71 -42.87 90.63 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 120.693 -0.403 . . . . 0.0 111.251 -179.809 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 29.2 pt -72.13 -35.26 52.67 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.882 179.698 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -55.68 -49.53 72.7 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.937 -179.215 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 13.5 pt20 -67.96 -38.05 82.29 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.526 179.557 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 64.1 tttp -62.66 -47.72 82.46 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.384 -179.894 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 72.2 mm-40 -76.39 -2.83 33.77 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.494 -179.755 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 74.64 4.62 4.41 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.08 -0.509 . . . . 0.0 109.916 -179.724 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 18.9 m -74.17 162.71 28.68 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.287 179.89 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.559 ' N ' HD12 ' A' ' 97' ' ' LEU . 10.5 mp -73.16 132.57 43.4 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.952 0.406 . . . . 0.0 110.052 -179.73 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.546 ' N ' HD12 ' A' ' 98' ' ' LEU . 10.6 mp -45.63 149.21 1.12 Allowed Pre-proline 0 CA--C 1.534 0.336 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.68 -179.618 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -72.55 143.52 38.44 Favored 'Trans proline' 0 N--CA 1.49 1.315 0 C-N-CA 122.681 2.254 . . . . 0.0 111.59 179.881 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 87.7 t80 -127.57 130.47 49.13 Favored 'General case' 0 CA--C 1.511 -0.545 0 N-CA-C 108.542 -0.911 . . . . 0.0 108.542 179.956 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 76.3 m-85 -100.15 147.32 25.82 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 110.012 -0.366 . . . . 0.0 110.012 -179.092 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -146.17 146.89 31.0 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.379 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 99.8 m -121.57 128.14 51.68 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.368 179.732 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -116.27 144.13 44.62 Favored 'General case' 0 N--CA 1.467 0.389 0 N-CA-C 109.93 -0.396 . . . . 0.0 109.93 179.737 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 30.2 p -106.75 134.85 49.27 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 109.97 -0.382 . . . . 0.0 109.97 179.775 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 41.0 t -164.42 162.12 21.88 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.148 179.926 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 122.7 -177.87 16.45 Favored Glycine 0 CA--C 1.528 0.876 0 N-CA-C 111.268 -0.733 . . . . 0.0 111.268 179.459 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 108' ' ' PRO . . . . . 0.598 ' HG2' ' HB3' ' A' ' 111' ' ' ALA . 23.4 Cg_endo -61.3 150.33 85.29 Favored 'Trans proline' 0 N--CA 1.497 1.718 0 C-N-CA 122.789 2.326 . . . . 0.0 112.317 179.902 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 36.9 t -63.99 -18.24 64.1 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.702 -0.681 . . . . 0.0 109.794 179.076 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 73.9 m80 -91.27 -38.19 12.82 Favored 'General case' 0 CA--C 1.518 -0.263 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.285 179.804 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 111' ' ' ALA . . . . . 0.598 ' HB3' ' HG2' ' A' ' 108' ' ' PRO . . . -123.96 79.61 57.73 Favored Pre-proline 0 CA--C 1.538 0.508 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.185 179.463 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -80.8 122.07 4.28 Favored 'Trans proline' 0 N--CA 1.491 1.338 0 C-N-CA 122.619 2.213 . . . . 0.0 112.15 179.68 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 3.5 p -109.12 171.26 7.54 Favored 'General case' 0 CA--C 1.517 -0.307 0 CA-C-N 115.646 -0.706 . . . . 0.0 109.978 -179.961 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -133.89 148.56 51.25 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.182 -179.702 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 94.8 m -129.73 126.61 38.64 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.104 179.398 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 11.2 t -96.39 121.47 38.23 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.276 179.829 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 117' ' ' THR . . . . . 0.439 ' CG2' ' CG2' ' A' ' 124' ' ' VAL . 70.8 m -112.86 130.35 56.13 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.017 -179.913 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 7.7 p -113.73 141.8 28.48 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.357 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.03 -179.748 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 79.0 tt0 -125.14 131.86 53.18 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.49 -179.764 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 120' ' ' PHE . . . . . 0.625 ' CZ ' ' CE1' ' A' ' 125' ' ' PHE . 48.4 p90 -166.63 159.51 14.18 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.435 179.372 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 53.32 19.05 1.44 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.8 0.333 . . . . 0.0 110.904 179.711 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 78.24 20.0 73.32 Favored Glycine 0 CA--C 1.525 0.687 0 N-CA-C 111.323 -0.711 . . . . 0.0 111.323 179.617 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -132.13 152.91 50.99 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.806 0.336 . . . . 0.0 110.408 179.872 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 124' ' ' VAL . . . . . 0.482 ' O ' HG13 ' A' ' 124' ' ' VAL . 14.9 p -121.38 127.88 75.8 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.288 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.713 -179.904 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 125' ' ' PHE . . . . . 0.625 ' CE1' ' CZ ' ' A' ' 120' ' ' PHE . 36.8 m-85 -111.38 120.55 42.58 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.346 179.911 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 5.7 m -78.8 129.24 34.39 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.283 179.707 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -84.05 -173.25 49.66 Favored Glycine 0 CA--C 1.521 0.444 0 N-CA-C 111.139 -0.785 . . . . 0.0 111.139 -179.938 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 128' ' ' GLU . . . . . 0.446 ' CG ' ' N ' ' A' ' 129' ' ' GLU . 69.1 tt0 -77.75 165.89 23.64 Favored 'General case' 0 N--CA 1.442 -0.842 0 CA-C-O 120.671 0.272 . . . . 0.0 110.443 179.894 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 129' ' ' GLU . . . . . 0.446 ' N ' ' CG ' ' A' ' 128' ' ' GLU . 18.7 pt-20 -105.94 140.7 38.55 Favored 'General case' 0 C--N 1.332 -0.168 0 N-CA-C 109.879 -0.415 . . . . 0.0 109.879 179.106 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -171.57 166.48 6.75 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.86 179.596 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -86.12 35.36 0.64 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.041 179.065 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 4.3 t -152.47 144.77 23.97 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.844 179.772 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -82.54 -21.95 35.17 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.965 179.44 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 56.3 mtpt -68.79 -54.49 15.56 Favored 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 120.632 -0.427 . . . . 0.0 111.208 -179.278 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 3.6 tp -64.02 -38.9 92.77 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.959 -179.504 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -58.91 -54.64 44.83 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.67 -179.527 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 81.0 mm-40 -60.07 -43.03 95.75 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.866 0.365 . . . . 0.0 110.766 -179.777 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 60.3 mtt -61.77 -41.88 98.27 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.319 -179.509 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 37.8 m -65.07 -36.61 84.87 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.014 179.775 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -63.32 -46.37 86.95 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 121.046 0.45 . . . . 0.0 110.524 -179.962 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -70.21 -24.25 63.08 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.686 179.849 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 38.7 ttmt -70.76 -49.94 41.36 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.29 -0.413 . . . . 0.0 111.276 179.711 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 143' ' ' VAL . . . . . 0.407 HG13 ' N ' ' A' ' 144' ' ' ALA . 7.1 p -67.98 -40.9 84.07 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.151 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.019 -179.501 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 144' ' ' ALA . . . . . 0.407 ' N ' HG13 ' A' ' 143' ' ' VAL . . . -62.29 -45.79 91.67 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.935 0.398 . . . . 0.0 110.526 -179.997 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 145' ' ' PHE . . . . . . . . . . . . . 69.8 t80 -59.19 -44.33 92.21 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.564 -179.656 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 146' ' ' MET . . . . . . . . . . . . . 64.1 ttp -61.68 -39.1 90.22 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.965 -179.711 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 11.7 t -67.34 -44.33 79.34 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 120.743 -0.383 . . . . 0.0 110.873 179.844 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 148' ' ' ILE . . . . . . . . . . . . . 94.2 mt -57.72 -29.57 35.23 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.204 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.994 -179.642 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 25.8 mtpp . . . . . 0 C--N 1.327 -0.413 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.51 179.87 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 82' ' ' ALA . . . . . 0.485 ' O ' ' N ' ' A' ' 84' ' ' LYS . . . . . . . . 0 N--CA 1.455 -0.209 0 CA-C-O 120.775 0.322 . . . . 0.0 110.528 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 2.1 m-85 -46.05 -15.89 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.27 179.709 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.485 ' N ' ' O ' ' A' ' 82' ' ' ALA . 99.4 mttt -64.79 -40.75 95.76 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.447 179.266 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 38.8 t30 -64.92 -44.69 88.71 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.63 -179.91 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 5.3 tt -60.03 -43.36 95.34 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.588 -179.304 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.432 HD23 HD11 ' A' ' 90' ' ' ILE . 74.0 mt -56.25 -37.74 70.19 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.402 179.976 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 88.4 mt-30 -70.8 -35.26 72.46 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.578 179.651 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 79.9 mm-40 -62.27 -48.43 79.93 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.807 -179.169 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.435 HG13 ' N ' ' A' ' 91' ' ' ALA . 19.9 pt -65.13 -41.34 91.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.655 -179.52 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 91' ' ' ALA . . . . . 0.519 ' O ' ' N ' ' A' ' 95' ' ' SER . . . -68.85 -49.9 54.45 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.852 -179.464 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 84.4 mt-30 -65.01 -45.68 84.5 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.865 -179.604 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 88.9 tttt -60.02 -47.35 86.19 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.562 -179.77 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 94' ' ' GLU . . . . . 0.408 ' O ' ' C ' ' A' ' 95' ' ' SER . 96.4 mt-10 -96.03 10.15 38.43 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.544 -179.928 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 95' ' ' SER . . . . . 0.519 ' N ' ' O ' ' A' ' 91' ' ' ALA . 13.9 t 39.24 40.84 0.56 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.47 -179.754 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 96' ' ' SER . . . . . 0.44 ' O ' ' CB ' ' A' ' 97' ' ' LEU . 44.7 m -87.47 33.26 0.69 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.653 -179.436 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.44 ' CB ' ' O ' ' A' ' 96' ' ' SER . 2.6 tp 76.93 100.58 0.07 Allowed 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.866 179.907 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.509 ' N ' HD12 ' A' ' 98' ' ' LEU . 11.0 mp -44.21 152.02 0.51 Allowed Pre-proline 0 C--N 1.325 -0.474 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.431 179.817 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_endo -65.86 171.16 10.28 Favored 'Trans proline' 0 C--N 1.304 -1.77 0 C-N-CA 122.951 2.434 . . . . 0.0 111.998 179.611 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 31.8 t80 -144.62 117.2 8.62 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.7 179.6 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 93.4 m-85 -96.95 129.03 44.47 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.505 -179.929 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -147.68 148.16 30.74 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.478 -179.781 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 1.5 t -135.26 145.21 47.36 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.63 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -129.39 153.93 47.42 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.521 -179.925 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 16.2 p -110.28 138.43 46.67 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.576 179.631 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 40.3 t -163.5 153.62 15.48 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.664 179.804 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 125.65 -175.94 17.41 Favored Glycine 0 CA--C 1.524 0.612 0 N-CA-C 111.039 -0.824 . . . . 0.0 111.039 179.643 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 25.9 Cg_endo -62.45 150.46 87.32 Favored 'Trans proline' 0 C--N 1.303 -1.824 0 C-N-CA 122.785 2.323 . . . . 0.0 112.278 -179.883 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 37.1 t -65.05 -16.09 63.07 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.36 179.038 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 49.6 t-80 -90.51 -43.43 10.24 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.472 179.646 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -126.21 77.2 72.12 Favored Pre-proline 0 CA--C 1.53 0.178 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.21 179.213 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -80.62 126.52 6.02 Favored 'Trans proline' 0 C--N 1.303 -1.847 0 C-N-CA 122.611 2.208 . . . . 0.0 112.261 -179.588 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 5.6 p -103.97 170.89 7.65 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.362 179.609 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -133.46 146.71 51.4 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.589 -179.665 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 86.9 m -127.82 122.42 32.63 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.434 179.733 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 25.4 m -96.06 122.55 39.0 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.013 0.435 . . . . 0.0 110.556 -179.758 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 57.5 m -112.29 128.13 56.18 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.514 -179.894 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 8.6 p -110.42 140.82 27.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.506 179.928 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -127.27 136.78 52.45 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.566 179.99 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 120' ' ' PHE . . . . . 0.619 ' CZ ' ' CE1' ' A' ' 125' ' ' PHE . 50.7 p90 -170.15 160.2 7.86 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.385 179.85 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 51.56 21.38 1.27 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.511 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 77.08 21.22 74.25 Favored Glycine 0 CA--C 1.522 0.503 0 N-CA-C 111.098 -0.801 . . . . 0.0 111.098 179.732 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -131.99 151.59 51.64 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.786 0.327 . . . . 0.0 110.614 179.909 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 124' ' ' VAL . . . . . 0.447 ' O ' HG13 ' A' ' 124' ' ' VAL . 8.5 p -121.38 127.84 75.79 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-O 120.965 0.412 . . . . 0.0 110.842 -179.65 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 125' ' ' PHE . . . . . 0.619 ' CE1' ' CZ ' ' A' ' 120' ' ' PHE . 26.4 m-85 -112.63 120.48 41.69 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.367 179.56 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 43.5 t -80.09 132.16 35.9 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.707 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -80.26 -172.42 44.68 Favored Glycine 0 CA--C 1.525 0.688 0 N-CA-C 110.77 -0.932 . . . . 0.0 110.77 179.808 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 128' ' ' GLU . . . . . 0.42 ' O ' ' CG ' ' A' ' 128' ' ' GLU . 8.9 pt-20 -96.46 131.69 42.78 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.612 0.244 . . . . 0.0 110.475 -179.833 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -54.06 142.09 26.38 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.373 179.541 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -165.43 157.9 15.46 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.559 179.993 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 51.0 tttm -86.65 33.56 0.64 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.597 179.704 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 4.8 t -159.64 152.19 21.3 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.509 -179.712 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -81.84 -33.56 30.6 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.001 0.429 . . . . 0.0 110.978 179.896 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -58.28 -54.25 49.16 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.892 -178.978 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 4.0 tp -65.08 -38.75 91.78 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.66 179.938 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -57.7 -55.03 40.2 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.833 -179.358 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -60.84 -41.59 96.09 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.434 -179.752 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 78.9 mmm -62.61 -41.39 98.95 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.552 -179.472 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 20.2 m -64.4 -38.46 91.1 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.632 -179.946 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -64.73 -43.77 92.33 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.595 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -72.21 -24.99 61.48 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.456 179.671 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 63.0 tttp -70.31 -47.16 62.41 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.046 -179.935 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 7.7 p -70.55 -37.34 69.58 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.83 -179.542 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -64.06 -46.3 84.96 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.662 -179.857 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 145' ' ' PHE . . . . . . . . . . . . . 66.0 t80 -58.33 -43.44 88.25 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.553 -179.734 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 146' ' ' MET . . . . . . . . . . . . . 59.2 ttp -61.06 -37.41 82.54 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.577 -179.536 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 35.8 t -70.55 -45.59 65.17 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.955 -179.86 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 148' ' ' ILE . . . . . . . . . . . . . 93.9 mt -55.01 -31.52 25.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.617 -179.459 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 10.2 mtpm? . . . . . 0 C--N 1.327 -0.412 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.671 179.752 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 82' ' ' ALA . . . . . 0.486 ' O ' ' N ' ' A' ' 84' ' ' LYS . . . . . . . . 0 N--CA 1.451 -0.404 0 CA-C-O 121.06 0.457 . . . . 0.0 110.318 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 2.1 m-85 -46.13 -15.87 0.03 OUTLIER 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.172 179.728 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.486 ' N ' ' O ' ' A' ' 82' ' ' ALA . 65.0 mttp -63.67 -40.26 96.39 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.169 179.509 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 63.6 t30 -65.95 -48.78 70.19 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.777 -179.467 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 6.4 tt -60.8 -40.98 94.68 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.791 -179.5 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.496 HD23 HD11 ' A' ' 90' ' ' ILE . 34.3 mt -56.11 -36.8 68.6 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.295 -179.591 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 89.4 mt-30 -69.81 -35.69 75.04 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.57 179.432 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 14.6 mm-40 -61.71 -49.7 75.41 Favored 'General case' 0 C--N 1.333 -0.11 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.107 -178.836 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.496 HD11 HD23 ' A' ' 87' ' ' LEU . 28.6 pt -65.02 -34.46 70.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.633 179.916 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -54.61 -50.44 68.05 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.529 -179.335 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 78.7 mt-30 -65.32 -42.32 93.09 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.851 -179.944 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 69.2 mmtt -61.35 -47.42 85.97 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.549 -179.512 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 80.9 mm-40 -68.15 -20.16 64.86 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.419 179.943 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 1.2 t 72.76 19.67 3.88 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.596 -179.825 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 75.3 m -80.43 -117.4 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.242 -179.898 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 40.9 tp -143.27 125.27 15.26 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.652 179.691 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.607 ' N ' HD12 ' A' ' 98' ' ' LEU . 9.9 mp -44.36 142.65 2.24 Favored Pre-proline 0 N--CA 1.452 -0.359 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.871 -179.812 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_endo -69.63 145.42 57.84 Favored 'Trans proline' 0 C--N 1.311 -1.442 0 C-N-CA 122.524 2.149 . . . . 0.0 112.008 -179.781 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 92.6 t80 -127.2 128.73 46.57 Favored 'General case' 0 C--O 1.235 0.321 0 N-CA-C 109.544 -0.539 . . . . 0.0 109.544 179.643 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 85.6 m-85 -96.23 144.48 26.39 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.939 -179.596 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -143.74 145.4 32.37 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.439 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 98.0 m -122.83 127.67 49.37 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.466 -179.913 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -105.5 135.22 47.28 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.174 179.78 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 18.8 p -114.42 119.29 36.38 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-O 120.876 0.369 . . . . 0.0 110.414 179.592 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 11.4 p -160.66 163.96 32.11 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.403 179.934 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 122.24 168.78 13.34 Favored Glycine 0 CA--C 1.523 0.536 0 N-CA-C 110.888 -0.885 . . . . 0.0 110.888 179.659 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 24.9 Cg_endo -62.43 151.02 85.26 Favored 'Trans proline' 0 C--N 1.301 -1.928 0 C-N-CA 122.78 2.32 . . . . 0.0 112.143 179.63 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 77.7 p -63.99 -17.58 63.44 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.327 179.002 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 66.0 m80 -90.42 -43.14 10.49 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.501 179.628 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -125.04 78.02 66.58 Favored Pre-proline 0 N--CA 1.464 0.243 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.357 179.637 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 112' ' ' PRO . . . . . 0.493 ' O ' HG23 ' A' ' 113' ' ' THR . 56.8 Cg_endo -76.28 164.44 31.01 Favored 'Trans proline' 0 C--N 1.303 -1.866 0 C-N-CA 122.711 2.274 . . . . 0.0 112.279 -179.995 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 113' ' ' THR . . . . . 0.493 HG23 ' O ' ' A' ' 112' ' ' PRO . 33.8 p -156.83 152.01 26.33 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.641 179.555 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -131.68 144.14 50.79 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.335 -179.628 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 93.0 m -130.33 125.73 35.42 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.46 179.438 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 46.1 t -97.19 122.91 40.74 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.612 -179.827 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 117' ' ' THR . . . . . 0.408 ' CG2' ' CG2' ' A' ' 124' ' ' VAL . 54.3 m -114.81 131.45 56.81 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.357 -179.834 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 9.9 p -111.75 141.83 26.01 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.285 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.267 -179.949 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 79.3 tt0 -125.79 133.77 51.92 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.623 -179.672 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 120' ' ' PHE . . . . . 0.627 ' CZ ' ' CE1' ' A' ' 125' ' ' PHE . 45.9 p90 -166.53 157.56 12.68 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.368 179.466 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 52.61 24.86 3.33 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.518 179.719 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 72.64 22.82 78.78 Favored Glycine 0 CA--C 1.521 0.466 0 N-CA-C 111.083 -0.807 . . . . 0.0 111.083 179.913 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 62.9 mttp -131.66 151.66 51.45 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.807 0.337 . . . . 0.0 110.331 179.826 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 124' ' ' VAL . . . . . 0.464 ' O ' HG13 ' A' ' 124' ' ' VAL . 12.2 p -122.21 128.47 75.53 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.227 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.768 -179.7 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 125' ' ' PHE . . . . . 0.627 ' CE1' ' CZ ' ' A' ' 120' ' ' PHE . 27.0 m-85 -112.93 123.35 50.12 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.434 179.919 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 4.2 p -79.37 126.76 31.23 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.195 179.843 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -82.65 -172.53 48.32 Favored Glycine 0 CA--C 1.525 0.676 0 N-CA-C 110.97 -0.852 . . . . 0.0 110.97 -179.664 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 128' ' ' GLU . . . . . 0.459 ' CG ' ' N ' ' A' ' 129' ' ' GLU . 67.5 tt0 -78.7 167.09 21.73 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-O 120.759 0.314 . . . . 0.0 110.491 179.972 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 129' ' ' GLU . . . . . 0.459 ' N ' ' CG ' ' A' ' 128' ' ' GLU . 3.0 pp20? -109.61 145.31 36.64 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.979 0.419 . . . . 0.0 110.343 178.952 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -174.19 170.41 3.72 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.617 179.663 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -86.28 36.13 0.68 Allowed 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.238 178.849 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 5.1 t -156.41 148.66 23.33 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.893 0.378 . . . . 0.0 110.538 -179.637 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -82.54 -33.14 28.28 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.103 179.591 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 69.5 mmtt -58.82 -52.66 64.76 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.01 -178.213 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 10.3 tp -63.78 -39.76 95.03 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.466 -0.333 . . . . 0.0 110.973 -179.531 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -60.31 -54.78 41.57 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.53 -179.142 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -59.19 -44.43 92.19 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.708 -179.456 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 38.3 ttm -60.63 -41.8 95.64 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.478 -179.775 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 139' ' ' SER . . . . . 0.413 ' CB ' ' H ' ' A' ' 128' ' ' GLU . 38.1 m -65.04 -35.17 80.3 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.754 179.763 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -62.7 -45.57 92.14 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.759 -179.733 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -72.41 -23.12 61.04 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.667 -179.771 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -71.6 -50.15 33.64 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.327 179.876 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 143' ' ' VAL . . . . . 0.443 HG13 ' N ' ' A' ' 144' ' ' ALA . 6.9 p -66.67 -41.01 87.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.696 -179.508 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 144' ' ' ALA . . . . . 0.443 ' N ' HG13 ' A' ' 143' ' ' VAL . . . -61.43 -43.56 98.65 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.479 -179.936 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 145' ' ' PHE . . . . . . . . . . . . . 65.4 t80 -60.2 -41.87 93.91 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.4 -179.832 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 146' ' ' MET . . . . . . . . . . . . . 89.9 mmm -63.85 -39.92 95.36 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.018 -179.349 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 9.1 t -67.48 -44.94 77.32 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.077 179.916 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 148' ' ' ILE . . . . . . . . . . . . . 78.7 mt -54.08 -33.5 24.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.582 -179.26 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 55.5 mtpt . . . . . 0 C--N 1.325 -0.491 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.532 -179.908 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 82' ' ' ALA . . . . . 0.481 ' O ' ' N ' ' A' ' 84' ' ' LYS . . . . . . . . 0 N--CA 1.451 -0.403 0 CA-C-O 121.079 0.466 . . . . 0.0 110.059 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -46.49 -16.36 0.03 OUTLIER 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.08 179.609 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.481 ' N ' ' O ' ' A' ' 82' ' ' ALA . 99.4 mttt -63.97 -41.96 97.4 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.314 179.328 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 35.9 t30 -64.79 -43.67 92.44 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.357 -179.523 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 2.6 tp -60.95 -43.36 98.81 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.6 -179.241 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 74.4 mt -55.83 -35.85 66.85 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.309 -179.767 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 88.6 mt-30 -71.01 -34.58 71.48 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.546 179.64 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -62.36 -48.08 81.34 Favored 'General case' 0 C--N 1.334 -0.08 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.044 -179.013 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 22.1 pt -65.2 -35.71 76.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.691 -179.996 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -59.17 -50.66 73.2 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.559 -179.648 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 56.0 tt0 -65.3 -44.93 86.34 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.859 -179.668 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -63.34 -47.58 81.59 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.702 -179.808 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 94' ' ' GLU . . . . . 0.445 ' O ' ' CB ' ' A' ' 95' ' ' SER . 16.0 mm-40 -72.64 -16.38 61.71 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.292 -179.832 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 95' ' ' SER . . . . . 0.445 ' CB ' ' O ' ' A' ' 94' ' ' GLU . 0.7 OUTLIER 79.69 11.36 1.27 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.516 -179.91 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 9.7 p -80.89 165.28 21.96 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.458 -179.911 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 57.5 tp -67.39 126.11 28.26 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.647 -179.974 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.574 ' N ' HD12 ' A' ' 98' ' ' LEU . 10.5 mp -46.4 148.37 1.66 Allowed Pre-proline 0 N--CA 1.45 -0.43 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.75 179.887 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -70.63 143.96 48.09 Favored 'Trans proline' 0 C--N 1.31 -1.474 0 C-N-CA 122.764 2.31 . . . . 0.0 111.996 179.63 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 91.5 t80 -129.97 131.37 45.9 Favored 'General case' 0 C--O 1.234 0.261 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 179.57 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 79.5 m-85 -98.72 146.17 26.16 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.823 -179.444 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -144.18 145.7 32.26 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.503 -179.883 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 94.4 m -123.97 129.76 51.47 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.423 -179.939 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -113.23 141.05 47.43 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.147 179.933 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 13.4 p -115.15 120.79 40.95 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-O 120.874 0.368 . . . . 0.0 110.627 179.452 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 35.6 p -159.02 164.67 35.3 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.425 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 122.8 164.97 12.27 Favored Glycine 0 CA--C 1.522 0.473 0 N-CA-C 110.834 -0.906 . . . . 0.0 110.834 179.721 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 20.4 Cg_endo -60.9 151.46 77.53 Favored 'Trans proline' 0 C--N 1.3 -1.98 0 C-N-CA 122.854 2.369 . . . . 0.0 112.16 179.344 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 91.2 p -63.68 -18.41 63.96 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.186 179.326 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 99.2 m-70 -89.9 -43.25 10.73 Favored 'General case' 0 CA--C 1.519 -0.234 0 CA-C-O 120.889 0.376 . . . . 0.0 110.538 179.409 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -124.2 77.75 60.31 Favored Pre-proline 0 CA--C 1.532 0.267 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.378 179.445 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 112' ' ' PRO . . . . . 0.513 ' O ' HG23 ' A' ' 113' ' ' THR . 59.7 Cg_endo -75.41 162.73 35.63 Favored 'Trans proline' 0 C--N 1.305 -1.743 0 C-N-CA 122.572 2.181 . . . . 0.0 112.295 179.836 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 113' ' ' THR . . . . . 0.513 HG23 ' O ' ' A' ' 112' ' ' PRO . 25.4 p -157.51 153.63 27.33 Favored 'General case' 0 CA--C 1.515 -0.378 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.629 179.488 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -130.75 143.14 50.53 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.287 -179.877 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 97.5 m -130.5 126.17 36.19 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.575 179.454 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 29.1 t -97.5 123.19 41.28 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.408 -179.922 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 117' ' ' THR . . . . . 0.427 ' CG2' ' CG2' ' A' ' 124' ' ' VAL . 51.7 m -112.97 129.14 56.59 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.196 -179.805 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 9.4 p -111.87 142.02 25.55 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.305 179.993 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 81.6 tt0 -124.64 132.71 53.4 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.767 179.908 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 120' ' ' PHE . . . . . 0.635 ' CZ ' ' CE1' ' A' ' 125' ' ' PHE . 48.3 p90 -167.3 158.57 11.92 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.51 179.168 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 54.12 21.47 3.02 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.605 179.685 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 75.52 21.88 76.43 Favored Glycine 0 CA--C 1.522 0.481 0 N-CA-C 111.075 -0.81 . . . . 0.0 111.075 -179.947 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -132.73 153.0 51.61 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.652 0.263 . . . . 0.0 110.575 179.872 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 124' ' ' VAL . . . . . 0.499 ' O ' HG13 ' A' ' 124' ' ' VAL . 14.2 p -121.4 126.81 75.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-O 120.91 0.386 . . . . 0.0 110.558 -179.826 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 125' ' ' PHE . . . . . 0.635 ' CE1' ' CZ ' ' A' ' 120' ' ' PHE . 41.9 m-85 -111.44 121.3 44.84 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.314 179.646 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 5.9 p -83.26 137.78 33.86 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.416 180.0 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -86.15 -169.07 45.54 Favored Glycine 0 CA--C 1.521 0.454 0 N-CA-C 110.654 -0.978 . . . . 0.0 110.654 179.826 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -97.88 132.88 43.07 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-O 120.653 0.263 . . . . 0.0 110.788 -179.91 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 98.4 mt-10 -56.55 146.98 23.32 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 120.924 0.392 . . . . 0.0 110.416 179.221 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -169.77 161.75 9.29 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.652 -179.962 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 77.5 tttt -88.84 33.03 0.78 Allowed 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.173 0.511 . . . . 0.0 110.311 179.532 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 2.5 t -159.28 150.6 20.12 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.789 -179.683 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -81.06 -32.83 33.83 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.933 179.758 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 134' ' ' LYS . . . . . 0.423 ' N ' ' CD ' ' A' ' 134' ' ' LYS . 4.5 mptp? -58.5 -51.87 68.03 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.644 -178.628 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 3.5 tp -65.8 -39.72 91.19 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-O 120.845 0.355 . . . . 0.0 110.824 179.916 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -57.79 -55.17 38.3 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.572 -179.157 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -59.24 -43.35 92.4 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.398 -179.433 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 47.8 ttp -61.4 -44.66 96.77 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.443 -179.573 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 18.1 m -62.08 -39.97 94.23 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.748 -179.854 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -62.88 -46.44 87.84 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.702 -179.946 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -71.88 -23.72 61.55 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.547 179.895 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 64.4 tttp -70.54 -48.73 54.02 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.261 179.78 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 143' ' ' VAL . . . . . 0.402 HG13 ' N ' ' A' ' 144' ' ' ALA . 7.6 p -69.16 -37.97 77.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.69 -179.542 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 144' ' ' ALA . . . . . 0.402 ' N ' HG13 ' A' ' 143' ' ' VAL . . . -63.19 -45.86 89.76 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.642 -179.622 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 145' ' ' PHE . . . . . . . . . . . . . 60.7 t80 -60.24 -43.01 96.45 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.566 -179.326 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 146' ' ' MET . . . . . . . . . . . . . 62.7 ttp -61.63 -39.63 91.97 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.95 -179.73 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 33.1 t -67.04 -43.6 82.36 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.901 -179.999 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 148' ' ' ILE . . . . . . . . . . . . . 89.6 mt -57.28 -31.82 39.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.695 -179.411 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 53.9 mtpt . . . . . 0 C--N 1.327 -0.395 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.819 179.864 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 82' ' ' ALA . . . . . 0.476 ' C ' ' N ' ' A' ' 84' ' ' LYS . . . . . . . . 0 N--CA 1.449 -0.51 0 CA-C-O 121.082 0.468 . . . . 0.0 110.274 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -47.01 -16.38 0.04 OUTLIER 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.914 -0.585 . . . . 0.0 109.804 179.603 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.476 ' N ' ' C ' ' A' ' 82' ' ' ALA . 69.1 mttm -63.73 -42.51 97.89 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.686 -0.688 . . . . 0.0 109.993 179.86 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 89.5 m-20 -63.12 -44.49 95.49 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.525 -179.748 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 6.2 tt -63.71 -40.95 98.04 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.832 -179.879 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.44 HD23 HD11 ' A' ' 90' ' ' ILE . 39.4 mt -56.79 -36.19 69.57 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.092 -179.703 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 88.3 mt-30 -71.63 -31.36 66.78 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.59 179.672 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -66.07 -47.26 74.89 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.301 -179.386 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.44 HD11 HD23 ' A' ' 87' ' ' LEU . 30.4 pt -66.88 -34.96 73.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-O 120.929 0.395 . . . . 0.0 110.463 179.957 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -58.32 -49.89 75.58 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.706 -179.416 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 89.0 mt-30 -65.67 -44.24 86.87 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.754 179.809 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 64.4 tttp -62.28 -47.94 82.12 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.621 -179.745 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 98.1 mt-10 -74.92 -2.91 29.09 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.508 179.995 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 2.7 t 67.79 6.31 5.0 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.603 -179.996 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 7.6 p -75.03 160.72 30.18 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.261 -179.873 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 51.7 tp -67.15 129.8 41.05 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.879 -179.521 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 10.3 mp -45.47 155.01 0.48 Allowed Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.2 179.258 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -65.1 171.65 8.61 Favored 'Trans proline' 0 C--N 1.307 -1.637 0 C-N-CA 122.826 2.351 . . . . 0.0 111.737 179.621 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 29.0 t80 -144.27 122.57 12.29 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.124 179.191 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 -103.59 132.96 49.39 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.416 -179.682 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -144.07 145.1 31.95 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.328 179.883 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 97.7 m -126.2 133.53 51.5 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.656 -179.672 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -124.28 149.08 46.91 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.339 179.925 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 20.3 p -108.06 135.4 49.48 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-O 120.864 0.364 . . . . 0.0 110.706 179.814 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 26.5 m -162.73 161.71 26.46 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.499 179.905 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 119.3 179.19 16.68 Favored Glycine 0 CA--C 1.522 0.479 0 N-CA-C 110.668 -0.973 . . . . 0.0 110.668 179.884 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 108' ' ' PRO . . . . . 0.667 ' HG2' ' HB3' ' A' ' 111' ' ' ALA . 28.6 Cg_endo -60.91 151.51 77.2 Favored 'Trans proline' 0 C--N 1.302 -1.91 0 C-N-CA 122.87 2.38 . . . . 0.0 112.392 -179.664 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 37.5 t -63.56 -18.86 64.31 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.172 179.433 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 52.3 t-80 -90.31 -37.0 14.35 Favored 'General case' 0 CA--C 1.519 -0.243 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.118 179.55 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 111' ' ' ALA . . . . . 0.667 ' HB3' ' HG2' ' A' ' 108' ' ' PRO . . . -124.35 81.14 59.06 Favored Pre-proline 0 N--CA 1.465 0.32 0 CA-C-O 121.124 0.488 . . . . 0.0 110.11 179.427 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -84.33 117.32 2.12 Favored 'Trans proline' 0 C--N 1.303 -1.855 0 C-N-CA 122.55 2.167 . . . . 0.0 112.487 -179.215 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 48.2 p -105.37 170.06 8.1 Favored 'General case' 0 CA--C 1.517 -0.326 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.197 179.741 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -130.57 142.27 50.46 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.396 -179.842 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 86.3 m -121.0 119.1 31.56 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.285 179.68 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 21.5 m -97.9 122.12 40.64 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.122 -179.988 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 62.2 m -112.9 132.16 55.43 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.347 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 10.9 p -112.67 138.9 40.22 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.261 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.197 -179.87 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 84.0 tt0 -125.28 134.01 52.43 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.81 -179.714 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 120' ' ' PHE . . . . . 0.605 ' CZ ' ' CE1' ' A' ' 125' ' ' PHE . 48.7 p90 -166.61 158.73 13.52 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.615 179.442 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 52.73 23.01 2.5 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.828 0.347 . . . . 0.0 110.467 179.843 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 74.98 22.27 77.06 Favored Glycine 0 CA--C 1.521 0.44 0 N-CA-C 111.118 -0.793 . . . . 0.0 111.118 179.786 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 63.5 mttp -132.3 152.6 51.31 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 110.355 -0.239 . . . . 0.0 110.355 -179.892 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 124' ' ' VAL . . . . . 0.482 ' O ' HG13 ' A' ' 124' ' ' VAL . 7.2 p -118.99 124.61 73.47 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.23 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.69 -179.994 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 125' ' ' PHE . . . . . 0.605 ' CE1' ' CZ ' ' A' ' 120' ' ' PHE . 50.5 m-85 -108.5 119.8 40.58 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.07 179.79 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 73.4 m -82.49 134.26 35.21 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.383 -179.91 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -91.2 -167.15 40.94 Favored Glycine 0 CA--C 1.524 0.63 0 N-CA-C 110.673 -0.971 . . . . 0.0 110.673 179.846 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 128' ' ' GLU . . . . . 0.54 ' H ' ' CB ' ' A' ' 139' ' ' SER . 35.7 tt0 -98.0 133.89 41.85 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-O 120.968 0.413 . . . . 0.0 110.658 179.716 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 -63.35 151.75 39.96 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.324 179.71 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -171.78 164.36 6.51 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.733 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 61.7 pttt -88.39 32.64 0.77 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.665 179.184 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 3.9 t -156.14 148.13 23.19 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.929 0.395 . . . . 0.0 110.361 179.976 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 99.9 mttt -81.81 -17.14 48.57 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.642 -0.708 . . . . 0.0 109.896 179.738 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -73.29 -56.86 4.51 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.815 -179.702 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 4.3 tp -65.46 -41.34 93.48 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.344 -179.491 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -56.53 -55.12 37.81 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.832 -178.959 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -60.71 -40.29 91.71 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.789 0.328 . . . . 0.0 110.586 -179.729 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 56.7 mtt -61.63 -42.75 99.32 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.46 -179.817 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 139' ' ' SER . . . . . 0.54 ' CB ' ' H ' ' A' ' 128' ' ' GLU . 74.1 m -61.38 -41.03 96.45 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.44 -0.345 . . . . 0.0 110.873 -179.885 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -63.02 -45.76 90.8 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.935 0.398 . . . . 0.0 110.937 -179.927 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -71.07 -24.22 62.28 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.711 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 52.7 tttp -71.95 -49.98 32.85 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.931 0.396 . . . . 0.0 111.254 179.828 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 143' ' ' VAL . . . . . 0.424 HG13 ' N ' ' A' ' 144' ' ' ALA . 7.4 p -68.29 -38.96 80.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.712 -179.67 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 144' ' ' ALA . . . . . 0.424 ' N ' HG13 ' A' ' 143' ' ' VAL . . . -64.44 -48.3 75.84 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.878 -179.647 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 145' ' ' PHE . . . . . 0.422 ' CD1' ' C ' ' A' ' 145' ' ' PHE . 30.7 t80 -58.76 -44.45 90.59 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.922 -179.594 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 146' ' ' MET . . . . . . . . . . . . . 61.6 ttp -60.82 -38.34 85.08 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.881 -179.286 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 6.6 t -67.95 -41.23 82.81 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.879 179.538 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 148' ' ' ILE . . . . . . . . . . . . . 80.8 mt -57.51 -42.85 81.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 115.681 -0.691 . . . . 0.0 111.147 -178.953 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 17.1 ptmt . . . . . 0 C--N 1.324 -0.506 0 C-N-CA 120.821 -0.352 . . . . 0.0 110.76 -179.783 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 82' ' ' ALA . . . . . 0.478 ' C ' ' N ' ' A' ' 84' ' ' LYS . . . . . . . . 0 N--CA 1.452 -0.347 0 CA-C-O 121.062 0.458 . . . . 0.0 110.051 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -47.01 -15.79 0.04 OUTLIER 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.93 179.748 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.478 ' N ' ' C ' ' A' ' 82' ' ' ALA . 99.6 mttt -64.13 -42.0 97.0 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.733 -0.667 . . . . 0.0 109.901 179.679 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 92.5 m-20 -64.23 -46.27 84.53 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.786 -179.79 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 6.3 tt -62.35 -40.79 97.56 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.828 -179.848 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.485 HD23 HD11 ' A' ' 90' ' ' ILE . 33.4 mt -57.21 -36.72 71.22 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.05 -179.642 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -70.78 -33.42 70.74 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.932 -0.577 . . . . 0.0 110.537 179.592 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 97.6 mt-10 -63.99 -48.51 76.13 Favored 'General case' 0 N--CA 1.462 0.152 0 C-N-CA 120.694 -0.402 . . . . 0.0 111.1 -179.29 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.485 HD11 HD23 ' A' ' 87' ' ' LEU . 29.4 pt -68.55 -34.77 67.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.75 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -57.72 -51.01 71.3 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.853 -179.535 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 69.3 tp60 -67.46 -41.5 84.58 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.539 179.937 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 65.8 tttm -60.97 -47.35 86.83 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.45 -179.505 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 96.1 mt-10 -72.85 -3.25 24.4 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.466 179.919 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 4.7 t 64.99 5.78 3.1 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.615 179.984 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 96' ' ' SER . . . . . 0.544 ' OG ' ' N ' ' A' ' 97' ' ' LEU . 29.3 t -61.86 -127.85 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.243 179.774 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.544 ' N ' ' OG ' ' A' ' 96' ' ' SER . 94.1 mt -139.35 126.43 21.14 Favored 'General case' 0 CA--C 1.517 -0.3 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.548 179.977 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.588 ' N ' HD12 ' A' ' 98' ' ' LEU . 10.2 mp -45.87 142.35 3.8 Favored Pre-proline 0 C--N 1.326 -0.435 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.658 -179.001 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -71.48 144.06 44.28 Favored 'Trans proline' 0 N--CA 1.494 1.546 0 C-N-CA 122.623 2.215 . . . . 0.0 112.241 179.757 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 87.4 t80 -123.28 126.62 47.23 Favored 'General case' 0 CA--C 1.513 -0.461 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 179.937 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 94.6 m-85 -95.18 142.05 28.06 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.393 -178.969 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -143.84 144.87 31.95 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 110.104 -0.332 . . . . 0.0 110.104 179.691 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 93.0 m -122.45 128.0 50.33 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.394 -179.936 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -114.58 142.77 46.0 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.223 179.848 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 29.4 p -103.68 132.4 49.98 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-O 120.787 0.327 . . . . 0.0 110.244 179.802 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 29.8 p -160.49 165.74 30.38 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.132 -179.837 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 115.4 -176.41 16.59 Favored Glycine 0 CA--C 1.524 0.615 0 N-CA-C 111.141 -0.784 . . . . 0.0 111.141 179.786 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 108' ' ' PRO . . . . . 0.42 ' HG2' ' HB3' ' A' ' 111' ' ' ALA . 29.4 Cg_endo -64.35 156.83 57.74 Favored 'Trans proline' 0 C--N 1.308 -1.565 0 C-N-CA 122.862 2.375 . . . . 0.0 112.272 -179.909 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 26.6 m -69.98 -19.54 63.34 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.14 179.313 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 74.6 m80 -88.84 -39.35 13.91 Favored 'General case' 0 CA--C 1.518 -0.269 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.405 179.894 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 111' ' ' ALA . . . . . 0.453 ' HB1' ' CE ' ' A' ' 131' ' ' LYS . . . -125.17 78.23 66.98 Favored Pre-proline 0 CA--C 1.534 0.344 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.257 179.221 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -80.81 126.38 5.83 Favored 'Trans proline' 0 C--N 1.305 -1.755 0 C-N-CA 122.344 2.029 . . . . 0.0 112.362 -179.725 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 4.3 p -110.36 173.64 6.23 Favored 'General case' 0 CA--C 1.513 -0.463 0 CA-C-O 120.951 0.405 . . . . 0.0 109.952 179.667 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 1.1 m-85 -134.14 148.28 50.93 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.491 -179.599 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 96.6 m -128.32 124.59 36.86 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.144 179.365 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 32.6 p -95.19 120.03 34.73 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.314 -179.649 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 117' ' ' THR . . . . . 0.42 ' CG2' ' CG2' ' A' ' 124' ' ' VAL . 99.8 m -107.92 126.57 52.84 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.17 179.856 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 11.6 p -109.33 137.35 41.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.203 -179.719 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 77.5 tt0 -123.82 131.8 53.66 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.822 -179.808 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 120' ' ' PHE . . . . . 0.615 ' CZ ' ' CE1' ' A' ' 125' ' ' PHE . 44.6 p90 -164.98 156.7 15.24 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.48 179.696 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 52.24 24.55 2.88 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.86 0.362 . . . . 0.0 110.617 179.832 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 73.54 22.22 78.71 Favored Glycine 0 CA--C 1.524 0.649 0 N-CA-C 111.139 -0.785 . . . . 0.0 111.139 179.787 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -131.99 152.25 51.24 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 110.319 -0.252 . . . . 0.0 110.319 -179.969 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 124' ' ' VAL . . . . . 0.477 ' O ' HG13 ' A' ' 124' ' ' VAL . 14.9 p -122.01 128.35 75.59 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.194 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.76 -179.649 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 125' ' ' PHE . . . . . 0.615 ' CE1' ' CZ ' ' A' ' 120' ' ' PHE . 24.5 m-85 -112.35 122.87 48.93 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.285 179.873 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 8.8 m -79.61 127.39 32.11 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.123 179.996 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -85.2 -171.84 48.57 Favored Glycine 0 CA--C 1.528 0.853 0 N-CA-C 110.891 -0.884 . . . . 0.0 110.891 -179.938 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 128' ' ' GLU . . . . . 0.467 ' CG ' ' N ' ' A' ' 129' ' ' GLU . 70.5 tt0 -80.25 167.8 19.85 Favored 'General case' 0 N--CA 1.445 -0.7 0 CA-C-O 120.664 0.269 . . . . 0.0 110.362 -179.915 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 129' ' ' GLU . . . . . 0.547 ' CD ' ' H ' ' A' ' 129' ' ' GLU . 1.3 pm0 -107.66 142.61 37.36 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.129 0.49 . . . . 0.0 110.138 179.242 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -172.11 166.64 6.1 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.856 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 131' ' ' LYS . . . . . 0.453 ' CE ' ' HB1' ' A' ' 111' ' ' ALA . 63.2 mttp -86.12 35.2 0.63 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.35 178.932 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 3.1 t -153.13 146.41 24.79 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.865 179.951 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 99.7 mttt -83.65 -21.65 32.41 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.802 179.692 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -69.26 -54.92 12.23 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.99 -179.187 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 4.0 tp -65.41 -40.19 93.09 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.888 -179.596 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -57.55 -54.99 40.56 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.621 -179.174 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -60.83 -41.39 95.66 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.804 0.335 . . . . 0.0 110.627 -179.741 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 33.3 tpp -60.23 -42.73 95.83 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.359 -179.727 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 139' ' ' SER . . . . . 0.423 ' CB ' ' H ' ' A' ' 128' ' ' GLU . 38.5 m -64.45 -36.81 85.37 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.847 -179.937 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -62.33 -46.46 88.6 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.971 0.415 . . . . 0.0 110.573 -179.822 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -70.38 -23.92 62.86 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.504 179.826 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -71.99 -50.61 27.25 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.291 -179.896 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 143' ' ' VAL . . . . . 0.45 HG13 ' N ' ' A' ' 144' ' ' ALA . 7.4 p -68.11 -40.97 83.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.763 -179.531 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 144' ' ' ALA . . . . . 0.45 ' N ' HG13 ' A' ' 143' ' ' VAL . . . -64.76 -46.88 80.29 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.667 -179.834 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 145' ' ' PHE . . . . . 0.45 ' C ' ' CD1' ' A' ' 145' ' ' PHE . 27.3 t80 -58.31 -45.93 87.1 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.931 -179.487 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 146' ' ' MET . . . . . . . . . . . . . 47.4 tpp -61.24 -38.02 85.14 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.863 -179.323 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 19.1 m -67.4 -41.03 85.58 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.106 -179.874 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 148' ' ' ILE . . . . . . . . . . . . . 81.1 mt -56.78 -42.53 77.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.608 -179.363 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 17.9 ptmt . . . . . 0 C--N 1.328 -0.367 0 CA-C-O 120.846 0.355 . . . . 0.0 110.787 179.9 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 82' ' ' ALA . . . . . 0.479 ' C ' ' N ' ' A' ' 84' ' ' LYS . . . . . . . . 0 N--CA 1.45 -0.457 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 2.8 m-85 -48.26 -16.46 0.1 Allowed 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.432 -0.804 . . . . 0.0 109.533 179.62 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.479 ' N ' ' C ' ' A' ' 82' ' ' ALA . 63.9 mttp -63.8 -43.34 96.58 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.465 -0.789 . . . . 0.0 109.891 -179.978 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 41.8 t30 -63.33 -44.1 95.89 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.711 -179.135 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 6.1 tt -61.51 -41.69 97.67 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.982 -179.416 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.485 HD23 HD11 ' A' ' 90' ' ' ILE . 65.1 mt -57.44 -36.52 71.5 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.197 0.522 . . . . 0.0 109.626 -179.638 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 88.9 mt-30 -70.39 -35.59 73.57 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.541 178.996 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 80.9 mm-40 -63.3 -48.44 78.07 Favored 'General case' 0 N--CA 1.462 0.138 0 C-N-CA 120.664 -0.414 . . . . 0.0 111.494 -179.054 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.485 HD11 HD23 ' A' ' 87' ' ' LEU . 14.6 pt -63.7 -43.69 98.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 C-N-CA 120.858 -0.337 . . . . 0.0 110.491 -179.791 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 91' ' ' ALA . . . . . 0.515 ' O ' ' N ' ' A' ' 95' ' ' SER . . . -64.31 -47.69 78.47 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.814 -179.651 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 3.5 tm0? -65.76 -46.51 78.51 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.81 -179.55 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 55.7 mtpt -62.43 -44.78 95.62 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.869 -179.743 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 96.1 mt-10 -91.73 -0.44 57.55 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.225 -179.663 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 95' ' ' SER . . . . . 0.515 ' N ' ' O ' ' A' ' 91' ' ' ALA . 13.8 m 41.33 81.36 0.03 OUTLIER 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.535 -179.658 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 96' ' ' SER . . . . . 0.434 ' O ' ' CB ' ' A' ' 97' ' ' LEU . 75.5 p -139.64 36.19 2.01 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.776 -179.578 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.434 ' CB ' ' O ' ' A' ' 96' ' ' SER . 0.2 OUTLIER 79.59 93.98 0.05 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.939 0.399 . . . . 0.0 110.779 179.749 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.556 ' N ' HD12 ' A' ' 98' ' ' LEU . 10.5 mp -45.74 147.65 1.53 Allowed Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.284 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -68.53 140.95 49.1 Favored 'Trans proline' 0 N--CA 1.495 1.612 0 C-N-CA 122.707 2.271 . . . . 0.0 111.844 -179.859 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 87.0 t80 -126.88 130.04 49.38 Favored 'General case' 0 CA--C 1.511 -0.521 0 N-CA-C 108.417 -0.957 . . . . 0.0 108.417 179.795 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 94.8 m-85 -97.53 143.61 28.06 Favored 'General case' 0 C--N 1.322 -0.597 0 C-N-CA 120.723 -0.391 . . . . 0.0 110.35 -178.972 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -142.61 144.4 32.81 Favored 'General case' 0 N--CA 1.464 0.243 0 N-CA-C 109.986 -0.376 . . . . 0.0 109.986 179.611 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 90.1 m -124.53 130.24 52.1 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.456 -179.971 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -119.54 146.95 45.01 Favored 'General case' 0 N--CA 1.467 0.409 0 N-CA-C 109.851 -0.426 . . . . 0.0 109.851 179.492 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 32.2 p -110.36 138.34 46.87 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 110.175 -0.306 . . . . 0.0 110.175 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 44.3 t -167.4 154.2 8.34 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 110.032 -0.358 . . . . 0.0 110.032 179.85 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 126.08 -175.75 17.6 Favored Glycine 0 CA--C 1.529 0.915 0 N-CA-C 111.307 -0.717 . . . . 0.0 111.307 179.554 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 108' ' ' PRO . . . . . 0.401 ' HG2' ' HB3' ' A' ' 111' ' ' ALA . 19.2 Cg_endo -61.37 153.06 68.42 Favored 'Trans proline' 0 N--CA 1.495 1.599 0 C-N-CA 122.59 2.193 . . . . 0.0 112.366 179.881 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 92.9 p -67.3 -16.53 64.32 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.661 -0.7 . . . . 0.0 109.927 179.202 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 52.7 t-80 -91.79 -41.97 10.37 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-O 120.894 0.378 . . . . 0.0 110.301 -179.942 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 111' ' ' ALA . . . . . 0.401 ' HB3' ' HG2' ' A' ' 108' ' ' PRO . . . -123.95 79.64 57.61 Favored Pre-proline 0 CA--C 1.535 0.373 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.225 179.383 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_endo -83.17 122.68 3.34 Favored 'Trans proline' 0 N--CA 1.491 1.348 0 C-N-CA 122.699 2.266 . . . . 0.0 112.232 179.949 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 63.6 p -102.82 167.31 9.95 Favored 'General case' 0 CA--C 1.515 -0.399 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.003 179.896 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 1.2 m-85 -130.9 144.42 51.45 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.121 -179.897 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 115' ' ' THR . . . . . 0.437 ' OG1' ' OE1' ' A' ' 129' ' ' GLU . 46.5 m -123.82 120.26 32.08 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.659 -0.497 . . . . 0.0 109.659 179.395 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 41.2 t -95.21 121.41 36.83 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.229 -179.821 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 70.6 m -115.83 129.82 56.59 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.29 -0.413 . . . . 0.0 109.932 -179.91 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 12.9 p -113.77 145.74 19.25 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.259 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.164 -179.75 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -127.29 133.41 50.16 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.584 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 120' ' ' PHE . . . . . 0.619 ' CZ ' ' CE1' ' A' ' 125' ' ' PHE . 49.3 p90 -166.3 159.79 15.23 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.525 179.179 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 52.89 19.37 1.3 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.694 0.283 . . . . 0.0 110.761 179.423 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 77.5 21.3 72.84 Favored Glycine 0 CA--C 1.526 0.742 0 N-CA-C 111.249 -0.74 . . . . 0.0 111.249 179.76 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -131.69 151.54 51.56 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 110.192 -0.299 . . . . 0.0 110.192 179.765 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 124' ' ' VAL . . . . . 0.411 ' O ' HG13 ' A' ' 124' ' ' VAL . 6.7 p -121.02 127.71 75.97 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.171 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.643 -179.478 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 125' ' ' PHE . . . . . 0.619 ' CE1' ' CZ ' ' A' ' 120' ' ' PHE . 27.5 m-85 -109.44 154.48 22.57 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.664 179.915 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 37.2 p -117.79 132.99 56.38 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.624 -179.998 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -83.81 -169.79 45.66 Favored Glycine 0 CA--C 1.52 0.394 0 N-CA-C 110.624 -0.99 . . . . 0.0 110.624 179.668 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 128' ' ' GLU . . . . . 0.491 ' H ' ' CB ' ' A' ' 139' ' ' SER . 7.1 pt-20 -94.51 127.75 40.65 Favored 'General case' 0 CA--C 1.529 0.152 0 CA-C-O 120.553 0.216 . . . . 0.0 111.025 -179.373 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 129' ' ' GLU . . . . . 0.437 ' OE1' ' OG1' ' A' ' 115' ' ' THR . 79.8 mm-40 -53.81 143.73 20.25 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 120.457 -0.497 . . . . 0.0 110.209 179.832 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -169.63 161.62 9.5 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.772 179.984 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 22.4 pttp -88.61 33.99 0.76 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.416 179.652 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 4.8 t -154.74 147.86 24.78 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.621 179.493 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 99.7 mttt -79.98 -33.41 39.46 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.877 179.639 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 62.9 mttp -59.9 -54.68 43.29 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.037 -178.826 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 135' ' ' LEU . . . . . 0.4 HD21 ' OE2' ' A' ' 128' ' ' GLU . 3.7 tp -64.81 -38.86 92.39 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.914 0.387 . . . . 0.0 110.388 179.924 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -57.16 -54.94 41.07 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.568 -179.406 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -64.14 -41.01 97.35 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.714 -179.218 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 93.0 mtp -62.41 -41.44 98.69 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.208 -179.826 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 139' ' ' SER . . . . . 0.491 ' CB ' ' H ' ' A' ' 128' ' ' GLU . 68.8 m -66.7 -36.55 82.77 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.724 179.39 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -65.17 -45.84 83.26 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.953 0.406 . . . . 0.0 110.65 179.553 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -72.36 -24.27 61.25 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.419 179.856 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -70.01 -48.68 57.12 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.048 179.757 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 7.2 p -67.98 -37.37 78.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.705 -179.94 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 144' ' ' ALA . . . . . 0.438 ' O ' ' OG ' ' A' ' 147' ' ' SER . . . -65.52 -46.41 79.72 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.903 0.382 . . . . 0.0 110.722 -179.952 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 145' ' ' PHE . . . . . . . . . . . . . 85.6 t80 -60.72 -41.52 95.45 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.797 -179.986 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 146' ' ' MET . . . . . . . . . . . . . 75.4 mmm -60.69 -38.47 85.09 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.627 -179.461 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 147' ' ' SER . . . . . 0.438 ' OG ' ' O ' ' A' ' 144' ' ' ALA . 58.5 p -70.76 -39.81 73.02 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 120.75 -0.38 . . . . 0.0 111.089 179.429 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 148' ' ' ILE . . . . . . . . . . . . . 84.3 mt -58.5 -26.78 31.82 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.242 0 CA-C-O 120.715 0.293 . . . . 0.0 110.622 -179.608 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 36.5 mtmt . . . . . 0 C--N 1.323 -0.577 0 C-N-CA 120.326 -0.55 . . . . 0.0 110.576 -179.413 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 82' ' ' ALA . . . . . 0.472 ' C ' ' N ' ' A' ' 84' ' ' LYS . . . . . . . . 0 N--CA 1.451 -0.422 0 CA-C-O 121.13 0.49 . . . . 0.0 109.759 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -47.63 -16.09 0.06 Allowed 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.72 179.971 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.472 ' N ' ' C ' ' A' ' 82' ' ' ALA . 64.7 mttp -63.88 -42.11 97.58 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.617 -0.719 . . . . 0.0 109.804 179.716 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 89.7 m-20 -63.73 -46.19 86.48 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.884 -179.403 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 7.1 tt -62.64 -39.67 94.59 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.556 -179.724 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.518 HD23 HD11 ' A' ' 90' ' ' ILE . 33.7 mt -57.74 -38.97 76.25 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 -179.689 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 78.7 mt-30 -69.26 -35.11 75.75 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.645 179.122 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 95.7 mt-10 -62.99 -48.73 77.58 Favored 'General case' 0 N--CA 1.466 0.327 0 C-N-CA 120.761 -0.376 . . . . 0.0 111.166 -179.121 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.518 HD11 HD23 ' A' ' 87' ' ' LEU . 29.8 pt -66.42 -34.77 72.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.683 -179.968 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -55.71 -49.09 73.93 Favored 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 120.737 -0.385 . . . . 0.0 110.667 -179.37 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 52.9 tt0 -67.97 -43.49 78.86 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.846 -179.857 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 66.0 tttm -61.82 -48.52 80.2 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.899 0.381 . . . . 0.0 110.555 -179.487 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 80.2 mm-40 -76.84 2.62 14.04 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.576 -179.764 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 4.3 t 64.42 8.04 4.01 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.78 179.766 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 18.7 m -75.21 158.46 32.92 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.437 179.732 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.594 ' N ' HD12 ' A' ' 97' ' ' LEU . 9.4 mp -69.29 131.68 45.24 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.998 0.428 . . . . 0.0 110.393 -179.459 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.56 ' N ' HD12 ' A' ' 98' ' ' LEU . 10.3 mp -46.16 148.23 1.59 Allowed Pre-proline 0 C--N 1.326 -0.426 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.601 -179.727 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -73.07 142.69 34.84 Favored 'Trans proline' 0 N--CA 1.496 1.65 0 C-N-CA 122.828 2.352 . . . . 0.0 111.992 179.541 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 94.6 t80 -124.93 127.4 47.0 Favored 'General case' 0 CA--C 1.51 -0.564 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 179.798 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 84.1 m-85 -96.93 145.98 25.39 Favored 'General case' 0 C--N 1.324 -0.512 0 C-N-CA 120.726 -0.39 . . . . 0.0 110.303 -178.885 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -142.37 143.53 32.75 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.51 -0.314 . . . . 0.0 110.266 179.712 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 97.3 m -125.83 133.03 52.11 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.305 179.809 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -127.17 152.28 47.56 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.176 179.765 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 33.3 p -108.22 135.01 50.26 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-O 120.823 0.344 . . . . 0.0 110.133 -179.891 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 99.5 p -160.08 164.41 33.11 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.461 -179.805 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 117.47 -175.5 15.73 Favored Glycine 0 CA--C 1.527 0.835 0 N-CA-C 111.171 -0.772 . . . . 0.0 111.171 179.618 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 25.0 Cg_endo -62.15 152.3 76.73 Favored 'Trans proline' 0 N--CA 1.497 1.713 0 C-N-CA 122.863 2.376 . . . . 0.0 112.461 179.895 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 89.7 p -67.46 -17.31 64.65 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.016 179.284 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 55.1 t-80 -89.6 -42.73 11.23 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.209 179.956 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -123.93 78.07 58.1 Favored Pre-proline 0 CA--C 1.535 0.391 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.112 179.331 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -79.07 127.95 7.98 Favored 'Trans proline' 0 N--CA 1.49 1.27 0 C-N-CA 122.347 2.031 . . . . 0.0 112.435 179.768 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 52.0 p -110.19 172.87 6.61 Favored 'General case' 0 CA--C 1.519 -0.249 0 CA-C-N 115.793 -0.639 . . . . 0.0 109.86 179.629 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 1.7 m-85 -130.47 143.9 51.06 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.503 -179.377 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 97.9 m -124.59 120.91 33.27 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.265 -0.425 . . . . 0.0 109.965 179.307 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 12.9 t -102.14 128.82 48.46 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.239 179.917 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 97.5 m -129.6 141.44 50.95 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.322 -179.87 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 14.2 p -117.77 152.09 19.75 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.227 0 CA-C-N 116.044 -0.525 . . . . 0.0 109.76 179.86 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -129.03 136.98 51.03 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.004 0.43 . . . . 0.0 110.308 -179.895 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 120' ' ' PHE . . . . . 0.62 ' CZ ' ' CE1' ' A' ' 125' ' ' PHE . 55.0 p90 -169.31 161.42 10.01 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.791 -0.641 . . . . 0.0 110.744 179.14 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 52.87 19.21 1.24 Allowed 'General case' 0 N--CA 1.462 0.166 0 CA-C-O 120.771 0.32 . . . . 0.0 110.712 179.39 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 75.86 20.44 77.92 Favored Glycine 0 CA--C 1.526 0.723 0 N-CA-C 111.05 -0.82 . . . . 0.0 111.05 179.774 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 97.2 mttt -131.82 151.5 51.63 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.955 0.407 . . . . 0.0 110.145 -179.703 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 124' ' ' VAL . . . . . 0.524 HG22 ' N ' ' A' ' 125' ' ' PHE . 7.7 p -103.54 160.29 4.62 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.229 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.606 -179.325 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 125' ' ' PHE . . . . . 0.62 ' CE1' ' CZ ' ' A' ' 120' ' ' PHE . 85.8 m-85 -151.63 105.69 3.17 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.154 179.817 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 126' ' ' SER . . . . . 0.519 ' O ' HG21 ' A' ' 143' ' ' VAL . 34.2 t -88.48 151.92 22.22 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.499 179.7 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -99.93 -159.36 28.5 Favored Glycine 0 N--CA 1.464 0.54 0 N-CA-C 110.652 -0.979 . . . . 0.0 110.652 179.454 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 128' ' ' GLU . . . . . 0.507 ' H ' ' CB ' ' A' ' 139' ' ' SER . 5.7 pt-20 -101.89 135.87 42.7 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-O 120.434 0.159 . . . . 0.0 110.801 -179.381 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -55.05 145.62 20.18 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 120.599 -0.441 . . . . 0.0 110.258 179.384 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -167.13 159.31 12.87 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.881 -179.999 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 48.0 tttp -88.58 32.18 0.8 Allowed 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.209 179.682 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 5.8 t -157.8 150.46 22.75 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.613 179.677 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -79.67 -35.98 38.36 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.054 179.619 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -56.45 -55.12 37.61 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.005 -178.926 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 4.3 tp -65.18 -40.4 94.22 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.269 -179.724 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -55.84 -54.44 44.56 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.501 -179.221 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -60.69 -40.25 91.51 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.897 0.38 . . . . 0.0 110.335 -179.593 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 51.4 ttp -60.16 -48.45 81.68 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.296 -179.722 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 139' ' ' SER . . . . . 0.507 ' CB ' ' H ' ' A' ' 128' ' ' GLU . 57.1 m -60.72 -35.47 76.41 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.7 179.92 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -68.82 -49.28 59.8 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.888 0.375 . . . . 0.0 110.825 179.727 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -60.07 -25.61 65.52 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.645 -179.559 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 30.7 mmtm -68.04 -43.33 78.98 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.87 179.311 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 143' ' ' VAL . . . . . 0.519 HG21 ' O ' ' A' ' 126' ' ' SER . 3.3 t -62.39 -45.42 98.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.576 -179.116 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -63.12 -49.14 75.58 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-O 120.875 0.369 . . . . 0.0 111.012 -179.755 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 145' ' ' PHE . . . . . . . . . . . . . 49.7 t80 -61.53 -44.52 96.9 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.84 -179.367 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 146' ' ' MET . . . . . . . . . . . . . 72.6 mmm -64.36 -40.26 95.5 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.794 0.33 . . . . 0.0 110.883 -179.537 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 16.3 m -69.78 -41.85 74.58 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.935 179.934 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 148' ' ' ILE . . . . . . . . . . . . . 48.1 mt -56.49 -32.58 36.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.369 -179.78 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 55.4 mtpt . . . . . 0 C--N 1.327 -0.409 0 C-N-CA 120.618 -0.433 . . . . 0.0 110.486 -179.989 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 82' ' ' ALA . . . . . 0.482 ' C ' ' N ' ' A' ' 84' ' ' LYS . . . . . . . . 0 N--CA 1.449 -0.504 0 CA-C-O 121.167 0.508 . . . . 0.0 110.155 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 2.2 m-85 -46.61 -16.04 0.03 OUTLIER 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.033 179.605 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.482 ' N ' ' C ' ' A' ' 82' ' ' ALA . 68.6 mttm -65.06 -42.37 94.27 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.004 179.604 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 89.9 m-20 -63.72 -45.77 88.46 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.478 -179.66 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 6.4 tt -61.98 -41.55 98.15 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.793 -179.741 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.57 HD23 HD11 ' A' ' 90' ' ' ILE . 37.6 mt -56.76 -37.04 70.52 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.115 -179.618 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 88.1 mt-30 -71.97 -32.68 67.51 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.415 179.737 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 78.5 mm-40 -65.01 -46.6 80.72 Favored 'General case' 0 CA--C 1.522 -0.102 0 C-N-CA 120.761 -0.375 . . . . 0.0 111.087 -179.048 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.57 HD11 HD23 ' A' ' 87' ' ' LEU . 18.1 pt -65.2 -44.45 95.25 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.703 -179.804 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 91' ' ' ALA . . . . . 0.504 ' O ' ' N ' ' A' ' 95' ' ' SER . . . -68.14 -47.77 67.18 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.538 -179.446 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 58.3 tt0 -64.78 -46.25 82.87 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.689 -179.809 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 66.3 tttm -61.67 -47.17 86.55 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.675 -179.923 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 80.9 mm-40 -92.94 8.47 39.65 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.408 -179.953 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 95' ' ' SER . . . . . 0.504 ' N ' ' O ' ' A' ' 91' ' ' ALA . 5.9 p 41.14 42.67 1.71 Allowed 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 120.848 0.356 . . . . 0.0 110.497 -179.882 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 18.7 p -92.74 39.43 1.04 Allowed 'General case' 0 CA--C 1.513 -0.466 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.788 -179.518 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 43.3 mt 69.4 100.4 0.06 Allowed 'General case' 0 CA--C 1.52 -0.21 0 O-C-N 123.451 0.469 . . . . 0.0 110.907 179.888 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 10.0 mp -44.85 155.06 0.41 Allowed Pre-proline 0 N--CA 1.452 -0.34 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.676 179.852 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_endo -64.8 170.17 10.49 Favored 'Trans proline' 0 C--N 1.305 -1.713 0 C-N-CA 122.791 2.328 . . . . 0.0 111.901 179.529 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 36.9 t80 -144.97 116.79 8.22 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.446 178.966 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 98.5 m-85 -98.77 131.95 44.51 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.918 0.39 . . . . 0.0 110.287 179.976 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -141.63 143.17 33.5 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.357 179.842 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 95.9 m -123.1 128.77 50.56 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.316 179.954 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -105.2 134.41 48.35 Favored 'General case' 0 CA--C 1.522 -0.108 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.271 179.714 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 19.4 p -115.21 123.95 50.16 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-O 120.897 0.379 . . . . 0.0 110.463 179.828 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 35.1 t -167.41 151.96 6.89 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.352 179.945 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 132.69 168.43 11.99 Favored Glycine 0 CA--C 1.522 0.491 0 N-CA-C 110.934 -0.867 . . . . 0.0 110.934 179.714 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 22.0 Cg_endo -61.46 151.38 80.12 Favored 'Trans proline' 0 C--N 1.303 -1.825 0 C-N-CA 122.814 2.342 . . . . 0.0 112.122 179.421 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 5.9 m -65.04 -17.42 64.44 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.031 -0.532 . . . . 0.0 110.254 179.395 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 93.4 m-70 -90.83 -41.91 10.94 Favored 'General case' 0 CA--C 1.52 -0.203 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.441 179.817 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -124.36 77.85 61.47 Favored Pre-proline 0 CA--C 1.531 0.248 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.356 179.508 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 112' ' ' PRO . . . . . 0.48 ' O ' HG23 ' A' ' 113' ' ' THR . 61.3 Cg_endo -76.46 160.72 35.13 Favored 'Trans proline' 0 C--N 1.304 -1.801 0 C-N-CA 122.681 2.254 . . . . 0.0 112.492 179.884 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 113' ' ' THR . . . . . 0.48 HG23 ' O ' ' A' ' 112' ' ' PRO . 24.5 p -155.8 150.3 25.95 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.56 179.423 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -132.59 146.05 51.59 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.352 179.98 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 91.6 m -126.12 121.33 32.56 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 116.175 -0.466 . . . . 0.0 109.878 179.197 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 10.4 p -95.76 121.75 37.81 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.601 179.927 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 52.6 m -115.77 130.67 56.94 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.044 179.944 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 9.8 p -112.59 143.79 21.62 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.267 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.208 179.994 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 84.0 tt0 -129.59 138.07 51.06 Favored 'General case' 0 CA--C 1.52 -0.189 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.632 -179.98 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 120' ' ' PHE . . . . . 0.627 ' CZ ' ' CE1' ' A' ' 125' ' ' PHE . 49.9 p90 -170.19 160.32 7.86 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.527 179.5 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 52.35 19.11 1.04 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.883 0.373 . . . . 0.0 110.559 179.419 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 79.55 20.37 69.04 Favored Glycine 0 CA--C 1.522 0.487 0 N-CA-C 111.353 -0.699 . . . . 0.0 111.353 179.697 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -131.9 150.8 52.05 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.661 0.267 . . . . 0.0 110.384 -179.96 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 124' ' ' VAL . . . . . 0.47 ' O ' HG13 ' A' ' 124' ' ' VAL . 7.8 p -119.59 126.41 75.3 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.312 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.972 -179.848 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 125' ' ' PHE . . . . . 0.627 ' CE1' ' CZ ' ' A' ' 120' ' ' PHE . 33.6 m-85 -110.83 118.2 35.49 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.112 179.805 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 11.3 p -76.64 125.25 28.92 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.479 -179.863 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -78.31 -172.67 40.67 Favored Glycine 0 CA--C 1.525 0.666 0 N-CA-C 110.904 -0.878 . . . . 0.0 110.904 179.914 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 18.9 mm-40 -79.62 169.81 17.46 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.649 0.262 . . . . 0.0 110.813 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 129' ' ' GLU . . . . . 0.547 ' CD ' ' H ' ' A' ' 129' ' ' GLU . 1.3 pm0 -109.33 139.17 44.62 Favored 'General case' 0 N--CA 1.464 0.262 0 N-CA-C 109.721 -0.474 . . . . 0.0 109.721 179.516 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -173.2 169.54 4.52 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.729 -179.994 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 22.6 pttp -86.86 36.34 0.72 Allowed 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.282 178.598 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 1.7 t -154.39 147.75 24.98 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.972 0.415 . . . . 0.0 110.665 -179.854 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -84.08 -25.61 29.66 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.027 179.594 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -66.22 -49.33 67.61 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.32 -178.496 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 4.2 tp -65.18 -42.59 93.49 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.573 -179.296 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -62.81 -54.92 31.52 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.391 -179.125 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -57.31 -46.24 83.41 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.739 0.304 . . . . 0.0 110.572 -179.965 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 36.8 ttm -62.98 -39.34 94.41 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.259 -179.969 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 37.5 m -63.01 -38.85 92.86 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.831 179.8 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -62.4 -40.62 97.1 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.622 -179.909 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -68.38 -27.15 65.98 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.911 -179.807 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 92.6 mttt -72.12 -51.1 23.03 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.802 179.233 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 143' ' ' VAL . . . . . 0.449 HG13 ' N ' ' A' ' 144' ' ' ALA . 7.2 p -66.6 -41.28 88.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.742 -179.625 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 144' ' ' ALA . . . . . 0.449 ' N ' HG13 ' A' ' 143' ' ' VAL . . . -64.07 -46.54 83.88 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.59 -179.798 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 145' ' ' PHE . . . . . . . . . . . . . 71.2 t80 -60.52 -42.66 96.89 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.41 -179.74 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 146' ' ' MET . . . . . 0.451 ' C ' ' SD ' ' A' ' 146' ' ' MET . 14.9 tmm? -61.63 -38.66 88.49 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.8 -179.742 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 6.8 t -69.22 -44.58 71.74 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.916 0.389 . . . . 0.0 110.976 179.874 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 148' ' ' ILE . . . . . . . . . . . . . 86.4 mt -56.17 -31.1 31.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.737 -179.466 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 55.0 mtpt . . . . . 0 C--N 1.326 -0.433 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.69 -179.939 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 82' ' ' ALA . . . . . 0.48 ' C ' ' N ' ' A' ' 84' ' ' LYS . . . . . . . . 0 N--CA 1.449 -0.504 0 CA-C-O 121.26 0.552 . . . . 0.0 110.026 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -46.68 -16.3 0.03 OUTLIER 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.71 -0.677 . . . . 0.0 109.831 179.674 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.48 ' N ' ' C ' ' A' ' 82' ' ' ALA . 68.6 mttm -63.89 -41.98 97.57 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.953 179.709 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 65.7 t30 -66.38 -46.44 76.69 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.599 179.91 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 2.6 tp -60.59 -42.69 97.25 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.374 -179.482 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.442 HD23 HD11 ' A' ' 90' ' ' ILE . 34.1 mt -56.54 -34.81 67.42 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.152 -179.497 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 99.2 mt-30 -71.74 -35.58 70.17 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.42 179.38 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 94.9 mt-10 -61.7 -48.95 78.44 Favored 'General case' 0 C--O 1.231 0.09 0 CA-C-O 120.913 0.387 . . . . 0.0 111.107 -178.887 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.442 HD11 HD23 ' A' ' 87' ' ' LEU . 21.8 pt -62.3 -36.76 76.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.506 -179.929 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -58.18 -47.6 82.91 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.572 -179.518 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 13.0 mm100 -64.55 -49.09 72.59 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.707 179.973 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 19.3 tptm -62.18 -48.07 81.68 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.724 -179.457 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -71.88 -15.37 62.11 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.429 -179.984 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 1.9 p 74.54 15.52 3.36 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.473 -179.723 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 11.2 p -84.26 161.91 20.32 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.676 -179.984 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 60.2 mt -61.62 124.68 21.37 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.493 -179.948 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.617 ' N ' HD12 ' A' ' 98' ' ' LEU . 9.4 mp -49.09 147.93 4.55 Favored Pre-proline 0 C--N 1.326 -0.436 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.706 -179.513 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_endo -68.45 140.11 47.08 Favored 'Trans proline' 0 C--N 1.311 -1.405 0 C-N-CA 122.508 2.138 . . . . 0.0 112.009 179.452 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 85.9 t80 -132.36 133.84 44.46 Favored 'General case' 0 CA--C 1.517 -0.322 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 179.819 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 45.0 m-85 -103.35 149.32 24.87 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.35 -179.303 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -152.27 93.5 1.82 Allowed 'General case' 0 C--O 1.234 0.265 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.175 179.883 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 103' ' ' THR . . . . . 0.433 ' H ' HG22 ' A' ' 103' ' ' THR . 0.0 OUTLIER -70.93 138.95 50.5 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.178 179.848 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -126.59 152.77 46.18 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.209 179.945 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 43.4 p -105.93 134.6 48.79 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-O 120.819 0.342 . . . . 0.0 110.414 179.798 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 51.0 p -161.7 161.0 29.24 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.229 179.902 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 116.83 -176.9 16.49 Favored Glycine 0 CA--C 1.523 0.584 0 N-CA-C 110.889 -0.884 . . . . 0.0 110.889 179.789 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -62.43 152.59 76.19 Favored 'Trans proline' 0 C--N 1.307 -1.644 0 C-N-CA 122.627 2.218 . . . . 0.0 112.298 -179.717 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 78.7 p -67.66 -15.35 63.6 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 109.46 -0.57 . . . . 0.0 109.46 178.833 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 77.2 m80 -90.13 -43.76 10.24 Favored 'General case' 0 CA--C 1.519 -0.242 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.546 179.981 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -124.89 78.67 65.2 Favored Pre-proline 0 N--CA 1.462 0.17 0 CA-C-N 116.018 -0.537 . . . . 0.0 109.636 179.011 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -82.0 126.91 5.22 Favored 'Trans proline' 0 C--N 1.306 -1.686 0 C-N-CA 122.467 2.112 . . . . 0.0 112.168 -179.716 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 3.9 p -108.16 172.9 6.57 Favored 'General case' 0 CA--C 1.516 -0.339 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.078 179.756 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 1.2 m-85 -131.1 145.46 52.0 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.448 -179.743 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 89.7 m -128.98 123.8 33.37 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.035 179.368 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 116' ' ' SER . . . . . 0.414 ' OG ' ' O ' ' A' ' 136' ' ' ALA . 93.6 p -92.06 119.37 31.69 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.731 -179.865 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 91.2 m -106.22 123.54 48.2 Favored 'General case' 0 N--CA 1.465 0.301 0 N-CA-C 109.991 -0.374 . . . . 0.0 109.991 179.921 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 7.5 p -109.7 137.81 40.15 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.301 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.144 -179.946 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 82.8 tt0 -123.47 131.29 53.6 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.707 -179.907 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 120' ' ' PHE . . . . . 0.626 ' CZ ' ' CE1' ' A' ' 125' ' ' PHE . 47.2 p90 -166.53 157.34 12.49 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.428 179.504 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 53.93 21.72 2.98 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.915 0.388 . . . . 0.0 110.494 179.667 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 75.45 21.51 77.28 Favored Glycine 0 CA--C 1.522 0.499 0 N-CA-C 111.024 -0.83 . . . . 0.0 111.024 -179.991 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -132.51 152.95 51.39 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.536 0.208 . . . . 0.0 110.509 179.944 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 124' ' ' VAL . . . . . 0.471 ' O ' HG13 ' A' ' 124' ' ' VAL . 12.0 p -122.49 128.27 75.33 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.232 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.776 -179.914 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 125' ' ' PHE . . . . . 0.626 ' CE1' ' CZ ' ' A' ' 120' ' ' PHE . 25.5 m-85 -114.02 123.46 49.75 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.257 179.673 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 96.0 p -83.29 137.36 34.02 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.531 -179.912 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -85.12 -171.48 48.28 Favored Glycine 0 CA--C 1.521 0.424 0 N-CA-C 110.711 -0.955 . . . . 0.0 110.711 179.93 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 128' ' ' GLU . . . . . 0.42 ' O ' ' CG ' ' A' ' 128' ' ' GLU . 9.7 pt-20 -92.74 127.57 38.29 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-O 121.003 0.43 . . . . 0.0 110.858 -179.823 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 129' ' ' GLU . . . . . 0.602 ' CD ' ' H ' ' A' ' 129' ' ' GLU . 1.2 pm0 -54.64 145.34 19.3 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 121.066 0.46 . . . . 0.0 110.695 179.305 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -171.66 163.15 6.53 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.645 179.884 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 51.8 tttm -89.2 33.91 0.8 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.986 0.422 . . . . 0.0 110.301 179.447 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -154.43 143.05 20.77 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.667 -179.644 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -78.91 -45.65 20.11 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.247 179.938 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 43.9 pttt -53.32 -46.71 69.56 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.539 -179.433 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 4.1 tp -66.69 -42.11 87.01 Favored 'General case' 0 N--CA 1.443 -0.78 0 CA-C-O 120.741 0.305 . . . . 0.0 110.942 -179.756 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 136' ' ' ALA . . . . . 0.414 ' O ' ' OG ' ' A' ' 116' ' ' SER . . . -59.55 -51.96 67.62 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.48 -179.381 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 95.6 mt-10 -55.77 -44.0 77.26 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.384 -179.667 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 47.9 ttp -61.54 -42.54 98.97 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.266 -179.739 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 23.3 m -63.16 -39.01 93.43 Favored 'General case' 0 CA--C 1.519 -0.221 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.954 -179.841 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -64.27 -44.89 90.32 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.009 0.433 . . . . 0.0 110.589 -179.788 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -72.16 -24.17 61.39 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.389 179.934 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 63.4 tttp -71.11 -48.89 49.68 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.293 179.867 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 7.5 p -68.34 -37.75 78.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.698 -179.734 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -62.9 -44.59 95.67 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.781 -179.544 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 145' ' ' PHE . . . . . . . . . . . . . 60.6 t80 -59.9 -43.12 95.02 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.739 -179.39 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 146' ' ' MET . . . . . . . . . . . . . 47.1 ttp -61.26 -39.43 90.34 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.732 0.301 . . . . 0.0 110.848 -179.242 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 12.2 t -67.44 -44.62 78.25 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.966 -179.999 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 148' ' ' ILE . . . . . . . . . . . . . 91.4 mt -56.22 -33.47 37.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.695 -179.665 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 56.0 mtpt . . . . . 0 C--N 1.324 -0.505 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.797 -179.929 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 82' ' ' ALA . . . . . 0.481 ' C ' ' N ' ' A' ' 84' ' ' LYS . . . . . . . . 0 N--CA 1.449 -0.483 0 CA-C-O 121.075 0.464 . . . . 0.0 110.086 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 -46.7 -16.06 0.03 OUTLIER 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.027 179.533 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.481 ' N ' ' C ' ' A' ' 82' ' ' ALA . 99.4 mttt -64.72 -41.07 96.25 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.844 -0.617 . . . . 0.0 110.125 179.69 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 89.5 m-20 -66.71 -47.2 73.1 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.692 -179.823 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 5.8 tt -60.82 -42.96 98.72 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.723 -179.406 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.432 HD23 HD11 ' A' ' 90' ' ' ILE . 33.8 mt -55.86 -35.23 66.22 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.259 -179.56 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 88.8 mt-30 -70.71 -34.0 71.45 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.303 179.459 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 80.9 mm-40 -63.95 -49.98 70.42 Favored 'General case' 0 C--O 1.231 0.098 0 C-N-CA 120.608 -0.437 . . . . 0.0 111.188 -178.807 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.432 HD11 HD23 ' A' ' 87' ' ' LEU . 30.8 pt -63.37 -35.39 72.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.515 179.982 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -58.53 -48.88 79.38 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.666 -179.187 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 87.6 mt-30 -66.09 -43.94 85.83 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.776 179.932 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 88.9 tttt -63.47 -48.32 78.14 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.478 -179.84 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 98.4 mt-10 -72.87 -10.11 59.44 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.31 -179.937 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 2.0 p 74.08 8.53 4.7 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.462 -179.881 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 10.0 p -77.66 164.14 25.57 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.322 179.93 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.589 ' N ' HD12 ' A' ' 97' ' ' LEU . 9.6 mp -68.31 128.23 35.81 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.981 0.42 . . . . 0.0 110.422 -179.555 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.549 ' N ' HD12 ' A' ' 98' ' ' LEU . 10.7 mp -46.39 148.54 1.6 Allowed Pre-proline 0 N--CA 1.448 -0.54 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.822 -179.846 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_endo -69.02 140.3 45.08 Favored 'Trans proline' 0 C--N 1.311 -1.42 0 C-N-CA 122.649 2.232 . . . . 0.0 112.072 179.834 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 49.9 t80 -132.27 132.39 42.99 Favored 'General case' 0 C--O 1.235 0.338 0 N-CA-C 109.696 -0.483 . . . . 0.0 109.696 179.823 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 33.7 m-85 -101.94 149.08 24.58 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.755 -179.578 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -142.27 91.38 2.33 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-O 120.991 0.424 . . . . 0.0 111.349 179.918 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 43.6 m -71.52 133.19 45.64 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.085 179.655 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -138.17 161.31 37.16 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 110.136 -0.32 . . . . 0.0 110.136 -179.969 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 37.4 p -100.72 134.96 42.91 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-O 120.906 0.384 . . . . 0.0 110.508 179.743 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 34.1 p -160.75 163.64 32.15 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.473 -179.899 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 119.83 -165.13 13.49 Favored Glycine 0 CA--C 1.526 0.723 0 N-CA-C 111.128 -0.789 . . . . 0.0 111.128 179.583 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 108' ' ' PRO . . . . . 0.443 ' HG2' ' HB3' ' A' ' 111' ' ' ALA . 47.3 Cg_endo -70.2 150.72 65.96 Favored 'Trans proline' 0 C--N 1.306 -1.668 0 C-N-CA 122.61 2.207 . . . . 0.0 112.453 -179.422 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 77.8 p -68.47 -20.02 64.59 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.243 178.729 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 73.0 m80 -85.23 -37.88 19.58 Favored 'General case' 0 CA--C 1.518 -0.251 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.413 179.706 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 111' ' ' ALA . . . . . 0.511 ' HB1' ' HE2' ' A' ' 131' ' ' LYS . . . -126.91 78.29 73.96 Favored Pre-proline 0 N--CA 1.465 0.291 0 CA-C-O 121.18 0.515 . . . . 0.0 110.396 178.76 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -62.63 122.46 10.82 Favored 'Trans proline' 0 C--N 1.301 -1.966 0 C-N-CA 122.315 2.01 . . . . 0.0 112.367 -179.693 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 40.8 p -111.69 173.96 6.1 Favored 'General case' 0 CA--C 1.515 -0.391 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.198 179.638 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 1.6 m-85 -130.28 144.37 51.33 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.506 -179.579 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 86.1 m -131.26 127.55 38.03 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.479 179.514 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 10.5 t -97.73 122.01 40.31 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.419 -179.934 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 98.5 m -107.78 127.7 53.94 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.183 -179.95 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 7.4 p -111.82 139.24 37.16 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.303 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.239 -179.945 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 84.1 tt0 -124.27 131.21 53.51 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.53 179.736 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 120' ' ' PHE . . . . . 0.612 ' CZ ' ' CE1' ' A' ' 125' ' ' PHE . 45.2 p90 -167.84 159.1 11.31 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.177 179.249 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 54.57 20.84 3.05 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.145 0.498 . . . . 0.0 109.767 -179.908 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 72.73 23.56 77.68 Favored Glycine 0 CA--C 1.521 0.448 0 N-CA-C 110.937 -0.865 . . . . 0.0 110.937 -179.77 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 62.9 mttp -132.6 152.25 51.69 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.587 0.232 . . . . 0.0 110.382 -179.884 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 124' ' ' VAL . . . . . 0.491 ' O ' HG13 ' A' ' 124' ' ' VAL . 12.7 p -120.19 127.26 75.89 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.167 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.926 -179.742 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 125' ' ' PHE . . . . . 0.612 ' CE1' ' CZ ' ' A' ' 120' ' ' PHE . 39.2 m-85 -112.74 119.88 39.57 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.079 179.312 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 6.8 m -82.26 138.43 34.6 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.638 -179.998 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -86.65 -168.21 44.56 Favored Glycine 0 CA--C 1.523 0.532 0 N-CA-C 110.646 -0.981 . . . . 0.0 110.646 179.724 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 128' ' ' GLU . . . . . 0.414 ' H ' ' CB ' ' A' ' 139' ' ' SER . 9.1 pt-20 -98.87 133.26 43.41 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.819 0.342 . . . . 0.0 110.522 -179.87 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -57.33 148.09 23.93 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.072 0.463 . . . . 0.0 110.545 179.068 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -170.78 162.74 7.72 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.811 179.818 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 131' ' ' LYS . . . . . 0.511 ' HE2' ' HB1' ' A' ' 111' ' ' ALA . 97.2 mttt -88.35 32.79 0.76 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.369 179.22 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 3.1 t -158.43 151.4 22.56 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.741 179.877 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 68.9 mttm -81.56 -36.32 29.22 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.083 0.468 . . . . 0.0 110.442 179.508 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 30.7 mmtp -53.42 -54.28 39.08 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.828 -178.979 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 4.4 tp -64.89 -40.5 95.2 Favored 'General case' 0 N--CA 1.446 -0.639 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.066 -179.906 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -55.64 -54.63 41.81 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.659 -179.172 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 97.3 mt-10 -60.96 -40.01 91.73 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.733 0.302 . . . . 0.0 110.404 -179.458 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 48.2 ttp -62.48 -46.68 87.35 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.735 -179.595 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 139' ' ' SER . . . . . 0.414 ' CB ' ' H ' ' A' ' 128' ' ' GLU . 68.8 m -61.95 -39.07 90.85 Favored 'General case' 0 CA--C 1.518 -0.269 0 CA-C-N 116.554 -0.294 . . . . 0.0 110.965 -179.356 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -63.66 -46.05 87.37 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.981 0.419 . . . . 0.0 110.563 -179.879 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -72.35 -23.5 61.15 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.563 -179.973 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 66.2 tttm -70.35 -48.63 55.53 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.054 0.454 . . . . 0.0 111.428 179.713 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 6.9 p -67.94 -36.41 75.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.614 -179.631 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -64.07 -45.01 90.64 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.614 -179.334 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 145' ' ' PHE . . . . . . . . . . . . . 62.1 t80 -60.46 -41.92 95.13 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.505 -179.615 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 146' ' ' MET . . . . . . . . . . . . . 47.9 ttp -63.74 -40.04 95.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.689 -179.648 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 67.8 m -68.27 -43.64 77.35 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.913 -179.885 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 148' ' ' ILE . . . . . . . . . . . . . 78.5 mt -55.77 -31.85 30.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.704 -179.686 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 54.3 mtpt . . . . . 0 C--N 1.326 -0.429 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.462 179.85 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 82' ' ' ALA . . . . . 0.483 ' C ' ' N ' ' A' ' 84' ' ' LYS . . . . . . . . 0 N--CA 1.45 -0.461 0 CA-C-O 121.245 0.545 . . . . 0.0 109.968 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -47.48 -15.99 0.06 Allowed 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.616 -0.72 . . . . 0.0 109.777 179.633 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.483 ' N ' ' C ' ' A' ' 82' ' ' ALA . 99.3 mttt -64.59 -41.84 95.98 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.038 179.958 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 57.0 t-20 -65.01 -46.47 81.27 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.615 -179.625 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 5.8 tt -61.21 -41.8 97.48 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.896 -179.665 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.485 HD23 HD11 ' A' ' 90' ' ' ILE . 34.9 mt -57.01 -37.18 71.33 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.223 -0.444 . . . . 0.0 109.939 -179.565 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 87.0 mt-30 -71.29 -34.78 70.96 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.413 179.395 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -63.0 -46.6 86.89 Favored 'General case' 0 N--CA 1.462 0.158 0 C-N-CA 120.727 -0.389 . . . . 0.0 111.412 -179.163 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.485 HD11 HD23 ' A' ' 87' ' ' LEU . 17.5 pt -64.93 -44.15 96.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.891 -179.876 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 91' ' ' ALA . . . . . 0.474 ' O ' ' N ' ' A' ' 95' ' ' SER . . . -67.21 -47.68 70.15 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.955 -179.643 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 52.0 tt0 -66.85 -45.08 79.31 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.83 -179.921 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 88.9 tttt -62.87 -46.98 85.32 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.577 -179.865 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 70.0 mm-40 -90.85 2.1 56.42 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.328 -179.645 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 95' ' ' SER . . . . . 0.474 ' N ' ' O ' ' A' ' 91' ' ' ALA . 3.2 t 40.99 78.01 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.488 179.911 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 96' ' ' SER . . . . . 0.416 ' O ' ' CB ' ' A' ' 97' ' ' LEU . 67.0 p -136.44 38.59 2.68 Favored 'General case' 0 CA--C 1.513 -0.462 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.485 -179.702 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.416 ' CB ' ' O ' ' A' ' 96' ' ' SER . 3.2 tp 78.15 94.47 0.06 Allowed 'General case' 0 N--CA 1.454 -0.254 0 CA-C-O 120.896 0.379 . . . . 0.0 111.026 179.514 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.544 ' N ' HD12 ' A' ' 98' ' ' LEU . 10.8 mp -44.99 148.8 0.93 Allowed Pre-proline 0 C--N 1.326 -0.428 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.484 -179.784 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_endo -68.99 138.3 39.94 Favored 'Trans proline' 0 N--CA 1.495 1.591 0 C-N-CA 122.53 2.154 . . . . 0.0 112.174 -179.879 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 90.8 t80 -125.56 127.32 46.19 Favored 'General case' 0 CA--C 1.513 -0.463 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 179.991 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 92.8 m-85 -93.78 141.26 28.7 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.5 -179.182 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -136.7 138.0 40.57 Favored 'General case' 0 CA--C 1.514 -0.424 0 N-CA-C 110.064 -0.347 . . . . 0.0 110.064 179.619 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 25.2 m -120.31 126.6 50.94 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.455 -179.963 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -127.31 153.57 46.01 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.092 179.654 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 33.7 p -102.69 133.41 47.77 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-O 120.879 0.371 . . . . 0.0 110.196 179.836 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 50.8 p -162.7 166.36 24.51 Favored 'General case' 0 CA--C 1.515 -0.403 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.273 -179.745 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 120.58 -163.2 14.26 Favored Glycine 0 CA--C 1.527 0.79 0 N-CA-C 111.153 -0.779 . . . . 0.0 111.153 179.572 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 40.9 Cg_endo -69.53 147.42 64.28 Favored 'Trans proline' 0 N--CA 1.494 1.533 0 C-N-CA 122.59 2.193 . . . . 0.0 112.335 -179.324 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 78.8 p -68.5 -16.69 63.97 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.848 179.092 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 95.8 m-70 -86.01 -41.32 14.94 Favored 'General case' 0 CA--C 1.516 -0.364 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.181 179.998 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -126.96 78.33 74.11 Favored Pre-proline 0 N--CA 1.467 0.418 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.264 178.562 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_exo -59.92 125.68 18.33 Favored 'Trans proline' 0 C--N 1.304 -1.78 0 C-N-CA 122.465 2.11 . . . . 0.0 112.395 -179.693 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 69.1 p -111.57 173.83 6.16 Favored 'General case' 0 CA--C 1.514 -0.416 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.097 179.825 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 -132.1 146.66 52.19 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.651 -179.714 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 86.4 m -129.55 124.38 33.72 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.023 179.446 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 60.3 m -94.75 121.93 36.85 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.538 -179.953 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 117' ' ' THR . . . . . 0.427 ' CG2' ' CG2' ' A' ' 124' ' ' VAL . 81.3 m -112.92 127.29 56.16 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.218 -179.891 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 11.9 p -112.89 144.91 19.62 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.23 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.015 -179.792 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 82.9 tt0 -126.28 133.03 51.54 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.695 -179.867 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 120' ' ' PHE . . . . . 0.628 ' CZ ' ' CE1' ' A' ' 125' ' ' PHE . 48.7 p90 -166.73 157.96 12.59 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.508 179.478 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 53.38 19.98 1.81 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.871 0.367 . . . . 0.0 110.755 179.599 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 77.51 21.43 72.48 Favored Glycine 0 CA--C 1.524 0.655 0 N-CA-C 111.131 -0.788 . . . . 0.0 111.131 179.872 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -132.67 152.04 51.8 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 110.198 -0.297 . . . . 0.0 110.198 179.917 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 124' ' ' VAL . . . . . 0.49 ' O ' HG13 ' A' ' 124' ' ' VAL . 13.1 p -120.69 127.69 75.96 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.301 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.861 -179.804 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 125' ' ' PHE . . . . . 0.628 ' CE1' ' CZ ' ' A' ' 120' ' ' PHE . 53.0 m-85 -113.08 120.12 40.2 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.159 179.879 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 72.0 m -83.32 138.78 33.4 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.468 179.955 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -85.0 -169.38 45.92 Favored Glycine 0 CA--C 1.52 0.379 0 N-CA-C 110.591 -1.004 . . . . 0.0 110.591 179.871 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 128' ' ' GLU . . . . . 0.428 ' H ' ' CB ' ' A' ' 139' ' ' SER . 6.6 pt-20 -97.34 132.99 42.54 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-O 120.839 0.352 . . . . 0.0 110.95 -179.711 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 98.1 mt-10 -55.38 146.0 20.8 Favored 'General case' 0 C--N 1.32 -0.717 0 C-N-CA 120.508 -0.477 . . . . 0.0 110.484 179.522 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -169.53 160.4 9.04 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.524 -179.997 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 29.3 ttpt -91.12 32.48 1.02 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.044 0.449 . . . . 0.0 110.479 179.789 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -151.49 140.9 21.51 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.573 -179.75 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 28.6 ttmt -74.66 -47.08 33.86 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.352 179.885 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 134' ' ' LYS . . . . . 0.404 ' HG3' ' N ' ' A' ' 135' ' ' LEU . 47.1 pttt -53.7 -46.22 70.66 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.509 -179.252 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 135' ' ' LEU . . . . . 0.404 ' N ' ' HG3' ' A' ' 134' ' ' LYS . 4.7 tp -65.32 -39.44 92.45 Favored 'General case' 0 N--CA 1.444 -0.768 0 CA-C-O 120.811 0.338 . . . . 0.0 110.977 -179.678 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -57.68 -52.06 66.97 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.745 -179.311 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 69.9 mm-40 -57.85 -41.26 82.02 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.866 0.365 . . . . 0.0 110.608 -179.75 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 94.8 mtp -63.81 -41.39 97.88 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.575 -179.789 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 139' ' ' SER . . . . . 0.428 ' CB ' ' H ' ' A' ' 128' ' ' GLU . 15.2 m -64.05 -39.2 93.54 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-N 116.544 -0.298 . . . . 0.0 110.72 -179.687 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -65.69 -44.38 86.36 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.819 -179.896 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -71.74 -24.79 61.84 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.568 179.983 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 38.1 ttmt -71.24 -48.56 50.39 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.201 179.773 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 143' ' ' VAL . . . . . 0.401 HG13 ' N ' ' A' ' 144' ' ' ALA . 7.1 p -70.11 -37.81 73.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.799 -179.626 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 144' ' ' ALA . . . . . 0.401 ' N ' HG13 ' A' ' 143' ' ' VAL . . . -63.89 -47.08 82.06 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-O 120.838 0.352 . . . . 0.0 110.801 -179.764 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 145' ' ' PHE . . . . . . . . . . . . . 63.7 t80 -60.55 -43.47 97.19 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.795 179.935 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 146' ' ' MET . . . . . . . . . . . . . 63.9 ttp -60.24 -38.64 84.05 Favored 'General case' 0 C--N 1.327 -0.407 0 O-C-N 123.331 0.394 . . . . 0.0 111.077 -179.433 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 48.8 m -72.26 -42.61 65.4 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.165 179.81 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 148' ' ' ILE . . . . . . . . . . . . . 71.9 mt -54.87 -25.33 15.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.63 -179.695 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 36.6 mtmt . . . . . 0 C--N 1.319 -0.728 0 C-N-CA 120.573 -0.451 . . . . 0.0 110.556 -179.617 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 82' ' ' ALA . . . . . 0.481 ' O ' ' N ' ' A' ' 84' ' ' LYS . . . . . . . . 0 N--CA 1.45 -0.45 0 CA-C-O 120.895 0.379 . . . . 0.0 110.379 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 -46.63 -15.83 0.03 OUTLIER 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.203 179.509 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.481 ' N ' ' O ' ' A' ' 82' ' ' ALA . 63.8 mttp -64.45 -41.64 96.43 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.182 179.311 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 93.2 m-20 -65.29 -47.14 77.68 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.522 -179.33 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 7.0 tt -59.74 -43.65 94.16 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.692 -179.126 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.454 HD23 HD11 ' A' ' 90' ' ' ILE . 59.0 mt -55.93 -35.56 66.76 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.523 -179.937 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 88.9 mt-30 -70.84 -34.98 72.24 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.425 179.496 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -63.78 -48.12 78.22 Favored 'General case' 0 C--O 1.23 0.054 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.001 -178.794 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.454 HD11 HD23 ' A' ' 87' ' ' LEU . 29.8 pt -66.48 -35.09 74.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.606 179.919 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -58.05 -49.65 76.17 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.36 -179.398 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 56.8 tt0 -65.19 -44.26 88.96 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.707 -179.656 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 65.2 tttm -63.43 -47.15 83.12 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.557 -179.938 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -76.47 -0.45 23.0 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.351 -179.825 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 3.9 t 65.49 7.4 4.33 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.653 -179.813 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 26.0 m -75.15 158.03 33.69 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.483 -179.93 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.562 ' N ' HD12 ' A' ' 97' ' ' LEU . 10.2 mp -64.39 128.19 34.7 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.398 -179.789 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.574 ' N ' HD12 ' A' ' 98' ' ' LEU . 10.2 mp -50.13 148.02 6.52 Favored Pre-proline 0 N--CA 1.451 -0.396 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.609 179.764 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -71.08 142.96 43.35 Favored 'Trans proline' 0 C--N 1.311 -1.401 0 C-N-CA 122.772 2.314 . . . . 0.0 112.173 179.539 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 74.4 t80 -130.72 132.96 45.66 Favored 'General case' 0 C--O 1.233 0.237 0 N-CA-C 109.809 -0.441 . . . . 0.0 109.809 -179.994 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 39.0 m-85 -103.81 149.53 24.96 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.655 -179.734 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -150.02 92.99 1.95 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.924 0.392 . . . . 0.0 111.025 -179.908 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 103' ' ' THR . . . . . 0.479 ' H ' HG22 ' A' ' 103' ' ' THR . 0.0 OUTLIER -70.4 136.99 50.07 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.195 179.911 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -128.25 153.32 47.08 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 120.866 0.365 . . . . 0.0 110.244 179.873 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 35.0 p -103.86 135.71 44.89 Favored 'General case' 0 N--CA 1.455 -0.208 0 CA-C-O 120.912 0.387 . . . . 0.0 110.642 179.9 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 24.8 m -163.1 161.81 25.41 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.447 179.987 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 116.68 -175.07 15.55 Favored Glycine 0 CA--C 1.522 0.52 0 N-CA-C 111.035 -0.826 . . . . 0.0 111.035 179.592 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_endo -64.66 152.22 82.72 Favored 'Trans proline' 0 C--N 1.301 -1.962 0 C-N-CA 122.725 2.283 . . . . 0.0 112.251 -179.904 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 78.1 p -66.39 -19.29 65.76 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.351 178.93 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 57.7 t-80 -86.84 -43.65 12.31 Favored 'General case' 0 CA--C 1.52 -0.188 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.541 179.821 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -124.66 77.75 63.9 Favored Pre-proline 0 N--CA 1.463 0.211 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.261 179.19 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -78.94 128.5 8.44 Favored 'Trans proline' 0 C--N 1.305 -1.716 0 C-N-CA 122.595 2.197 . . . . 0.0 112.375 -179.452 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 2.9 p -109.68 173.7 6.2 Favored 'General case' 0 CA--C 1.517 -0.305 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.321 179.485 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -131.25 143.89 50.9 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.526 -179.657 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 88.3 m -127.13 125.5 41.3 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.642 179.489 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 7.3 t -97.27 120.4 37.56 Favored 'General case' 0 CA--C 1.518 -0.258 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.389 -179.958 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 94.9 m -105.93 127.37 53.09 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.163 179.916 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 8.8 p -110.2 137.14 43.82 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.271 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.272 -179.901 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 9.1 tm-20 -124.16 130.42 52.52 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.613 -179.909 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 120' ' ' PHE . . . . . 0.626 ' CZ ' ' CE1' ' A' ' 125' ' ' PHE . 45.4 p90 -164.93 158.12 16.8 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.566 179.006 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 53.61 23.42 3.56 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.606 179.819 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 73.85 22.49 78.06 Favored Glycine 0 CA--C 1.521 0.461 0 N-CA-C 110.881 -0.888 . . . . 0.0 110.881 179.874 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -133.25 153.81 51.22 Favored 'General case' 0 CA--C 1.516 -0.337 0 CA-C-O 120.889 0.376 . . . . 0.0 110.606 179.789 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 124' ' ' VAL . . . . . 0.431 ' O ' HG13 ' A' ' 124' ' ' VAL . 7.2 p -122.2 128.61 75.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.862 -179.75 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 125' ' ' PHE . . . . . 0.626 ' CE1' ' CZ ' ' A' ' 120' ' ' PHE . 26.1 m-85 -113.33 122.33 47.09 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.249 179.408 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 4.8 p -81.97 136.64 35.26 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.512 -179.898 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -88.86 -170.26 45.23 Favored Glycine 0 CA--C 1.522 0.51 0 N-CA-C 110.785 -0.926 . . . . 0.0 110.785 179.902 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 128' ' ' GLU . . . . . 0.497 ' H ' ' CB ' ' A' ' 139' ' ' SER . 14.9 tt0 -96.55 133.98 40.34 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-O 120.872 0.368 . . . . 0.0 110.71 179.581 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -58.93 149.39 27.27 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.501 179.209 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -171.17 160.78 6.46 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.613 179.982 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -86.59 33.55 0.64 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.624 179.011 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 4.6 t -158.42 150.82 21.92 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.579 179.833 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 133' ' ' LYS . . . . . 0.417 ' NZ ' ' OG1' ' A' ' 103' ' ' THR . 68.4 mttm -82.41 -21.85 35.59 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.741 179.66 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -68.92 -54.79 13.52 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.774 -179.106 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 4.3 tp -63.61 -41.67 98.3 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 116.51 -0.314 . . . . 0.0 111.046 -179.635 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -55.46 -54.91 38.0 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.497 -179.365 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -61.01 -38.31 85.64 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.46 179.847 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 48.0 ttp -62.85 -42.7 99.85 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.387 -179.512 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 139' ' ' SER . . . . . 0.497 ' CB ' ' H ' ' A' ' 128' ' ' GLU . 63.3 m -65.23 -38.65 91.05 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.893 -179.781 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -63.42 -46.44 86.36 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.962 0.411 . . . . 0.0 110.717 -179.892 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -71.21 -22.98 61.94 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.449 179.95 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 65.7 tttm -71.62 -49.27 41.72 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.327 179.674 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 143' ' ' VAL . . . . . 0.407 HG13 ' N ' ' A' ' 144' ' ' ALA . 6.4 p -67.45 -39.03 81.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.652 -179.4 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 144' ' ' ALA . . . . . 0.407 ' N ' HG13 ' A' ' 143' ' ' VAL . . . -61.96 -44.91 95.77 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.564 -179.3 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 145' ' ' PHE . . . . . . . . . . . . . 60.2 t80 -58.48 -42.74 88.2 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.522 -179.261 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 146' ' ' MET . . . . . . . . . . . . . 56.3 mtt -63.74 -39.62 94.72 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.943 -179.604 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 68.1 m -67.18 -45.69 76.19 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.974 -179.946 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 148' ' ' ILE . . . . . . . . . . . . . 81.5 mt -52.56 -36.24 21.99 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.54 -179.509 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 54.7 mtpt . . . . . 0 C--N 1.326 -0.428 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.782 -179.484 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 30.9 m . . . . . 0 N--CA 1.49 1.554 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 82' ' ' ALA . . . . . 0.489 ' O ' ' N ' ' A' ' 84' ' ' LYS . . . -153.5 96.2 2.0 Allowed 'General case' 0 N--CA 1.453 -0.296 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.548 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 1.9 m-85 -45.41 -16.37 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.336 179.887 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.489 ' N ' ' O ' ' A' ' 82' ' ' ALA . 67.8 mttm -64.41 -40.13 95.18 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.11 179.677 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 13.6 m120 -66.08 -47.47 74.13 Favored 'General case' 0 N--CA 1.457 -0.098 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.485 -179.658 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 6.5 tt -60.95 -42.06 97.49 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.549 -179.319 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 34.7 mt -55.78 -37.32 68.42 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.062 -179.576 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 86.6 mt-30 -71.32 -36.69 71.68 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.981 0.419 . . . . 0.0 110.511 179.577 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 70.6 mm-40 -59.63 -49.26 78.44 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.994 -179.222 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 30.3 pt -64.29 -32.3 56.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.637 179.576 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -55.85 -49.3 73.69 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.178 -179.404 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 59.4 tt0 -67.14 -49.76 63.71 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.914 -179.683 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 65.4 tttm -58.95 -50.78 72.78 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.534 -179.335 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' GLU . . . . . 0.467 ' O ' ' CB ' ' A' ' 95' ' ' SER . 97.6 mt-10 -69.95 -15.76 63.1 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.6 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 95' ' ' SER . . . . . 0.467 ' CB ' ' O ' ' A' ' 94' ' ' GLU . 0.7 OUTLIER 79.17 9.91 1.64 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.433 -179.731 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 20.7 m -77.61 162.86 26.74 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.531 -179.793 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.574 HD12 ' N ' ' A' ' 97' ' ' LEU . 9.7 mp -70.22 127.49 32.97 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.683 -179.959 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.593 ' N ' HD12 ' A' ' 98' ' ' LEU . 10.1 mp -45.31 120.58 4.7 Favored Pre-proline 0 N--CA 1.452 -0.358 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.488 179.756 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -49.34 149.02 9.81 Favored 'Trans proline' 0 C--N 1.308 -1.563 0 C-N-CA 122.941 2.428 . . . . 0.0 112.866 179.404 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 85.1 t80 -130.73 133.48 46.08 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-O 121.119 0.485 . . . . 0.0 110.598 -179.32 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 88.2 m-85 -96.41 143.74 27.17 Favored 'General case' 0 N--CA 1.463 0.182 0 C-N-CA 120.745 -0.382 . . . . 0.0 111.251 -179.346 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -146.41 147.58 31.42 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.999 0.428 . . . . 0.0 110.93 -179.698 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -133.55 143.31 48.63 Favored 'General case' 0 CA--C 1.516 -0.348 0 CA-C-O 120.82 0.343 . . . . 0.0 110.463 179.594 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -120.68 146.83 46.03 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 120.882 0.373 . . . . 0.0 110.342 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 21.1 p -115.4 126.96 55.03 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.51 179.767 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 47.6 t -165.46 156.2 13.71 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.58 179.879 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 127.83 166.06 11.98 Favored Glycine 0 CA--C 1.524 0.602 0 N-CA-C 111.208 -0.757 . . . . 0.0 111.208 179.678 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 108' ' ' PRO . . . . . 0.57 ' HG2' ' HB3' ' A' ' 111' ' ' ALA . 29.1 Cg_endo -61.46 152.45 72.95 Favored 'Trans proline' 0 C--N 1.301 -1.957 0 C-N-CA 122.736 2.29 . . . . 0.0 112.467 179.67 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 78.1 p -64.27 -19.65 65.54 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.279 179.509 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 70.0 m80 -90.03 -38.73 13.39 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.298 179.699 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 111' ' ' ALA . . . . . 0.57 ' HB3' ' HG2' ' A' ' 108' ' ' PRO . . . -125.21 79.0 66.61 Favored Pre-proline 0 C--O 1.234 0.268 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.216 179.581 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 112' ' ' PRO . . . . . 0.502 ' O ' HG23 ' A' ' 113' ' ' THR . 57.3 Cg_endo -76.33 158.11 37.04 Favored 'Trans proline' 0 C--N 1.3 -2.007 0 C-N-CA 122.883 2.388 . . . . 0.0 112.111 179.657 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 113' ' ' THR . . . . . 0.502 HG23 ' O ' ' A' ' 112' ' ' PRO . 25.2 p -156.48 150.96 25.57 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.612 179.648 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -133.91 147.34 51.09 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.375 179.941 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 92.3 m -129.79 124.72 34.05 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.368 179.567 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 11.2 t -99.57 125.93 45.46 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.246 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 81.2 m -122.95 136.21 54.78 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.661 -179.527 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 12.3 p -114.83 147.89 17.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 120.962 0.41 . . . . 0.0 110.322 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 85.2 tt0 -127.23 134.32 50.11 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.415 -179.9 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 120' ' ' PHE . . . . . 0.623 ' CZ ' ' CE1' ' A' ' 125' ' ' PHE . 49.6 p90 -167.84 159.95 12.0 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.336 179.431 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 54.25 20.7 2.74 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.485 179.462 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 75.62 22.37 75.27 Favored Glycine 0 CA--C 1.522 0.526 0 N-CA-C 110.767 -0.933 . . . . 0.0 110.767 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -131.94 152.5 51.04 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-O 120.876 0.369 . . . . 0.0 110.567 179.839 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 124' ' ' VAL . . . . . 0.521 ' O ' HG13 ' A' ' 124' ' ' VAL . 7.4 p -120.35 126.61 75.45 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.289 0 CA-C-O 120.916 0.388 . . . . 0.0 110.532 -179.907 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 125' ' ' PHE . . . . . 0.623 ' CE1' ' CZ ' ' A' ' 120' ' ' PHE . 35.6 m-85 -111.42 120.01 40.73 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.294 -0.412 . . . . 0.0 109.913 179.623 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 5.2 p -83.35 137.75 33.82 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.498 -179.777 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -84.71 -168.87 45.06 Favored Glycine 0 CA--C 1.521 0.423 0 N-CA-C 110.618 -0.993 . . . . 0.0 110.618 179.908 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 128' ' ' GLU . . . . . 0.585 ' H ' ' CB ' ' A' ' 139' ' ' SER . 8.4 pt-20 -98.68 132.97 43.65 Favored 'General case' 0 C--N 1.33 -0.266 0 O-C-N 122.701 -0.293 . . . . 0.0 110.699 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -54.13 144.71 18.96 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.224 179.258 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -169.76 159.92 8.36 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.319 -179.729 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 25.7 pttm -90.9 33.65 0.93 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.527 179.702 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 3.4 t -158.05 149.35 21.24 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.586 -179.612 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -79.65 -32.76 41.63 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.213 179.579 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -59.17 -52.97 63.43 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.005 -178.893 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 4.0 tp -65.32 -40.2 93.43 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.292 -179.992 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -56.35 -54.91 39.97 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.357 -179.597 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -57.92 -39.93 79.18 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.515 -179.83 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 50.7 ttp -63.47 -41.52 98.6 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.767 -179.753 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 139' ' ' SER . . . . . 0.585 ' CB ' ' H ' ' A' ' 128' ' ' GLU . 78.0 p -63.95 -35.73 81.66 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.777 -179.53 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -67.64 -47.03 70.73 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.785 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -71.24 -25.47 62.5 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.93 179.934 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -70.94 -49.36 46.44 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.184 179.832 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 143' ' ' VAL . . . . . 0.452 HG13 ' N ' ' A' ' 144' ' ' ALA . 8.3 p -68.39 -40.05 81.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.885 -179.8 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 144' ' ' ALA . . . . . 0.452 ' N ' HG13 ' A' ' 143' ' ' VAL . . . -62.21 -46.3 89.48 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.941 -179.471 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 145' ' ' PHE . . . . . . . . . . . . . 74.9 t80 -60.26 -42.08 94.58 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.925 0.393 . . . . 0.0 110.621 179.993 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 146' ' ' MET . . . . . . . . . . . . . 33.5 ttm -62.37 -39.58 93.65 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.044 -179.829 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 35.9 t -68.66 -43.45 76.16 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.99 -179.783 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 148' ' ' ILE . . . . . . . . . . . . . 85.4 mt -56.98 -29.94 32.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.796 -179.598 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 25.0 mtpp -62.67 -41.1 98.9 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.766 -179.944 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 150' ' ' ASN . . . . . . . . . . . . . 63.5 t30 -86.07 107.73 17.95 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.589 -179.916 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.221 -0.679 0 CA-C-O 117.964 -1.464 . . . . 0.0 110.969 179.971 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 55.8 t . . . . . 0 N--CA 1.49 1.539 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 82' ' ' ALA . . . . . 0.493 ' C ' ' N ' ' A' ' 84' ' ' LYS . . . -153.67 96.0 1.96 Allowed 'General case' 0 N--CA 1.451 -0.422 0 CA-C-O 121.166 0.508 . . . . 0.0 110.332 -179.8 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 3.0 m-85 -47.43 -15.5 0.05 OUTLIER 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.788 -0.642 . . . . 0.0 109.766 179.452 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.493 ' N ' ' C ' ' A' ' 82' ' ' ALA . 99.4 mttt -63.74 -39.95 95.52 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.05 179.795 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 85' ' ' ASN . . . . . 0.566 ' ND2' ' OE2' ' A' ' 89' ' ' GLU . 4.4 t30 -66.19 -46.5 77.1 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.675 -0.693 . . . . 0.0 111.049 -179.689 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 6.0 tt -60.54 -42.64 96.94 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.677 -179.547 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 56.9 mt -56.22 -35.06 66.91 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.117 179.794 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 88.6 mt-30 -74.68 -37.46 62.67 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.08 179.26 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.566 ' OE2' ' ND2' ' A' ' 85' ' ' ASN . 97.6 mt-10 -63.32 -50.34 70.43 Favored 'General case' 0 C--O 1.232 0.142 0 C-N-CA 120.776 -0.369 . . . . 0.0 111.415 -179.173 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.462 HD12 ' N ' ' A' ' 91' ' ' ALA . 2.2 pp -66.21 -41.73 89.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.304 179.78 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 91' ' ' ALA . . . . . 0.462 ' N ' HD12 ' A' ' 90' ' ' ILE . . . -57.18 -48.7 78.07 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.527 -179.871 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 88.6 mt-30 -71.8 -41.33 68.4 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.802 179.779 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 88.9 tttt -60.88 -49.27 78.13 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.551 -179.576 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' GLU . . . . . 0.429 ' C ' ' H ' ' A' ' 96' ' ' SER . 98.0 mt-10 -75.95 9.21 2.55 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.379 179.947 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 95' ' ' SER . . . . . 0.436 ' O ' ' O ' ' A' ' 96' ' ' SER . 13.9 t 55.06 9.03 0.28 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.571 179.955 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 96' ' ' SER . . . . . 0.436 ' O ' ' O ' ' A' ' 95' ' ' SER . 5.4 t -59.89 -130.82 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.226 179.724 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 92.3 mt -134.85 124.73 25.51 Favored 'General case' 0 CA--C 1.515 -0.388 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.588 179.895 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.544 ' N ' HD12 ' A' ' 98' ' ' LEU . 10.7 mp -44.94 151.29 0.65 Allowed Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.439 -179.385 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_endo -66.88 170.88 11.96 Favored 'Trans proline' 0 C--N 1.308 -1.559 0 C-N-CA 122.836 2.357 . . . . 0.0 111.931 -179.896 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 32.8 t80 -143.82 114.76 7.79 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.178 179.246 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 97.7 m-85 -96.2 129.93 43.39 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.933 0.397 . . . . 0.0 110.253 -179.948 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -147.44 147.86 30.66 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.427 -179.81 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 1.5 t -136.3 146.16 46.31 Favored 'General case' 0 CA--C 1.518 -0.252 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.563 179.866 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -121.35 146.17 47.13 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.156 179.935 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 12.1 p -114.64 126.2 54.62 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-O 120.978 0.418 . . . . 0.0 110.39 179.839 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 52.8 p -160.72 164.17 31.83 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.275 179.817 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 119.64 163.8 12.41 Favored Glycine 0 CA--C 1.525 0.698 0 N-CA-C 111.005 -0.838 . . . . 0.0 111.005 179.681 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 22.4 Cg_endo -61.15 151.75 76.6 Favored 'Trans proline' 0 C--N 1.304 -1.811 0 C-N-CA 122.938 2.425 . . . . 0.0 112.127 179.537 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 38.8 t -62.94 -19.35 64.17 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.209 179.193 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 58.3 m170 -89.39 -44.09 10.43 Favored 'General case' 0 CA--C 1.517 -0.301 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.499 179.91 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -124.56 77.56 63.21 Favored Pre-proline 0 N--CA 1.467 0.387 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.156 179.244 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 112' ' ' PRO . . . . . 0.457 ' O ' HG23 ' A' ' 113' ' ' THR . 72.9 Cg_endo -77.33 165.09 28.15 Favored 'Trans proline' 0 C--N 1.306 -1.672 0 C-N-CA 122.661 2.24 . . . . 0.0 112.367 -179.694 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 113' ' ' THR . . . . . 0.457 HG23 ' O ' ' A' ' 112' ' ' PRO . 38.8 p -156.17 151.4 26.6 Favored 'General case' 0 CA--C 1.516 -0.352 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.314 179.929 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -132.49 145.79 51.44 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.442 -179.853 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 88.7 m -133.45 128.15 34.84 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.184 -0.462 . . . . 0.0 109.991 179.63 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 27.6 t -102.19 129.76 48.66 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.471 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 65.4 m -119.09 132.63 56.03 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.032 -179.908 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 12.8 p -113.64 146.15 18.6 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.214 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.104 -179.597 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 81.2 tt0 -131.07 139.2 49.86 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.724 179.929 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 120' ' ' PHE . . . . . 0.626 ' CZ ' ' CE1' ' A' ' 125' ' ' PHE . 52.4 p90 -168.89 160.26 10.09 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.576 179.739 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 51.87 22.42 1.74 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.992 0.425 . . . . 0.0 110.683 179.697 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 75.88 22.74 73.82 Favored Glycine 0 CA--C 1.524 0.65 0 N-CA-C 111.132 -0.787 . . . . 0.0 111.132 179.825 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -132.19 151.02 52.02 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 110.089 -0.337 . . . . 0.0 110.089 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 124' ' ' VAL . . . . . 0.446 ' O ' HG13 ' A' ' 124' ' ' VAL . 6.5 p -118.23 125.06 73.99 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.225 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.93 -179.644 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 125' ' ' PHE . . . . . 0.626 ' CE1' ' CZ ' ' A' ' 120' ' ' PHE . 63.0 m-85 -110.14 117.53 33.96 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 116.185 -0.461 . . . . 0.0 109.888 179.903 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 6.0 p -80.6 132.12 35.59 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.503 -179.909 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -84.69 -167.64 43.24 Favored Glycine 0 CA--C 1.52 0.391 0 N-CA-C 110.614 -0.995 . . . . 0.0 110.614 179.689 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 128' ' ' GLU . . . . . 0.441 ' H ' ' CB ' ' A' ' 139' ' ' SER . 4.6 pt-20 -90.77 -178.6 5.3 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.835 0.35 . . . . 0.0 110.182 -179.905 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 129' ' ' GLU . . . . . 0.539 ' N ' ' OE1' ' A' ' 129' ' ' GLU . 55.1 mp0 -110.8 145.7 37.69 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.235 178.995 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -170.24 163.35 8.91 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.689 -179.936 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 62.1 mttp -85.83 35.31 0.62 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.37 179.354 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 7.5 t -157.54 150.54 23.32 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.676 179.887 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 63.2 mttp -82.06 -34.73 29.3 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.824 179.398 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 134' ' ' LYS . . . . . 0.405 ' N ' ' CD ' ' A' ' 134' ' ' LYS . 13.6 mptt -56.66 -54.34 47.18 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.84 -178.789 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 11.6 tp -63.34 -38.43 91.12 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.559 -179.696 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -58.13 -54.48 46.51 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.808 -179.574 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 81.1 mm-40 -58.75 -42.74 89.59 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.797 0.332 . . . . 0.0 110.403 -179.674 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 26.1 ttm -61.48 -41.41 97.21 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.664 179.882 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 139' ' ' SER . . . . . 0.441 ' CB ' ' H ' ' A' ' 128' ' ' GLU . 15.7 m -58.81 -39.93 82.6 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.786 -179.699 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -64.88 -42.23 95.0 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.93 0.395 . . . . 0.0 111.046 -179.897 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -69.66 -28.81 66.2 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.95 179.97 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 85.5 mttt -71.73 -49.79 36.09 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.79 179.694 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 143' ' ' VAL . . . . . 0.484 HG13 ' N ' ' A' ' 144' ' ' ALA . 7.3 p -67.34 -42.52 87.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.737 -179.581 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 144' ' ' ALA . . . . . 0.484 ' N ' HG13 ' A' ' 143' ' ' VAL . . . -63.16 -46.47 87.04 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.901 -179.81 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 145' ' ' PHE . . . . . . . . . . . . . 69.6 t80 -60.21 -42.69 95.68 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.534 -179.757 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 146' ' ' MET . . . . . . . . . . . . . 54.6 ttp -61.43 -37.57 84.01 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.631 -179.487 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 37.6 t -71.29 -44.28 65.48 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.962 0.41 . . . . 0.0 111.133 179.858 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 148' ' ' ILE . . . . . . . . . . . . . 90.6 mt -55.95 -30.44 28.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.525 -179.752 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 53.3 mtpt -62.31 -42.75 99.63 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.789 179.888 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 150' ' ' ASN . . . . . . . . . . . . . 58.3 t30 -86.97 109.99 19.74 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.388 -179.945 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.727 0 CA-C-O 117.984 -1.454 . . . . 0.0 110.854 179.96 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 4.6 m . . . . . 0 N--CA 1.49 1.528 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 82' ' ' ALA . . . . . 0.493 ' C ' ' N ' ' A' ' 84' ' ' LYS . . . -153.6 96.71 2.04 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-O 121.253 0.549 . . . . 0.0 110.187 -179.756 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 2.2 m-85 -46.46 -16.09 0.03 OUTLIER 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 115.845 -0.616 . . . . 0.0 109.929 179.633 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.493 ' N ' ' C ' ' A' ' 82' ' ' ALA . 68.4 mttm -63.9 -39.74 94.89 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.089 179.67 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 45.2 t30 -66.58 -47.07 73.92 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.679 -179.838 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 7.0 tt -61.76 -41.34 97.56 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.812 -179.905 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 32.3 mt -55.79 -36.24 67.18 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.139 -0.482 . . . . 0.0 109.856 -179.527 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 90.5 mt-30 -72.29 -36.05 68.85 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.294 179.29 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 70.3 mm-40 -60.34 -47.3 86.64 Favored 'General case' 0 C--O 1.233 0.216 0 C-N-CA 120.779 -0.368 . . . . 0.0 111.043 -179.131 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 28.0 pt -65.08 -32.89 60.23 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.499 179.869 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -55.49 -49.28 72.95 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.541 -179.604 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 27.9 mm100 -67.92 -49.46 61.74 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.301 -0.408 . . . . 0.0 111.116 179.798 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -58.88 -51.25 70.85 Favored 'General case' 0 C--N 1.331 -0.203 0 C-N-CA 120.702 -0.399 . . . . 0.0 110.786 -179.379 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 94' ' ' GLU . . . . . 0.406 ' O ' ' CB ' ' A' ' 95' ' ' SER . 80.4 mm-40 -68.97 -13.75 62.64 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.666 179.748 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 95' ' ' SER . . . . . 0.406 ' CB ' ' O ' ' A' ' 94' ' ' GLU . 1.0 OUTLIER 75.45 10.37 3.52 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.287 -179.861 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 8.6 p -79.71 166.2 22.04 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.659 -179.518 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 70.3 mt -72.7 133.8 44.76 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.932 0.396 . . . . 0.0 110.739 -179.706 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.516 ' N ' HD12 ' A' ' 98' ' ' LEU . 11.0 mp -44.81 152.92 0.51 Allowed Pre-proline 0 C--N 1.327 -0.405 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.71 -179.651 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_endo -61.17 170.0 5.55 Favored 'Trans proline' 0 N--CA 1.496 1.654 0 C-N-CA 122.847 2.365 . . . . 0.0 111.889 179.964 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 42.6 t80 -145.9 117.92 8.28 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.454 179.172 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' TYR . . . . . 0.471 ' CE2' ' NZ ' ' A' ' 84' ' ' LYS . 96.9 m-85 -102.79 136.62 42.28 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.898 0.38 . . . . 0.0 110.349 179.949 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -145.98 146.68 31.1 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.455 -179.803 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 92.2 m -124.31 130.86 53.25 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.314 179.926 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -111.35 139.8 46.45 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.529 -0.305 . . . . 0.0 110.224 179.825 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 22.7 p -117.22 122.71 44.76 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-O 121.019 0.438 . . . . 0.0 110.803 179.499 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 51.8 p -162.52 162.6 27.45 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.325 179.893 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 126.4 165.45 11.99 Favored Glycine 0 CA--C 1.523 0.54 0 N-CA-C 111.118 -0.793 . . . . 0.0 111.118 179.511 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -60.54 150.9 79.1 Favored 'Trans proline' 0 C--N 1.304 -1.796 0 C-N-CA 122.787 2.325 . . . . 0.0 112.036 179.378 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 99.0 p -63.2 -16.74 61.1 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.416 179.379 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 84.6 t60 -92.66 -43.4 9.11 Favored 'General case' 0 CA--C 1.519 -0.23 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.627 179.759 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -124.24 78.16 60.45 Favored Pre-proline 0 CA--C 1.531 0.219 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.527 179.807 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 112' ' ' PRO . . . . . 0.473 ' O ' HG23 ' A' ' 113' ' ' THR . 70.2 Cg_endo -76.43 163.22 32.49 Favored 'Trans proline' 0 C--N 1.305 -1.718 0 C-N-CA 122.669 2.246 . . . . 0.0 112.192 -179.949 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 113' ' ' THR . . . . . 0.473 HG23 ' O ' ' A' ' 112' ' ' PRO . 31.0 p -156.61 151.32 25.81 Favored 'General case' 0 CA--C 1.514 -0.431 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.132 179.375 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -131.27 144.52 51.35 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.022 -0.535 . . . . 0.0 109.734 -179.801 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 115' ' ' THR . . . . . 0.424 ' OG1' ' OE1' ' A' ' 129' ' ' GLU . 72.4 m -130.33 125.5 34.84 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.932 0.396 . . . . 0.0 110.16 179.822 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 11.7 t -96.94 122.4 39.88 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.018 179.779 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 52.2 m -114.24 130.62 56.64 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.131 179.911 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 10.8 p -113.33 143.51 22.88 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.234 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.908 -179.953 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 80.9 tt0 -128.05 135.32 49.7 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.64 179.957 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 120' ' ' PHE . . . . . 0.622 ' CZ ' ' CE1' ' A' ' 125' ' ' PHE . 52.6 p90 -167.26 158.5 11.93 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.5 179.709 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 54.64 21.56 3.51 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.857 0.361 . . . . 0.0 110.594 179.587 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 76.0 22.59 73.81 Favored Glycine 0 CA--C 1.521 0.468 0 N-CA-C 110.869 -0.893 . . . . 0.0 110.869 179.927 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -132.34 151.99 51.61 Favored 'General case' 0 C--N 1.328 -0.338 0 O-C-N 122.768 -0.254 . . . . 0.0 110.413 -179.976 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 124' ' ' VAL . . . . . 0.428 ' O ' HG13 ' A' ' 124' ' ' VAL . 7.1 p -121.34 127.77 75.8 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.555 -179.782 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 125' ' ' PHE . . . . . 0.622 ' CE1' ' CZ ' ' A' ' 120' ' ' PHE . 24.1 m-85 -113.11 120.3 40.81 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.163 179.782 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 84.4 p -81.21 136.07 35.81 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.544 179.895 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -83.82 -169.89 45.79 Favored Glycine 0 CA--C 1.524 0.629 0 N-CA-C 110.689 -0.964 . . . . 0.0 110.689 179.806 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 128' ' ' GLU . . . . . 0.491 ' H ' ' CB ' ' A' ' 139' ' ' SER . 12.2 tt0 -99.1 134.18 42.31 Favored 'General case' 0 N--CA 1.448 -0.525 0 CA-C-O 121.014 0.435 . . . . 0.0 110.715 179.596 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 129' ' ' GLU . . . . . 0.424 ' OE1' ' OG1' ' A' ' 115' ' ' THR . 70.4 mm-40 -56.06 146.05 23.9 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.385 179.109 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -169.5 159.95 8.82 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.517 -179.936 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 52.4 mtpt -88.97 33.07 0.79 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.63 179.462 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 3.6 t -158.49 150.17 21.18 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.688 179.835 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 55.8 mtmt -82.58 -21.44 35.24 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.785 179.364 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 59.5 mttp -69.59 -53.95 16.39 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.788 -179.447 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 4.1 tp -64.3 -40.24 95.54 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-O 120.789 0.328 . . . . 0.0 111.002 -179.796 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -57.29 -54.29 48.41 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.355 -179.111 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 75.8 mm-40 -56.51 -40.87 75.73 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.854 0.359 . . . . 0.0 110.512 -179.869 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 51.8 mtt -62.99 -41.39 99.55 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.967 -179.616 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 139' ' ' SER . . . . . 0.491 ' CB ' ' H ' ' A' ' 128' ' ' GLU . 68.7 m -62.92 -40.74 98.51 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 121.04 -0.264 . . . . 0.0 111.19 -179.95 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -62.37 -45.82 91.44 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.102 0.477 . . . . 0.0 110.59 -179.583 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -69.83 -25.49 63.77 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.936 179.991 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 142' ' ' LYS . . . . . 0.513 ' O ' ' SD ' ' A' ' 146' ' ' MET . 37.5 ttpt -71.43 -49.72 38.88 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.042 0.449 . . . . 0.0 111.597 -179.992 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 143' ' ' VAL . . . . . 0.424 HG13 ' N ' ' A' ' 144' ' ' ALA . 7.6 p -67.33 -39.62 83.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.067 -179.693 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 144' ' ' ALA . . . . . 0.424 ' N ' HG13 ' A' ' 143' ' ' VAL . . . -63.28 -46.48 86.62 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-N 116.339 -0.392 . . . . 0.0 111.079 -179.098 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 145' ' ' PHE . . . . . . . . . . . . . 65.6 t80 -59.84 -42.28 93.24 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.484 -0.325 . . . . 0.0 110.573 -179.71 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 146' ' ' MET . . . . . 0.581 ' SD ' ' N ' ' A' ' 146' ' ' MET . 0.0 OUTLIER -63.07 -39.34 94.44 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.764 -179.601 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 72.8 p -67.76 -42.1 82.29 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.989 -179.858 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 148' ' ' ILE . . . . . . . . . . . . . 93.3 mt -59.05 -30.85 44.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.78 -179.675 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 54.9 mtpt -62.92 -40.66 98.3 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.802 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 150' ' ' ASN . . . . . . . . . . . . . 78.5 m-20 -62.98 -40.72 98.58 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.419 -179.848 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.776 0 CA-C-O 118.018 -1.434 . . . . 0.0 110.953 179.935 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 14.4 t . . . . . 0 N--CA 1.491 1.608 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 82' ' ' ALA . . . . . 0.486 ' C ' ' N ' ' A' ' 84' ' ' LYS . . . -153.2 96.56 2.07 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-O 121.118 0.485 . . . . 0.0 109.723 -179.877 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -47.58 -16.35 0.06 Allowed 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.526 -0.761 . . . . 0.0 109.761 179.792 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.486 ' N ' ' C ' ' A' ' 82' ' ' ALA . 51.9 mtmt -63.73 -41.08 98.11 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.027 179.843 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 34.1 t30 -64.68 -47.91 76.65 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.934 -179.517 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 6.3 tt -61.92 -39.69 92.93 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.885 -179.684 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.513 HD23 HD11 ' A' ' 90' ' ' ILE . 29.9 mt -56.75 -38.71 72.8 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 -179.628 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 84.5 mt-30 -68.96 -36.2 77.64 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.682 179.214 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 80.7 mm-40 -61.74 -48.14 82.04 Favored 'General case' 0 C--O 1.232 0.154 0 C-N-CA 120.67 -0.412 . . . . 0.0 111.355 -179.066 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.513 HD11 HD23 ' A' ' 87' ' ' LEU . 27.2 pt -65.0 -35.15 74.79 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.501 179.804 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -58.83 -49.88 76.07 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.687 -179.516 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 68.4 tp60 -66.77 -47.33 72.51 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.992 -179.738 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -61.48 -47.83 83.85 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.607 -179.31 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 94' ' ' GLU . . . . . 0.432 ' O ' ' CB ' ' A' ' 95' ' ' SER . 80.3 mm-40 -71.68 -14.42 62.03 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.575 179.806 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 95' ' ' SER . . . . . 0.432 ' CB ' ' O ' ' A' ' 94' ' ' GLU . 0.7 OUTLIER 78.94 9.11 1.85 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.383 -179.996 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 17.5 m -77.81 164.39 25.25 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.504 179.918 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 69.2 mt -69.68 129.24 39.07 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.495 -179.654 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.569 ' N ' HD12 ' A' ' 98' ' ' LEU . 10.3 mp -45.63 147.93 1.4 Allowed Pre-proline 0 CA--C 1.533 0.321 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.54 -179.491 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -69.77 140.76 43.45 Favored 'Trans proline' 0 N--CA 1.494 1.513 0 C-N-CA 122.74 2.293 . . . . 0.0 111.767 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 88.9 t80 -125.95 128.77 48.03 Favored 'General case' 0 CA--C 1.511 -0.529 0 N-CA-C 108.542 -0.91 . . . . 0.0 108.542 -179.966 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 88.5 m-85 -97.51 145.32 26.34 Favored 'General case' 0 C--N 1.324 -0.53 0 C-N-CA 120.706 -0.398 . . . . 0.0 110.321 -179.07 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -144.19 145.67 32.23 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 110.174 -0.306 . . . . 0.0 110.174 179.651 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 96.8 m -125.97 132.11 52.12 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.499 179.927 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -125.45 151.85 45.69 Favored 'General case' 0 N--CA 1.467 0.391 0 N-CA-C 109.999 -0.371 . . . . 0.0 109.999 179.798 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 22.1 p -110.4 135.38 51.19 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-O 120.834 0.349 . . . . 0.0 110.258 179.85 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 30.3 p -161.33 163.06 31.02 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.26 179.903 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 120.07 -176.09 16.08 Favored Glycine 0 CA--C 1.527 0.836 0 N-CA-C 111.328 -0.709 . . . . 0.0 111.328 179.556 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -61.75 153.44 67.63 Favored 'Trans proline' 0 N--CA 1.495 1.59 0 C-N-CA 122.655 2.236 . . . . 0.0 112.276 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 6.5 m -68.3 -16.26 63.88 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.735 -0.666 . . . . 0.0 109.97 179.156 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 55.4 t-80 -90.81 -43.63 9.94 Favored 'General case' 0 CA--C 1.518 -0.253 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.442 179.774 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -124.4 78.52 61.52 Favored Pre-proline 0 CA--C 1.533 0.303 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.413 179.271 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -81.08 129.74 7.02 Favored 'Trans proline' 0 C--N 1.313 -1.31 0 C-N-CA 122.464 2.109 . . . . 0.0 112.466 179.835 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 72.2 p -111.2 173.44 6.34 Favored 'General case' 0 CA--C 1.515 -0.388 0 CA-C-N 115.885 -0.598 . . . . 0.0 109.895 179.926 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -130.81 145.19 51.91 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.444 -179.768 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 88.4 m -125.25 120.36 31.02 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.198 -0.455 . . . . 0.0 109.821 179.493 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 116' ' ' SER . . . . . 0.422 ' O ' ' HB2' ' A' ' 140' ' ' ALA . 35.9 t -95.66 122.77 38.78 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.36 -179.837 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 117' ' ' THR . . . . . 0.517 HG22 ' N ' ' A' ' 118' ' ' VAL . 54.0 m -107.17 159.89 15.99 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.029 179.937 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 118' ' ' VAL . . . . . 0.517 ' N ' HG22 ' A' ' 117' ' ' THR . 14.7 p -141.25 137.94 33.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.187 -0.46 . . . . 0.0 109.965 179.664 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 81.2 tt0 -121.82 127.15 50.23 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.634 179.848 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 120' ' ' PHE . . . . . 0.403 ' CZ ' ' CE1' ' A' ' 125' ' ' PHE . 42.1 p90 -159.6 154.57 24.82 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.519 179.225 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 52.18 25.66 3.44 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.888 0.375 . . . . 0.0 110.902 179.557 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 72.75 23.68 77.46 Favored Glycine 0 CA--C 1.522 0.501 0 N-CA-C 111.002 -0.839 . . . . 0.0 111.002 179.849 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 45.7 mmtt -130.93 150.57 52.03 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 110.224 -0.288 . . . . 0.0 110.224 -179.78 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 124' ' ' VAL . . . . . 0.431 ' O ' HG13 ' A' ' 124' ' ' VAL . 6.2 p -120.59 125.74 74.45 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.627 -179.987 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 125' ' ' PHE . . . . . 0.403 ' CE1' ' CZ ' ' A' ' 120' ' ' PHE . 41.9 m-85 -112.05 120.6 42.4 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.262 179.774 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 43.1 t -82.29 137.11 34.91 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.515 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -84.76 -169.63 46.07 Favored Glycine 0 CA--C 1.521 0.466 0 N-CA-C 110.559 -1.017 . . . . 0.0 110.559 179.802 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -99.28 136.06 39.78 Favored 'General case' 0 CA--C 1.532 0.264 0 O-C-N 122.769 -0.254 . . . . 0.0 111.068 -179.577 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 18.4 pt-20 -54.29 142.59 25.9 Favored 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 120.403 -0.519 . . . . 0.0 110.138 179.589 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -162.94 155.74 19.1 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.602 179.835 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 51.2 tttm -90.49 31.09 1.05 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.302 179.918 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 7.4 t -159.06 149.53 19.57 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.765 179.798 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -73.7 -40.61 63.48 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.188 179.388 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -53.36 -55.17 27.07 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.949 -178.75 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 12.1 tp -64.32 -39.44 93.92 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.785 0.326 . . . . 0.0 110.845 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -57.08 -55.18 38.1 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.678 -179.305 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -59.86 -42.12 92.96 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.841 0.353 . . . . 0.0 110.46 -179.54 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 41.5 tpp -60.19 -46.32 90.13 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.371 -179.606 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 37.1 m -61.3 -37.04 81.78 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.009 -179.812 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 140' ' ' ALA . . . . . 0.422 ' HB2' ' O ' ' A' ' 116' ' ' SER . . . -63.97 -47.57 79.86 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.936 0.398 . . . . 0.0 110.725 179.781 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -73.2 -23.48 60.4 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.742 179.901 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -70.81 -49.58 44.82 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.227 179.968 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 143' ' ' VAL . . . . . 0.468 HG13 ' N ' ' A' ' 144' ' ' ALA . 7.1 p -68.87 -41.49 82.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.786 -179.767 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 144' ' ' ALA . . . . . 0.468 ' N ' HG13 ' A' ' 143' ' ' VAL . . . -63.72 -46.09 86.99 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.698 -179.857 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 145' ' ' PHE . . . . . . . . . . . . . 84.7 t80 -60.56 -43.41 97.3 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.809 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 146' ' ' MET . . . . . . . . . . . . . 79.8 mmm -63.02 -37.56 87.69 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.476 -179.773 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 147' ' ' SER . . . . . 0.438 ' O ' ' OD1' ' A' ' 150' ' ' ASN . 37.8 m -72.29 -43.14 64.67 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 120.784 -0.366 . . . . 0.0 111.044 179.569 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 148' ' ' ILE . . . . . . . . . . . . . 71.5 mt -55.87 -27.3 22.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 C-N-CA 120.956 -0.298 . . . . 0.0 110.78 -179.559 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 41.6 mttt -62.12 -42.23 99.03 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 120.653 -0.419 . . . . 0.0 111.242 179.662 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 150' ' ' ASN . . . . . 0.474 ' OD1' ' N ' ' A' ' 151' ' ' GLY . 47.1 p30 -65.77 -14.77 61.99 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 120.802 -0.359 . . . . 0.0 110.634 -179.383 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 151' ' ' GLY . . . . . 0.474 ' N ' ' OD1' ' A' ' 150' ' ' ASN . . . . . . . . 0 C--O 1.221 -0.711 0 CA-C-O 117.921 -1.489 . . . . 0.0 111.097 -179.63 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 6.8 t . . . . . 0 N--CA 1.489 1.519 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 82' ' ' ALA . . . . . 0.49 ' C ' ' N ' ' A' ' 84' ' ' LYS . . . -153.37 96.04 2.0 Allowed 'General case' 0 N--CA 1.452 -0.35 0 CA-C-O 121.143 0.497 . . . . 0.0 110.019 -179.806 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -47.07 -15.75 0.04 OUTLIER 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.689 -0.687 . . . . 0.0 109.885 179.551 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.49 ' N ' ' C ' ' A' ' 82' ' ' ALA . 99.4 mttt -64.44 -40.51 95.87 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.08 179.759 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 85' ' ' ASN . . . . . 0.414 ' O ' ' OE2' ' A' ' 89' ' ' GLU . 94.5 m-20 -65.12 -47.82 75.81 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.843 -179.769 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 6.3 tt -60.68 -40.54 92.53 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.908 -179.631 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.608 HD23 HD11 ' A' ' 90' ' ' ILE . 38.2 mt -56.6 -37.68 70.98 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.269 -0.423 . . . . 0.0 109.995 -179.779 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 87.4 mt-30 -69.83 -36.97 76.03 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.429 179.526 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.521 ' OE1' ' N ' ' A' ' 89' ' ' GLU . 0.3 OUTLIER -61.63 -48.85 79.01 Favored 'General case' 0 C--O 1.233 0.22 0 C-N-CA 120.774 -0.37 . . . . 0.0 111.037 -178.932 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.608 HD11 HD23 ' A' ' 87' ' ' LEU . 19.2 pt -63.74 -40.47 89.17 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.663 -179.693 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 91' ' ' ALA . . . . . 0.401 ' N ' HG13 ' A' ' 90' ' ' ILE . . . -59.57 -48.88 79.93 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.657 -179.78 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 58.6 tt0 -68.71 -41.98 78.35 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.722 179.717 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 65.1 tttm -61.7 -49.5 76.2 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.693 -179.73 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' GLU . . . . . 0.419 ' O ' ' CB ' ' A' ' 95' ' ' SER . 98.1 mt-10 -66.6 -19.58 65.8 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.456 179.627 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 95' ' ' SER . . . . . 0.419 ' CB ' ' O ' ' A' ' 94' ' ' GLU . 1.1 t 76.02 21.21 1.58 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.013 -179.654 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 12.8 p -79.56 -114.73 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.283 -179.874 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 54.4 tp -141.03 126.55 18.83 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.398 179.747 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.561 ' N ' HD12 ' A' ' 98' ' ' LEU . 10.4 mp -44.91 143.94 2.1 Favored Pre-proline 0 C--N 1.327 -0.375 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.704 -179.503 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -70.26 139.35 38.31 Favored 'Trans proline' 0 N--CA 1.495 1.601 0 C-N-CA 122.508 2.139 . . . . 0.0 111.899 -179.897 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 86.8 t80 -128.05 129.08 46.09 Favored 'General case' 0 CA--C 1.514 -0.422 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 -179.527 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 81.6 m-85 -96.53 146.14 25.07 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.588 -179.126 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -147.35 148.14 31.04 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.242 179.967 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 1.2 t -130.67 138.22 49.94 Favored 'General case' 0 CA--C 1.519 -0.217 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.666 179.75 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -123.02 150.77 42.62 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.289 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 30.1 p -108.79 136.5 48.26 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-O 120.863 0.363 . . . . 0.0 110.152 179.757 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 38.6 t -164.01 160.97 22.4 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.22 -179.812 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 119.43 -179.13 16.67 Favored Glycine 0 CA--C 1.522 0.521 0 N-CA-C 111.21 -0.756 . . . . 0.0 111.21 179.908 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_endo -61.07 148.57 92.44 Favored 'Trans proline' 0 C--N 1.308 -1.57 0 C-N-CA 122.828 2.352 . . . . 0.0 112.139 -179.881 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 32.7 t -63.5 -16.63 61.26 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.819 -0.628 . . . . 0.0 109.872 179.124 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 61.3 t-80 -89.22 -44.0 10.59 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.396 179.872 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -125.58 77.81 68.97 Favored Pre-proline 0 N--CA 1.465 0.286 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.38 179.124 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -81.42 128.97 6.41 Favored 'Trans proline' 0 C--N 1.306 -1.677 0 C-N-CA 122.467 2.111 . . . . 0.0 112.253 179.931 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 4.4 p -108.77 173.07 6.48 Favored 'General case' 0 CA--C 1.515 -0.38 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.049 179.712 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -133.62 147.42 51.48 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.493 -179.455 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 85.6 m -129.11 123.1 31.32 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.137 179.602 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 35.0 t -96.74 125.17 41.01 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.25 -179.861 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 98.2 m -121.86 133.8 54.88 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.289 -179.74 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 13.8 p -118.51 152.3 20.66 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.208 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.255 -179.622 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -131.01 139.15 49.94 Favored 'General case' 0 CA--C 1.52 -0.185 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.592 -179.803 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 120' ' ' PHE . . . . . 0.626 ' CZ ' ' CE1' ' A' ' 125' ' ' PHE . 54.1 p90 -166.71 159.04 13.57 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.718 179.964 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 51.72 24.28 2.35 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.873 0.368 . . . . 0.0 110.519 179.701 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 73.21 23.02 78.37 Favored Glycine 0 CA--C 1.524 0.613 0 N-CA-C 111.009 -0.836 . . . . 0.0 111.009 179.829 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -131.22 150.41 52.16 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.885 0.374 . . . . 0.0 110.322 -179.893 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 124' ' ' VAL . . . . . 0.541 HG22 ' N ' ' A' ' 125' ' ' PHE . 14.9 p -104.73 160.38 5.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.792 -179.461 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 125' ' ' PHE . . . . . 0.626 ' CE1' ' CZ ' ' A' ' 120' ' ' PHE . 85.8 m-85 -153.4 108.92 3.24 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.413 179.908 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 69.1 m -84.29 142.24 30.37 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.799 -179.984 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -85.85 -167.3 43.29 Favored Glycine 0 CA--C 1.519 0.317 0 N-CA-C 110.536 -1.026 . . . . 0.0 110.536 179.783 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 128' ' ' GLU . . . . . 0.416 ' H ' ' CB ' ' A' ' 139' ' ' SER . 5.3 pt-20 -99.38 134.52 42.14 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-O 120.803 0.335 . . . . 0.0 110.902 -179.676 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 97.3 mt-10 -51.2 138.63 20.12 Favored 'General case' 0 C--N 1.322 -0.599 0 C-N-CA 120.489 -0.485 . . . . 0.0 110.296 179.642 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -160.53 155.03 23.61 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.661 -179.964 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 40.9 tttp -88.19 32.33 0.77 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.987 0.422 . . . . 0.0 110.334 179.867 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 4.9 t -160.57 153.95 22.0 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.531 179.875 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -79.68 -37.35 36.01 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.019 179.854 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -56.63 -54.41 46.35 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.991 -178.948 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 4.9 tp -63.99 -39.17 93.52 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-O 120.654 0.264 . . . . 0.0 110.76 -179.807 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -59.25 -54.44 46.82 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.712 -179.502 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 99.1 mt-10 -57.15 -44.98 83.94 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.714 0.293 . . . . 0.0 110.677 -179.535 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 72.3 mtm -62.78 -41.04 99.07 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.528 -179.75 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 139' ' ' SER . . . . . 0.416 ' CB ' ' H ' ' A' ' 128' ' ' GLU . 20.4 m -60.0 -39.26 85.15 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 120.999 -0.281 . . . . 0.0 110.585 -179.938 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -64.43 -42.29 96.1 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.962 0.41 . . . . 0.0 110.672 -179.842 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -69.49 -27.52 65.28 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.684 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 65.7 mttm -71.63 -49.85 36.17 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.379 179.83 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 143' ' ' VAL . . . . . 0.441 HG13 ' N ' ' A' ' 144' ' ' ALA . 7.5 p -67.56 -41.11 85.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.622 -179.763 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 144' ' ' ALA . . . . . 0.441 ' N ' HG13 ' A' ' 143' ' ' VAL . . . -64.01 -45.97 86.61 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.804 0.335 . . . . 0.0 110.473 -179.986 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 145' ' ' PHE . . . . . . . . . . . . . 70.9 t80 -60.89 -43.98 97.76 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.606 -179.737 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 146' ' ' MET . . . . . . . . . . . . . 48.8 ttp -60.96 -38.78 87.11 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.688 -179.653 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 147' ' ' SER . . . . . 0.424 ' O ' ' OD1' ' A' ' 150' ' ' ASN . 37.7 t -67.61 -42.27 82.65 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.927 0.394 . . . . 0.0 111.193 -179.996 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 148' ' ' ILE . . . . . . . . . . . . . 93.7 mt -60.85 -29.16 44.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.076 -179.386 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 53.6 mtpt -62.86 -43.2 99.45 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.139 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 150' ' ' ASN . . . . . 0.424 ' OD1' ' O ' ' A' ' 147' ' ' SER . 99.6 m-20 54.57 34.92 22.35 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.84 -0.344 . . . . 0.0 110.519 -179.932 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.734 0 CA-C-O 118.008 -1.44 . . . . 0.0 111.002 -179.921 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 13.6 p . . . . . 0 N--CA 1.489 1.494 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 82' ' ' ALA . . . . . 0.491 ' C ' ' N ' ' A' ' 84' ' ' LYS . . . -153.19 95.48 1.95 Allowed 'General case' 0 N--CA 1.45 -0.44 0 CA-C-O 121.135 0.493 . . . . 0.0 110.344 -179.947 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 -46.55 -15.29 0.03 OUTLIER 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.109 179.302 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.491 ' N ' ' C ' ' A' ' 82' ' ' ALA . 99.4 mttt -64.87 -40.63 95.44 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.118 179.342 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 66.3 t30 -66.11 -48.24 71.52 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.549 -0.751 . . . . 0.0 110.803 -179.632 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 6.5 tt -60.21 -42.37 94.98 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.809 -179.33 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.475 HD23 HD11 ' A' ' 90' ' ' ILE . 38.1 mt -55.7 -35.96 66.64 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.118 -179.561 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 88.7 mt-30 -71.59 -36.12 70.75 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.401 179.328 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 81.1 mm-40 -61.11 -48.96 79.25 Favored 'General case' 0 N--CA 1.462 0.146 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.793 -179.041 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.475 HD11 HD23 ' A' ' 87' ' ' LEU . 26.8 pt -66.11 -35.87 76.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.584 179.802 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -59.43 -50.34 74.31 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.518 -179.511 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 87.8 mt-30 -70.65 -43.76 68.52 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.804 179.845 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -60.32 -50.91 71.73 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.67 -179.595 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 -69.35 -2.61 11.33 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.29 179.848 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 1.5 m 62.3 16.67 8.68 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.367 -179.996 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' SER . . . . . 0.468 ' OG ' ' N ' ' A' ' 97' ' ' LEU . 66.7 p -73.08 -124.82 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.25 -179.72 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.468 ' N ' ' OG ' ' A' ' 96' ' ' SER . 89.6 mt -137.62 128.35 26.98 Favored 'General case' 0 CA--C 1.52 -0.197 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.701 -179.831 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.485 ' N ' HD12 ' A' ' 98' ' ' LEU . 11.1 mp -44.77 152.25 0.56 Allowed Pre-proline 0 N--CA 1.452 -0.332 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.714 -179.734 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -64.69 169.7 11.07 Favored 'Trans proline' 0 C--N 1.308 -1.579 0 C-N-CA 122.879 2.386 . . . . 0.0 112.194 -179.917 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 55.5 t80 -145.05 114.53 7.16 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.417 179.236 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 93.2 m-85 -99.33 133.64 43.33 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.306 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -145.5 146.51 31.49 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.405 -179.694 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 88.9 m -126.36 132.19 51.62 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.235 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -117.13 145.23 43.93 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.247 -0.433 . . . . 0.0 109.888 179.651 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 17.6 p -114.42 125.48 53.89 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-O 120.813 0.34 . . . . 0.0 110.605 179.761 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 106' ' ' SER . . . . . 0.464 ' O ' ' O ' ' A' ' 113' ' ' THR . 34.6 p -164.04 160.77 22.09 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.553 179.974 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 130.4 170.57 12.73 Favored Glycine 0 CA--C 1.52 0.372 0 N-CA-C 110.814 -0.915 . . . . 0.0 110.814 179.533 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 27.2 Cg_endo -63.31 149.1 92.16 Favored 'Trans proline' 0 C--N 1.302 -1.877 0 C-N-CA 122.772 2.314 . . . . 0.0 111.905 179.471 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 50.2 m -65.16 -16.32 63.38 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.059 -0.518 . . . . 0.0 110.07 178.965 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 52.6 t-80 -88.96 -41.94 12.08 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.354 179.366 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -126.93 78.82 73.52 Favored Pre-proline 0 N--CA 1.464 0.251 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.557 178.711 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 112' ' ' PRO . . . . . 0.482 ' O ' HG23 ' A' ' 113' ' ' THR . 24.4 Cg_exo -62.43 158.24 41.82 Favored 'Trans proline' 0 C--N 1.301 -1.958 0 C-N-CA 122.723 2.282 . . . . 0.0 112.363 -180.0 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 113' ' ' THR . . . . . 0.482 HG23 ' O ' ' A' ' 112' ' ' PRO . 23.7 p -155.83 150.97 26.6 Favored 'General case' 0 CA--C 1.517 -0.29 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.864 179.719 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -131.59 145.51 51.74 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.304 -179.955 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 99.3 m -126.11 119.72 28.3 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.561 179.338 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 59.8 p -94.23 122.0 36.32 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.351 -179.894 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 117' ' ' THR . . . . . 0.479 HG22 ' N ' ' A' ' 118' ' ' VAL . 91.5 m -105.88 157.03 17.77 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.195 179.808 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 118' ' ' VAL . . . . . 0.479 ' N ' HG22 ' A' ' 117' ' ' THR . 9.9 p -140.45 138.13 36.36 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.459 179.566 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 119' ' ' GLU . . . . . 0.428 ' OE2' ' N ' ' A' ' 123' ' ' LYS . 5.2 tm-20 -124.58 130.84 53.2 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.735 179.73 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 120' ' ' PHE . . . . . 0.622 ' CZ ' ' CE1' ' A' ' 125' ' ' PHE . 49.8 p90 -164.84 156.76 15.62 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.52 179.225 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 53.45 21.23 2.34 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.767 0.318 . . . . 0.0 110.609 179.565 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 76.56 22.32 72.92 Favored Glycine 0 CA--C 1.523 0.534 0 N-CA-C 110.983 -0.847 . . . . 0.0 110.983 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 123' ' ' LYS . . . . . 0.428 ' N ' ' OE2' ' A' ' 119' ' ' GLU . 51.8 mtpt -132.67 151.81 51.86 Favored 'General case' 0 CA--C 1.517 -0.293 0 O-C-N 122.75 -0.265 . . . . 0.0 110.487 179.832 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 124' ' ' VAL . . . . . 0.492 ' O ' HG13 ' A' ' 124' ' ' VAL . 12.7 p -122.13 128.7 75.63 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.159 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.872 -179.669 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 125' ' ' PHE . . . . . 0.622 ' CE1' ' CZ ' ' A' ' 120' ' ' PHE . 22.2 m-85 -116.05 123.27 47.51 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.3 179.707 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 66.1 m -81.99 136.11 35.3 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.486 179.893 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -80.46 -171.37 43.51 Favored Glycine 0 CA--C 1.522 0.485 0 N-CA-C 110.665 -0.974 . . . . 0.0 110.665 179.834 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 128' ' ' GLU . . . . . 0.667 ' H ' ' CB ' ' A' ' 139' ' ' SER . 13.6 tt0 -94.89 130.16 41.6 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-O 120.931 0.396 . . . . 0.0 110.668 179.643 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 129' ' ' GLU . . . . . 0.403 ' H ' ' CD ' ' A' ' 129' ' ' GLU . 56.4 mp0 -56.22 144.18 30.83 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 116.04 -0.527 . . . . 0.0 109.978 179.087 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -172.96 166.78 5.09 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.78 -179.661 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 22.6 pttp -93.3 33.38 1.22 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.567 179.022 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 132' ' ' THR . . . . . 0.436 ' HG1' ' HG2' ' A' ' 134' ' ' LYS . 0.3 OUTLIER -153.66 142.82 21.39 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.512 -179.826 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 58.1 mttp -79.27 -45.03 20.54 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.195 0.522 . . . . 0.0 110.729 179.779 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 134' ' ' LYS . . . . . 0.436 ' HG2' ' HG1' ' A' ' 132' ' ' THR . 16.3 pttp -53.63 -46.5 70.52 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.932 -179.4 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 4.4 tp -66.33 -41.84 89.02 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.677 179.871 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -60.21 -53.07 62.04 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 -179.451 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 96.1 mt-10 -54.19 -40.67 67.78 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 -179.727 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 50.1 mtt -61.34 -42.47 98.74 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.217 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 139' ' ' SER . . . . . 0.667 ' CB ' ' H ' ' A' ' 128' ' ' GLU . 90.9 p -60.09 -38.75 83.86 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.658 -179.316 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -65.54 -44.24 87.47 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.999 0.428 . . . . 0.0 110.818 -179.619 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -69.31 -30.16 68.16 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.719 -179.462 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 57.5 mttp -71.94 -51.15 23.47 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.905 0.383 . . . . 0.0 111.56 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 143' ' ' VAL . . . . . 0.54 HG13 ' N ' ' A' ' 144' ' ' ALA . 11.3 p -66.15 -43.32 92.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.555 -179.207 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 144' ' ' ALA . . . . . 0.54 ' N ' HG13 ' A' ' 143' ' ' VAL . . . -61.67 -46.15 90.96 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.625 -179.584 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 145' ' ' PHE . . . . . . . . . . . . . 64.6 t80 -60.67 -42.27 96.72 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.528 -179.598 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 146' ' ' MET . . . . . . . . . . . . . 59.6 mtt -62.8 -39.16 93.4 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.816 -179.638 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 78.1 p -69.21 -42.1 76.2 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.847 0.356 . . . . 0.0 110.904 -179.709 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 148' ' ' ILE . . . . . . . . . . . . . 87.2 mt -59.05 -29.23 40.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.769 -179.646 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 55.2 mtpt -63.73 -42.15 97.95 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.669 179.688 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 150' ' ' ASN . . . . . . . . . . . . . 91.8 m-20 -63.95 -40.45 96.46 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.508 -179.901 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.776 0 CA-C-O 118.034 -1.426 . . . . 0.0 110.939 -179.988 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 17.0 m . . . . . 0 N--CA 1.492 1.629 0 N-CA-C 109.341 -0.614 . . . . 0.0 109.341 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 82' ' ' ALA . . . . . 0.479 ' C ' ' N ' ' A' ' 84' ' ' LYS . . . -153.96 96.59 1.98 Allowed 'General case' 0 N--CA 1.448 -0.543 0 CA-C-O 121.209 0.528 . . . . 0.0 109.679 -179.965 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 2.8 m-85 -48.02 -16.58 0.09 Allowed 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.542 -0.754 . . . . 0.0 109.716 179.857 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.479 ' N ' ' C ' ' A' ' 82' ' ' ALA . 60.5 mttp -64.3 -42.73 96.23 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.479 -0.782 . . . . 0.0 109.932 179.916 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 89.5 m-20 -63.57 -45.66 89.43 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.9 -179.376 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 6.0 tt -61.21 -41.57 97.08 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.777 -179.388 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.478 HD23 HD11 ' A' ' 90' ' ' ILE . 56.3 mt -57.92 -38.11 75.28 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.111 -0.495 . . . . 0.0 109.77 179.962 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 87.4 mt-30 -70.22 -35.3 73.79 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.355 179.102 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 96.2 mt-10 -63.41 -48.58 77.22 Favored 'General case' 0 N--CA 1.462 0.161 0 C-N-CA 120.668 -0.413 . . . . 0.0 111.426 -179.022 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.478 HD11 HD23 ' A' ' 87' ' ' LEU . 15.3 pt -62.82 -44.31 99.44 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 116.449 -0.342 . . . . 0.0 110.765 -179.542 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 91' ' ' ALA . . . . . 0.482 ' O ' ' N ' ' A' ' 95' ' ' SER . . . -68.81 -45.48 71.12 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.015 -179.622 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -63.27 -47.7 81.25 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.62 -179.417 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -63.34 -42.52 98.95 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.766 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -92.81 7.56 43.23 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.449 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 95' ' ' SER . . . . . 0.482 ' N ' ' O ' ' A' ' 91' ' ' ALA . 14.2 m 39.49 47.15 1.54 Allowed 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 120.91 0.386 . . . . 0.0 110.641 -179.936 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 60.2 p -100.48 44.7 1.0 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.435 -179.273 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.563 HD12 ' N ' ' A' ' 97' ' ' LEU . 9.9 mp 64.66 93.17 0.06 Allowed 'General case' 0 N--CA 1.461 0.092 0 CA-C-O 121.042 0.449 . . . . 0.0 110.705 -179.445 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.569 ' N ' HD12 ' A' ' 98' ' ' LEU . 10.3 mp -45.59 146.69 1.7 Allowed Pre-proline 0 CA--C 1.532 0.278 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.324 -179.712 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -70.28 145.42 54.09 Favored 'Trans proline' 0 N--CA 1.493 1.452 0 C-N-CA 122.496 2.131 . . . . 0.0 111.863 -179.8 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 84.4 t80 -127.76 131.59 49.63 Favored 'General case' 0 CA--C 1.514 -0.436 0 N-CA-C 108.771 -0.825 . . . . 0.0 108.771 179.972 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 95.7 m-85 -97.52 143.18 28.48 Favored 'General case' 0 C--N 1.324 -0.521 0 C-N-CA 120.741 -0.384 . . . . 0.0 110.474 -179.191 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -143.85 145.28 32.21 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.075 179.681 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 98.6 m -122.57 127.21 49.15 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.514 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -123.24 150.91 42.86 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 110.007 -0.368 . . . . 0.0 110.007 179.785 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 35.1 p -106.85 137.42 44.92 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-O 120.761 0.315 . . . . 0.0 110.23 179.97 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 31.2 m -161.75 163.35 29.65 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.253 179.965 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 118.04 -178.34 16.84 Favored Glycine 0 CA--C 1.527 0.82 0 N-CA-C 111.281 -0.728 . . . . 0.0 111.281 179.535 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 108' ' ' PRO . . . . . 0.637 ' HG2' ' HB3' ' A' ' 111' ' ' ALA . 19.7 Cg_endo -61.4 154.42 59.01 Favored 'Trans proline' 0 N--CA 1.497 1.715 0 C-N-CA 122.702 2.268 . . . . 0.0 112.337 179.964 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 28.3 m -67.68 -18.16 64.83 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.627 -0.715 . . . . 0.0 109.978 179.29 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 94.9 m-70 -91.95 -36.54 13.38 Favored 'General case' 0 CA--C 1.52 -0.179 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.164 179.735 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 111' ' ' ALA . . . . . 0.637 ' HB3' ' HG2' ' A' ' 108' ' ' PRO . . . -124.21 79.77 59.31 Favored Pre-proline 0 CA--C 1.538 0.519 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.077 179.232 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -81.45 121.39 3.81 Favored 'Trans proline' 0 N--CA 1.489 1.24 0 C-N-CA 122.481 2.121 . . . . 0.0 112.194 -179.917 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 4.9 p -109.26 172.8 6.64 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.004 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 -132.2 146.76 52.24 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.167 -179.765 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 88.5 m -131.52 126.95 36.22 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.152 -0.476 . . . . 0.0 109.86 179.138 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 68.2 m -94.4 121.23 35.71 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.367 -179.834 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 117' ' ' THR . . . . . 0.421 ' CG2' ' CG2' ' A' ' 124' ' ' VAL . 98.6 m -108.95 125.33 51.92 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.385 -179.869 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 11.0 p -110.55 139.66 33.12 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.3 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.004 -179.945 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 84.1 tt0 -123.25 130.35 52.63 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.619 179.925 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 120' ' ' PHE . . . . . 0.584 ' CZ ' ' CE1' ' A' ' 125' ' ' PHE . 47.7 p90 -163.72 157.45 19.13 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.533 179.214 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 52.59 21.85 1.98 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.788 0.328 . . . . 0.0 110.86 179.503 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 75.7 21.89 76.0 Favored Glycine 0 CA--C 1.523 0.568 0 N-CA-C 111.185 -0.766 . . . . 0.0 111.185 179.836 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 61.0 mttp -131.66 151.2 51.81 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 120.723 0.297 . . . . 0.0 110.303 179.898 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 124' ' ' VAL . . . . . 0.457 ' O ' HG13 ' A' ' 124' ' ' VAL . 13.6 p -123.03 129.77 74.86 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.27 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.763 -179.572 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 125' ' ' PHE . . . . . 0.584 ' CE1' ' CZ ' ' A' ' 120' ' ' PHE . 18.5 m-85 -117.56 123.34 46.01 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.167 179.979 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 12.3 p -83.66 141.55 31.42 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.594 -179.976 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -86.18 -169.62 46.12 Favored Glycine 0 CA--C 1.523 0.584 0 N-CA-C 110.704 -0.959 . . . . 0.0 110.704 179.847 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 128' ' ' GLU . . . . . 0.626 ' H ' ' CB ' ' A' ' 139' ' ' SER . 5.8 pt-20 -93.86 128.89 40.38 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-O 120.765 0.317 . . . . 0.0 111.056 -179.564 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -55.15 144.14 25.11 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 120.45 -0.5 . . . . 0.0 110.172 179.703 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -170.63 163.67 8.18 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.931 179.837 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 31.0 mtmm -89.71 32.84 0.86 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.366 179.226 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 4.0 t -156.43 149.5 24.16 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.601 179.493 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 58.8 mttp -80.57 -31.8 36.76 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.921 179.708 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 134' ' ' LYS . . . . . 0.496 ' O ' ' SD ' ' A' ' 138' ' ' MET . 25.9 mtpp -59.19 -51.18 71.09 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.038 -178.901 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 11.6 tp -64.76 -39.3 93.4 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-O 120.838 0.351 . . . . 0.0 110.936 -179.654 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -59.36 -54.81 42.48 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.8 -179.351 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 80.6 mm-40 -58.15 -43.61 87.46 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 120.847 -0.341 . . . . 0.0 110.436 -179.382 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 138' ' ' MET . . . . . 0.571 ' N ' ' SD ' ' A' ' 138' ' ' MET . 0.0 OUTLIER -62.02 -41.98 98.67 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.458 -179.979 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 139' ' ' SER . . . . . 0.626 ' CB ' ' H ' ' A' ' 128' ' ' GLU . 77.4 p -65.06 -36.16 83.48 Favored 'General case' 0 C--N 1.329 -0.317 0 C-N-CA 120.922 -0.311 . . . . 0.0 111.022 -179.934 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -65.83 -47.32 75.38 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.047 0.451 . . . . 0.0 110.645 179.94 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -71.7 -24.41 61.81 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.738 -179.907 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -70.62 -49.35 48.53 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.246 179.812 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 143' ' ' VAL . . . . . 0.405 HG13 ' N ' ' A' ' 144' ' ' ALA . 7.1 p -68.37 -38.9 80.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.88 -179.545 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 144' ' ' ALA . . . . . 0.405 ' N ' HG13 ' A' ' 143' ' ' VAL . . . -64.08 -44.95 90.8 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.82 0.343 . . . . 0.0 110.95 -179.612 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 145' ' ' PHE . . . . . . . . . . . . . 64.7 t80 -57.11 -44.21 83.03 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.472 -179.713 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 146' ' ' MET . . . . . . . . . . . . . 63.3 mtt -63.79 -38.98 93.13 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.88 179.907 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 78.0 p -67.91 -44.98 75.68 Favored 'General case' 0 C--N 1.332 -0.189 0 C-N-CA 120.702 -0.399 . . . . 0.0 110.936 -179.752 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 148' ' ' ILE . . . . . . . . . . . . . 82.2 mt -52.1 -39.14 25.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.085 -179.521 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 32.6 mttm -62.59 -42.17 99.4 Favored 'General case' 0 C--N 1.326 -0.444 0 C-N-CA 120.593 -0.443 . . . . 0.0 110.932 179.424 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 150' ' ' ASN . . . . . . . . . . . . . 41.8 t30 -62.96 -40.64 98.31 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.383 -0.372 . . . . 0.0 110.555 -179.881 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.768 0 CA-C-O 118.003 -1.443 . . . . 0.0 111.0 179.929 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 34.0 m . . . . . 0 N--CA 1.489 1.523 0 N-CA-C 109.241 -0.651 . . . . 0.0 109.241 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 82' ' ' ALA . . . . . 0.477 ' C ' ' N ' ' A' ' 84' ' ' LYS . . . -153.8 96.63 2.01 Favored 'General case' 0 N--CA 1.447 -0.576 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 179.925 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 3.9 m-85 -48.56 -15.77 0.09 Allowed 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.515 -0.766 . . . . 0.0 109.575 179.709 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.477 ' N ' ' C ' ' A' ' 82' ' ' ALA . 99.6 mttt -63.02 -39.47 94.84 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.758 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 93.0 m-20 -63.1 -44.84 94.54 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.739 -179.912 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 7.2 tt -71.92 -33.72 68.49 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.667 -179.515 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 17.7 mt -59.63 -41.71 91.07 Favored 'General case' 0 CA--C 1.52 -0.206 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.424 -178.839 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 10.5 pt20 -73.04 -29.43 62.98 Favored 'General case' 0 C--N 1.316 -0.866 0 C-N-CA 120.424 -0.51 . . . . 0.0 110.509 179.191 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 92.2 mt-10 -65.71 -42.87 90.63 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 120.693 -0.403 . . . . 0.0 111.251 -179.809 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 29.2 pt -72.13 -35.26 52.67 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.882 179.698 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -55.68 -49.53 72.7 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.937 -179.215 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 13.5 pt20 -67.96 -38.05 82.29 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.526 179.557 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 64.1 tttp -62.66 -47.72 82.46 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.384 -179.894 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 72.2 mm-40 -76.39 -2.83 33.77 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.494 -179.755 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 74.64 4.62 4.41 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.08 -0.509 . . . . 0.0 109.916 -179.724 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 18.9 m -74.17 162.71 28.68 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.287 179.89 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.559 ' N ' HD12 ' A' ' 97' ' ' LEU . 10.5 mp -73.16 132.57 43.4 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.952 0.406 . . . . 0.0 110.052 -179.73 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.546 ' N ' HD12 ' A' ' 98' ' ' LEU . 10.6 mp -45.63 149.21 1.12 Allowed Pre-proline 0 CA--C 1.534 0.336 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.68 -179.618 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -72.55 143.52 38.44 Favored 'Trans proline' 0 N--CA 1.49 1.315 0 C-N-CA 122.681 2.254 . . . . 0.0 111.59 179.881 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 87.7 t80 -127.57 130.47 49.13 Favored 'General case' 0 CA--C 1.511 -0.545 0 N-CA-C 108.542 -0.911 . . . . 0.0 108.542 179.956 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 76.3 m-85 -100.15 147.32 25.82 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 110.012 -0.366 . . . . 0.0 110.012 -179.092 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -146.17 146.89 31.0 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.379 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 99.8 m -121.57 128.14 51.68 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.368 179.732 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -116.27 144.13 44.62 Favored 'General case' 0 N--CA 1.467 0.389 0 N-CA-C 109.93 -0.396 . . . . 0.0 109.93 179.737 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 30.2 p -106.75 134.85 49.27 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 109.97 -0.382 . . . . 0.0 109.97 179.775 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 41.0 t -164.42 162.12 21.88 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.148 179.926 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 122.7 -177.87 16.45 Favored Glycine 0 CA--C 1.528 0.876 0 N-CA-C 111.268 -0.733 . . . . 0.0 111.268 179.459 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 108' ' ' PRO . . . . . 0.598 ' HG2' ' HB3' ' A' ' 111' ' ' ALA . 23.4 Cg_endo -61.3 150.33 85.29 Favored 'Trans proline' 0 N--CA 1.497 1.718 0 C-N-CA 122.789 2.326 . . . . 0.0 112.317 179.902 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 36.9 t -63.99 -18.24 64.1 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.702 -0.681 . . . . 0.0 109.794 179.076 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 73.9 m80 -91.27 -38.19 12.82 Favored 'General case' 0 CA--C 1.518 -0.263 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.285 179.804 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 111' ' ' ALA . . . . . 0.598 ' HB3' ' HG2' ' A' ' 108' ' ' PRO . . . -123.96 79.61 57.73 Favored Pre-proline 0 CA--C 1.538 0.508 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.185 179.463 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -80.8 122.07 4.28 Favored 'Trans proline' 0 N--CA 1.491 1.338 0 C-N-CA 122.619 2.213 . . . . 0.0 112.15 179.68 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 3.5 p -109.12 171.26 7.54 Favored 'General case' 0 CA--C 1.517 -0.307 0 CA-C-N 115.646 -0.706 . . . . 0.0 109.978 -179.961 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -133.89 148.56 51.25 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.182 -179.702 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 94.8 m -129.73 126.61 38.64 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.104 179.398 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 11.2 t -96.39 121.47 38.23 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.276 179.829 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 117' ' ' THR . . . . . 0.439 ' CG2' ' CG2' ' A' ' 124' ' ' VAL . 70.8 m -112.86 130.35 56.13 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.017 -179.913 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 7.7 p -113.73 141.8 28.48 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.357 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.03 -179.748 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 79.0 tt0 -125.14 131.86 53.18 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.49 -179.764 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 120' ' ' PHE . . . . . 0.625 ' CZ ' ' CE1' ' A' ' 125' ' ' PHE . 48.4 p90 -166.63 159.51 14.18 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.435 179.372 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 53.32 19.05 1.44 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.8 0.333 . . . . 0.0 110.904 179.711 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 78.24 20.0 73.32 Favored Glycine 0 CA--C 1.525 0.687 0 N-CA-C 111.323 -0.711 . . . . 0.0 111.323 179.617 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -132.13 152.91 50.99 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.806 0.336 . . . . 0.0 110.408 179.872 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 124' ' ' VAL . . . . . 0.482 ' O ' HG13 ' A' ' 124' ' ' VAL . 14.9 p -121.38 127.88 75.8 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.288 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.713 -179.904 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 125' ' ' PHE . . . . . 0.625 ' CE1' ' CZ ' ' A' ' 120' ' ' PHE . 36.8 m-85 -111.38 120.55 42.58 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.346 179.911 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 5.7 m -78.8 129.24 34.39 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.283 179.707 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -84.05 -173.25 49.66 Favored Glycine 0 CA--C 1.521 0.444 0 N-CA-C 111.139 -0.785 . . . . 0.0 111.139 -179.938 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 128' ' ' GLU . . . . . 0.446 ' CG ' ' N ' ' A' ' 129' ' ' GLU . 69.1 tt0 -77.75 165.89 23.64 Favored 'General case' 0 N--CA 1.442 -0.842 0 CA-C-O 120.671 0.272 . . . . 0.0 110.443 179.894 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 129' ' ' GLU . . . . . 0.446 ' N ' ' CG ' ' A' ' 128' ' ' GLU . 18.7 pt-20 -105.94 140.7 38.55 Favored 'General case' 0 C--N 1.332 -0.168 0 N-CA-C 109.879 -0.415 . . . . 0.0 109.879 179.106 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -171.57 166.48 6.75 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.86 179.596 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -86.12 35.36 0.64 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.041 179.065 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 4.3 t -152.47 144.77 23.97 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.844 179.772 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -82.54 -21.95 35.17 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.965 179.44 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 56.3 mtpt -68.79 -54.49 15.56 Favored 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 120.632 -0.427 . . . . 0.0 111.208 -179.278 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 3.6 tp -64.02 -38.9 92.77 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.959 -179.504 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -58.91 -54.64 44.83 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.67 -179.527 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 81.0 mm-40 -60.07 -43.03 95.75 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.866 0.365 . . . . 0.0 110.766 -179.777 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 60.3 mtt -61.77 -41.88 98.27 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.319 -179.509 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 37.8 m -65.07 -36.61 84.87 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.014 179.775 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -63.32 -46.37 86.95 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 121.046 0.45 . . . . 0.0 110.524 -179.962 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -70.21 -24.25 63.08 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.686 179.849 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 38.7 ttmt -70.76 -49.94 41.36 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.29 -0.413 . . . . 0.0 111.276 179.711 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 143' ' ' VAL . . . . . 0.407 HG13 ' N ' ' A' ' 144' ' ' ALA . 7.1 p -67.98 -40.9 84.07 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.151 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.019 -179.501 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 144' ' ' ALA . . . . . 0.407 ' N ' HG13 ' A' ' 143' ' ' VAL . . . -62.29 -45.79 91.67 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.935 0.398 . . . . 0.0 110.526 -179.997 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 145' ' ' PHE . . . . . . . . . . . . . 69.8 t80 -59.19 -44.33 92.21 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.564 -179.656 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 146' ' ' MET . . . . . . . . . . . . . 64.1 ttp -61.68 -39.1 90.22 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.965 -179.711 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 11.7 t -67.34 -44.33 79.34 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 120.743 -0.383 . . . . 0.0 110.873 179.844 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 148' ' ' ILE . . . . . . . . . . . . . 94.2 mt -57.72 -29.57 35.23 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.204 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.994 -179.642 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 25.8 mtpp -64.54 -8.57 14.45 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.51 179.87 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 150' ' ' ASN . . . . . 0.477 ' OD1' ' N ' ' A' ' 151' ' ' GLY . 35.9 p-10 -63.36 -39.67 95.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.499 -179.962 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 151' ' ' GLY . . . . . 0.477 ' N ' ' OD1' ' A' ' 150' ' ' ASN . . . . . . . . 0 C--O 1.22 -0.723 0 CA-C-O 117.972 -1.46 . . . . 0.0 110.935 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 6.5 t . . . . . 0 N--CA 1.49 1.574 0 N-CA-C 109.406 -0.591 . . . . 0.0 109.406 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 82' ' ' ALA . . . . . 0.485 ' O ' ' N ' ' A' ' 84' ' ' LYS . . . -152.71 95.73 2.03 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.528 179.96 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 2.1 m-85 -46.05 -15.89 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.27 179.709 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.485 ' N ' ' O ' ' A' ' 82' ' ' ALA . 99.4 mttt -64.79 -40.75 95.76 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.447 179.266 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 38.8 t30 -64.92 -44.69 88.71 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.63 -179.91 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 5.3 tt -60.03 -43.36 95.34 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.588 -179.304 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.432 HD23 HD11 ' A' ' 90' ' ' ILE . 74.0 mt -56.25 -37.74 70.19 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.402 179.976 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 88.4 mt-30 -70.8 -35.26 72.46 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.578 179.651 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 79.9 mm-40 -62.27 -48.43 79.93 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.807 -179.169 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.435 HG13 ' N ' ' A' ' 91' ' ' ALA . 19.9 pt -65.13 -41.34 91.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.655 -179.52 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 91' ' ' ALA . . . . . 0.519 ' O ' ' N ' ' A' ' 95' ' ' SER . . . -68.85 -49.9 54.45 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.852 -179.464 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 84.4 mt-30 -65.01 -45.68 84.5 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.865 -179.604 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 88.9 tttt -60.02 -47.35 86.19 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.562 -179.77 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 94' ' ' GLU . . . . . 0.408 ' O ' ' C ' ' A' ' 95' ' ' SER . 96.4 mt-10 -96.03 10.15 38.43 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.544 -179.928 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 95' ' ' SER . . . . . 0.519 ' N ' ' O ' ' A' ' 91' ' ' ALA . 13.9 t 39.24 40.84 0.56 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.47 -179.754 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 96' ' ' SER . . . . . 0.44 ' O ' ' CB ' ' A' ' 97' ' ' LEU . 44.7 m -87.47 33.26 0.69 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.653 -179.436 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.44 ' CB ' ' O ' ' A' ' 96' ' ' SER . 2.6 tp 76.93 100.58 0.07 Allowed 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.866 179.907 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.509 ' N ' HD12 ' A' ' 98' ' ' LEU . 11.0 mp -44.21 152.02 0.51 Allowed Pre-proline 0 C--N 1.325 -0.474 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.431 179.817 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_endo -65.86 171.16 10.28 Favored 'Trans proline' 0 C--N 1.304 -1.77 0 C-N-CA 122.951 2.434 . . . . 0.0 111.998 179.611 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 31.8 t80 -144.62 117.2 8.62 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.7 179.6 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 93.4 m-85 -96.95 129.03 44.47 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.505 -179.929 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -147.68 148.16 30.74 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.478 -179.781 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 1.5 t -135.26 145.21 47.36 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.63 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -129.39 153.93 47.42 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.521 -179.925 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 16.2 p -110.28 138.43 46.67 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.576 179.631 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 40.3 t -163.5 153.62 15.48 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.664 179.804 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 125.65 -175.94 17.41 Favored Glycine 0 CA--C 1.524 0.612 0 N-CA-C 111.039 -0.824 . . . . 0.0 111.039 179.643 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 25.9 Cg_endo -62.45 150.46 87.32 Favored 'Trans proline' 0 C--N 1.303 -1.824 0 C-N-CA 122.785 2.323 . . . . 0.0 112.278 -179.883 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 37.1 t -65.05 -16.09 63.07 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.36 179.038 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 49.6 t-80 -90.51 -43.43 10.24 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.472 179.646 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -126.21 77.2 72.12 Favored Pre-proline 0 CA--C 1.53 0.178 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.21 179.213 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -80.62 126.52 6.02 Favored 'Trans proline' 0 C--N 1.303 -1.847 0 C-N-CA 122.611 2.208 . . . . 0.0 112.261 -179.588 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 5.6 p -103.97 170.89 7.65 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.362 179.609 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -133.46 146.71 51.4 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.589 -179.665 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 86.9 m -127.82 122.42 32.63 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.434 179.733 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 25.4 m -96.06 122.55 39.0 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.013 0.435 . . . . 0.0 110.556 -179.758 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 57.5 m -112.29 128.13 56.18 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.514 -179.894 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 8.6 p -110.42 140.82 27.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.506 179.928 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -127.27 136.78 52.45 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.566 179.99 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 120' ' ' PHE . . . . . 0.619 ' CZ ' ' CE1' ' A' ' 125' ' ' PHE . 50.7 p90 -170.15 160.2 7.86 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.385 179.85 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 51.56 21.38 1.27 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.511 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 77.08 21.22 74.25 Favored Glycine 0 CA--C 1.522 0.503 0 N-CA-C 111.098 -0.801 . . . . 0.0 111.098 179.732 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -131.99 151.59 51.64 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.786 0.327 . . . . 0.0 110.614 179.909 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 124' ' ' VAL . . . . . 0.447 ' O ' HG13 ' A' ' 124' ' ' VAL . 8.5 p -121.38 127.84 75.79 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-O 120.965 0.412 . . . . 0.0 110.842 -179.65 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 125' ' ' PHE . . . . . 0.619 ' CE1' ' CZ ' ' A' ' 120' ' ' PHE . 26.4 m-85 -112.63 120.48 41.69 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.367 179.56 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 43.5 t -80.09 132.16 35.9 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.707 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -80.26 -172.42 44.68 Favored Glycine 0 CA--C 1.525 0.688 0 N-CA-C 110.77 -0.932 . . . . 0.0 110.77 179.808 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 128' ' ' GLU . . . . . 0.42 ' O ' ' CG ' ' A' ' 128' ' ' GLU . 8.9 pt-20 -96.46 131.69 42.78 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.612 0.244 . . . . 0.0 110.475 -179.833 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -54.06 142.09 26.38 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.373 179.541 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -165.43 157.9 15.46 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.559 179.993 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 51.0 tttm -86.65 33.56 0.64 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.597 179.704 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 4.8 t -159.64 152.19 21.3 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.509 -179.712 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -81.84 -33.56 30.6 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.001 0.429 . . . . 0.0 110.978 179.896 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -58.28 -54.25 49.16 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.892 -178.978 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 4.0 tp -65.08 -38.75 91.78 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.66 179.938 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -57.7 -55.03 40.2 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.833 -179.358 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -60.84 -41.59 96.09 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.434 -179.752 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 78.9 mmm -62.61 -41.39 98.95 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.552 -179.472 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 20.2 m -64.4 -38.46 91.1 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.632 -179.946 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -64.73 -43.77 92.33 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.595 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -72.21 -24.99 61.48 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.456 179.671 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 63.0 tttp -70.31 -47.16 62.41 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.046 -179.935 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 7.7 p -70.55 -37.34 69.58 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.83 -179.542 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -64.06 -46.3 84.96 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.662 -179.857 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 145' ' ' PHE . . . . . . . . . . . . . 66.0 t80 -58.33 -43.44 88.25 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.553 -179.734 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 146' ' ' MET . . . . . . . . . . . . . 59.2 ttp -61.06 -37.41 82.54 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.577 -179.536 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 35.8 t -70.55 -45.59 65.17 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.955 -179.86 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 148' ' ' ILE . . . . . . . . . . . . . 93.9 mt -55.01 -31.52 25.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.617 -179.459 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 10.2 mtpm? -61.62 -41.6 97.7 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.671 179.752 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 150' ' ' ASN . . . . . . . . . . . . . 33.8 t30 41.12 -103.75 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.722 -179.98 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.219 -0.795 0 CA-C-O 118.0 -1.445 . . . . 0.0 110.923 -179.957 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 15.0 t . . . . . 0 N--CA 1.49 1.535 0 N-CA-C 109.365 -0.606 . . . . 0.0 109.365 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 82' ' ' ALA . . . . . 0.486 ' O ' ' N ' ' A' ' 84' ' ' LYS . . . -153.37 95.79 1.97 Allowed 'General case' 0 N--CA 1.451 -0.404 0 CA-C-O 121.06 0.457 . . . . 0.0 110.318 -179.975 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 2.1 m-85 -46.13 -15.87 0.03 OUTLIER 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.172 179.728 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.486 ' N ' ' O ' ' A' ' 82' ' ' ALA . 65.0 mttp -63.67 -40.26 96.39 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.169 179.509 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 63.6 t30 -65.95 -48.78 70.19 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.777 -179.467 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 6.4 tt -60.8 -40.98 94.68 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.791 -179.5 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.496 HD23 HD11 ' A' ' 90' ' ' ILE . 34.3 mt -56.11 -36.8 68.6 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.295 -179.591 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 89.4 mt-30 -69.81 -35.69 75.04 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.57 179.432 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 14.6 mm-40 -61.71 -49.7 75.41 Favored 'General case' 0 C--N 1.333 -0.11 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.107 -178.836 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.496 HD11 HD23 ' A' ' 87' ' ' LEU . 28.6 pt -65.02 -34.46 70.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.633 179.916 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -54.61 -50.44 68.05 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.529 -179.335 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 78.7 mt-30 -65.32 -42.32 93.09 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.851 -179.944 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 69.2 mmtt -61.35 -47.42 85.97 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.549 -179.512 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 80.9 mm-40 -68.15 -20.16 64.86 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.419 179.943 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 1.2 t 72.76 19.67 3.88 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.596 -179.825 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 75.3 m -80.43 -117.4 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.242 -179.898 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 40.9 tp -143.27 125.27 15.26 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.652 179.691 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.607 ' N ' HD12 ' A' ' 98' ' ' LEU . 9.9 mp -44.36 142.65 2.24 Favored Pre-proline 0 N--CA 1.452 -0.359 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.871 -179.812 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_endo -69.63 145.42 57.84 Favored 'Trans proline' 0 C--N 1.311 -1.442 0 C-N-CA 122.524 2.149 . . . . 0.0 112.008 -179.781 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 92.6 t80 -127.2 128.73 46.57 Favored 'General case' 0 C--O 1.235 0.321 0 N-CA-C 109.544 -0.539 . . . . 0.0 109.544 179.643 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 85.6 m-85 -96.23 144.48 26.39 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.939 -179.596 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -143.74 145.4 32.37 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.439 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 98.0 m -122.83 127.67 49.37 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.466 -179.913 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -105.5 135.22 47.28 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.174 179.78 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 18.8 p -114.42 119.29 36.38 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-O 120.876 0.369 . . . . 0.0 110.414 179.592 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 11.4 p -160.66 163.96 32.11 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.403 179.934 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 122.24 168.78 13.34 Favored Glycine 0 CA--C 1.523 0.536 0 N-CA-C 110.888 -0.885 . . . . 0.0 110.888 179.659 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 24.9 Cg_endo -62.43 151.02 85.26 Favored 'Trans proline' 0 C--N 1.301 -1.928 0 C-N-CA 122.78 2.32 . . . . 0.0 112.143 179.63 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 77.7 p -63.99 -17.58 63.44 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.327 179.002 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 66.0 m80 -90.42 -43.14 10.49 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.501 179.628 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -125.04 78.02 66.58 Favored Pre-proline 0 N--CA 1.464 0.243 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.357 179.637 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 112' ' ' PRO . . . . . 0.493 ' O ' HG23 ' A' ' 113' ' ' THR . 56.8 Cg_endo -76.28 164.44 31.01 Favored 'Trans proline' 0 C--N 1.303 -1.866 0 C-N-CA 122.711 2.274 . . . . 0.0 112.279 -179.995 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 113' ' ' THR . . . . . 0.493 HG23 ' O ' ' A' ' 112' ' ' PRO . 33.8 p -156.83 152.01 26.33 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.641 179.555 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -131.68 144.14 50.79 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.335 -179.628 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 93.0 m -130.33 125.73 35.42 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.46 179.438 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 46.1 t -97.19 122.91 40.74 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.612 -179.827 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 117' ' ' THR . . . . . 0.408 ' CG2' ' CG2' ' A' ' 124' ' ' VAL . 54.3 m -114.81 131.45 56.81 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.357 -179.834 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 9.9 p -111.75 141.83 26.01 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.285 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.267 -179.949 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 79.3 tt0 -125.79 133.77 51.92 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.623 -179.672 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 120' ' ' PHE . . . . . 0.627 ' CZ ' ' CE1' ' A' ' 125' ' ' PHE . 45.9 p90 -166.53 157.56 12.68 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.368 179.466 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 52.61 24.86 3.33 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.518 179.719 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 72.64 22.82 78.78 Favored Glycine 0 CA--C 1.521 0.466 0 N-CA-C 111.083 -0.807 . . . . 0.0 111.083 179.913 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 62.9 mttp -131.66 151.66 51.45 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.807 0.337 . . . . 0.0 110.331 179.826 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 124' ' ' VAL . . . . . 0.464 ' O ' HG13 ' A' ' 124' ' ' VAL . 12.2 p -122.21 128.47 75.53 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.227 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.768 -179.7 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 125' ' ' PHE . . . . . 0.627 ' CE1' ' CZ ' ' A' ' 120' ' ' PHE . 27.0 m-85 -112.93 123.35 50.12 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.434 179.919 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 4.2 p -79.37 126.76 31.23 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.195 179.843 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -82.65 -172.53 48.32 Favored Glycine 0 CA--C 1.525 0.676 0 N-CA-C 110.97 -0.852 . . . . 0.0 110.97 -179.664 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 128' ' ' GLU . . . . . 0.459 ' CG ' ' N ' ' A' ' 129' ' ' GLU . 67.5 tt0 -78.7 167.09 21.73 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-O 120.759 0.314 . . . . 0.0 110.491 179.972 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 129' ' ' GLU . . . . . 0.459 ' N ' ' CG ' ' A' ' 128' ' ' GLU . 3.0 pp20? -109.61 145.31 36.64 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.979 0.419 . . . . 0.0 110.343 178.952 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -174.19 170.41 3.72 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.617 179.663 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -86.28 36.13 0.68 Allowed 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.238 178.849 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 5.1 t -156.41 148.66 23.33 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.893 0.378 . . . . 0.0 110.538 -179.637 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -82.54 -33.14 28.28 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.103 179.591 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 69.5 mmtt -58.82 -52.66 64.76 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.01 -178.213 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 10.3 tp -63.78 -39.76 95.03 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.466 -0.333 . . . . 0.0 110.973 -179.531 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -60.31 -54.78 41.57 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.53 -179.142 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -59.19 -44.43 92.19 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.708 -179.456 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 38.3 ttm -60.63 -41.8 95.64 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.478 -179.775 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 139' ' ' SER . . . . . 0.413 ' CB ' ' H ' ' A' ' 128' ' ' GLU . 38.1 m -65.04 -35.17 80.3 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.754 179.763 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -62.7 -45.57 92.14 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.759 -179.733 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -72.41 -23.12 61.04 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.667 -179.771 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -71.6 -50.15 33.64 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.327 179.876 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 143' ' ' VAL . . . . . 0.443 HG13 ' N ' ' A' ' 144' ' ' ALA . 6.9 p -66.67 -41.01 87.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.696 -179.508 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 144' ' ' ALA . . . . . 0.443 ' N ' HG13 ' A' ' 143' ' ' VAL . . . -61.43 -43.56 98.65 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.479 -179.936 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 145' ' ' PHE . . . . . . . . . . . . . 65.4 t80 -60.2 -41.87 93.91 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.4 -179.832 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 146' ' ' MET . . . . . . . . . . . . . 89.9 mmm -63.85 -39.92 95.36 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.018 -179.349 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 9.1 t -67.48 -44.94 77.32 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.077 179.916 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 148' ' ' ILE . . . . . . . . . . . . . 78.7 mt -54.08 -33.5 24.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.582 -179.26 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 55.5 mtpt -60.97 -42.05 97.58 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.532 -179.908 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 150' ' ' ASN . . . . . . . . . . . . . 58.7 t-20 -86.61 108.95 18.84 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.443 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.777 0 CA-C-O 117.979 -1.456 . . . . 0.0 110.985 179.967 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 4.4 m . . . . . 0 N--CA 1.491 1.596 0 N-CA-C 109.319 -0.623 . . . . 0.0 109.319 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 82' ' ' ALA . . . . . 0.481 ' O ' ' N ' ' A' ' 84' ' ' LYS . . . -153.14 95.85 2.0 Allowed 'General case' 0 N--CA 1.451 -0.403 0 CA-C-O 121.079 0.466 . . . . 0.0 110.059 179.994 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -46.49 -16.36 0.03 OUTLIER 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.08 179.609 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.481 ' N ' ' O ' ' A' ' 82' ' ' ALA . 99.4 mttt -63.97 -41.96 97.4 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.314 179.328 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 35.9 t30 -64.79 -43.67 92.44 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.357 -179.523 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 2.6 tp -60.95 -43.36 98.81 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.6 -179.241 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 74.4 mt -55.83 -35.85 66.85 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.309 -179.767 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 88.6 mt-30 -71.01 -34.58 71.48 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.546 179.64 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -62.36 -48.08 81.34 Favored 'General case' 0 C--N 1.334 -0.08 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.044 -179.013 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 22.1 pt -65.2 -35.71 76.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.691 -179.996 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -59.17 -50.66 73.2 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.559 -179.648 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 56.0 tt0 -65.3 -44.93 86.34 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.859 -179.668 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -63.34 -47.58 81.59 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.702 -179.808 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 94' ' ' GLU . . . . . 0.445 ' O ' ' CB ' ' A' ' 95' ' ' SER . 16.0 mm-40 -72.64 -16.38 61.71 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.292 -179.832 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 95' ' ' SER . . . . . 0.445 ' CB ' ' O ' ' A' ' 94' ' ' GLU . 0.7 OUTLIER 79.69 11.36 1.27 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.516 -179.91 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 9.7 p -80.89 165.28 21.96 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.458 -179.911 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 57.5 tp -67.39 126.11 28.26 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.647 -179.974 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.574 ' N ' HD12 ' A' ' 98' ' ' LEU . 10.5 mp -46.4 148.37 1.66 Allowed Pre-proline 0 N--CA 1.45 -0.43 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.75 179.887 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -70.63 143.96 48.09 Favored 'Trans proline' 0 C--N 1.31 -1.474 0 C-N-CA 122.764 2.31 . . . . 0.0 111.996 179.63 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 91.5 t80 -129.97 131.37 45.9 Favored 'General case' 0 C--O 1.234 0.261 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 179.57 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 79.5 m-85 -98.72 146.17 26.16 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.823 -179.444 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -144.18 145.7 32.26 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.503 -179.883 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 94.4 m -123.97 129.76 51.47 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.423 -179.939 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -113.23 141.05 47.43 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.147 179.933 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 13.4 p -115.15 120.79 40.95 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-O 120.874 0.368 . . . . 0.0 110.627 179.452 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 35.6 p -159.02 164.67 35.3 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.425 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 122.8 164.97 12.27 Favored Glycine 0 CA--C 1.522 0.473 0 N-CA-C 110.834 -0.906 . . . . 0.0 110.834 179.721 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 20.4 Cg_endo -60.9 151.46 77.53 Favored 'Trans proline' 0 C--N 1.3 -1.98 0 C-N-CA 122.854 2.369 . . . . 0.0 112.16 179.344 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 91.2 p -63.68 -18.41 63.96 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.186 179.326 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 99.2 m-70 -89.9 -43.25 10.73 Favored 'General case' 0 CA--C 1.519 -0.234 0 CA-C-O 120.889 0.376 . . . . 0.0 110.538 179.409 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -124.2 77.75 60.31 Favored Pre-proline 0 CA--C 1.532 0.267 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.378 179.445 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 112' ' ' PRO . . . . . 0.513 ' O ' HG23 ' A' ' 113' ' ' THR . 59.7 Cg_endo -75.41 162.73 35.63 Favored 'Trans proline' 0 C--N 1.305 -1.743 0 C-N-CA 122.572 2.181 . . . . 0.0 112.295 179.836 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 113' ' ' THR . . . . . 0.513 HG23 ' O ' ' A' ' 112' ' ' PRO . 25.4 p -157.51 153.63 27.33 Favored 'General case' 0 CA--C 1.515 -0.378 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.629 179.488 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -130.75 143.14 50.53 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.287 -179.877 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 97.5 m -130.5 126.17 36.19 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.575 179.454 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 29.1 t -97.5 123.19 41.28 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.408 -179.922 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 117' ' ' THR . . . . . 0.427 ' CG2' ' CG2' ' A' ' 124' ' ' VAL . 51.7 m -112.97 129.14 56.59 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.196 -179.805 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 9.4 p -111.87 142.02 25.55 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.305 179.993 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 81.6 tt0 -124.64 132.71 53.4 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.767 179.908 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 120' ' ' PHE . . . . . 0.635 ' CZ ' ' CE1' ' A' ' 125' ' ' PHE . 48.3 p90 -167.3 158.57 11.92 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.51 179.168 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 54.12 21.47 3.02 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.605 179.685 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 75.52 21.88 76.43 Favored Glycine 0 CA--C 1.522 0.481 0 N-CA-C 111.075 -0.81 . . . . 0.0 111.075 -179.947 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -132.73 153.0 51.61 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.652 0.263 . . . . 0.0 110.575 179.872 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 124' ' ' VAL . . . . . 0.499 ' O ' HG13 ' A' ' 124' ' ' VAL . 14.2 p -121.4 126.81 75.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-O 120.91 0.386 . . . . 0.0 110.558 -179.826 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 125' ' ' PHE . . . . . 0.635 ' CE1' ' CZ ' ' A' ' 120' ' ' PHE . 41.9 m-85 -111.44 121.3 44.84 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.314 179.646 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 5.9 p -83.26 137.78 33.86 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.416 180.0 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -86.15 -169.07 45.54 Favored Glycine 0 CA--C 1.521 0.454 0 N-CA-C 110.654 -0.978 . . . . 0.0 110.654 179.826 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -97.88 132.88 43.07 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-O 120.653 0.263 . . . . 0.0 110.788 -179.91 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 98.4 mt-10 -56.55 146.98 23.32 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 120.924 0.392 . . . . 0.0 110.416 179.221 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -169.77 161.75 9.29 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.652 -179.962 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 77.5 tttt -88.84 33.03 0.78 Allowed 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.173 0.511 . . . . 0.0 110.311 179.532 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 2.5 t -159.28 150.6 20.12 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.789 -179.683 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -81.06 -32.83 33.83 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.933 179.758 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 134' ' ' LYS . . . . . 0.423 ' N ' ' CD ' ' A' ' 134' ' ' LYS . 4.5 mptp? -58.5 -51.87 68.03 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.644 -178.628 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 3.5 tp -65.8 -39.72 91.19 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-O 120.845 0.355 . . . . 0.0 110.824 179.916 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -57.79 -55.17 38.3 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.572 -179.157 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -59.24 -43.35 92.4 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.398 -179.433 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 47.8 ttp -61.4 -44.66 96.77 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.443 -179.573 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 18.1 m -62.08 -39.97 94.23 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.748 -179.854 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -62.88 -46.44 87.84 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.702 -179.946 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -71.88 -23.72 61.55 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.547 179.895 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 64.4 tttp -70.54 -48.73 54.02 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.261 179.78 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 143' ' ' VAL . . . . . 0.402 HG13 ' N ' ' A' ' 144' ' ' ALA . 7.6 p -69.16 -37.97 77.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.69 -179.542 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 144' ' ' ALA . . . . . 0.402 ' N ' HG13 ' A' ' 143' ' ' VAL . . . -63.19 -45.86 89.76 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.642 -179.622 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 145' ' ' PHE . . . . . . . . . . . . . 60.7 t80 -60.24 -43.01 96.45 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.566 -179.326 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 146' ' ' MET . . . . . . . . . . . . . 62.7 ttp -61.63 -39.63 91.97 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.95 -179.73 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 33.1 t -67.04 -43.6 82.36 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.901 -179.999 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 148' ' ' ILE . . . . . . . . . . . . . 89.6 mt -57.28 -31.82 39.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.695 -179.411 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 53.9 mtpt -63.05 -41.85 99.57 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.819 179.864 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 150' ' ' ASN . . . . . . . . . . . . . 45.1 t30 -64.03 -40.13 95.63 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.506 -179.98 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.775 0 CA-C-O 117.957 -1.468 . . . . 0.0 110.921 -179.901 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 13.0 t . . . . . 0 N--CA 1.489 1.494 0 N-CA-C 109.455 -0.572 . . . . 0.0 109.455 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 82' ' ' ALA . . . . . 0.476 ' C ' ' N ' ' A' ' 84' ' ' LYS . . . -153.36 95.97 1.99 Allowed 'General case' 0 N--CA 1.449 -0.51 0 CA-C-O 121.082 0.468 . . . . 0.0 110.274 -179.877 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -47.01 -16.38 0.04 OUTLIER 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.914 -0.585 . . . . 0.0 109.804 179.603 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.476 ' N ' ' C ' ' A' ' 82' ' ' ALA . 69.1 mttm -63.73 -42.51 97.89 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.686 -0.688 . . . . 0.0 109.993 179.86 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 89.5 m-20 -63.12 -44.49 95.49 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.525 -179.748 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 6.2 tt -63.71 -40.95 98.04 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.832 -179.879 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.44 HD23 HD11 ' A' ' 90' ' ' ILE . 39.4 mt -56.79 -36.19 69.57 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.092 -179.703 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 88.3 mt-30 -71.63 -31.36 66.78 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.59 179.672 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -66.07 -47.26 74.89 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.301 -179.386 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.44 HD11 HD23 ' A' ' 87' ' ' LEU . 30.4 pt -66.88 -34.96 73.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-O 120.929 0.395 . . . . 0.0 110.463 179.957 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -58.32 -49.89 75.58 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.706 -179.416 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 89.0 mt-30 -65.67 -44.24 86.87 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.754 179.809 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 64.4 tttp -62.28 -47.94 82.12 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.621 -179.745 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 98.1 mt-10 -74.92 -2.91 29.09 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.508 179.995 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 2.7 t 67.79 6.31 5.0 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.603 -179.996 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 7.6 p -75.03 160.72 30.18 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.261 -179.873 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 51.7 tp -67.15 129.8 41.05 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.879 -179.521 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 10.3 mp -45.47 155.01 0.48 Allowed Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.2 179.258 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -65.1 171.65 8.61 Favored 'Trans proline' 0 C--N 1.307 -1.637 0 C-N-CA 122.826 2.351 . . . . 0.0 111.737 179.621 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 29.0 t80 -144.27 122.57 12.29 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.124 179.191 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 -103.59 132.96 49.39 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.416 -179.682 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -144.07 145.1 31.95 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.328 179.883 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 97.7 m -126.2 133.53 51.5 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.656 -179.672 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -124.28 149.08 46.91 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.339 179.925 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 20.3 p -108.06 135.4 49.48 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-O 120.864 0.364 . . . . 0.0 110.706 179.814 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 26.5 m -162.73 161.71 26.46 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.499 179.905 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 119.3 179.19 16.68 Favored Glycine 0 CA--C 1.522 0.479 0 N-CA-C 110.668 -0.973 . . . . 0.0 110.668 179.884 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 108' ' ' PRO . . . . . 0.667 ' HG2' ' HB3' ' A' ' 111' ' ' ALA . 28.6 Cg_endo -60.91 151.51 77.2 Favored 'Trans proline' 0 C--N 1.302 -1.91 0 C-N-CA 122.87 2.38 . . . . 0.0 112.392 -179.664 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 37.5 t -63.56 -18.86 64.31 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.172 179.433 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 52.3 t-80 -90.31 -37.0 14.35 Favored 'General case' 0 CA--C 1.519 -0.243 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.118 179.55 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 111' ' ' ALA . . . . . 0.667 ' HB3' ' HG2' ' A' ' 108' ' ' PRO . . . -124.35 81.14 59.06 Favored Pre-proline 0 N--CA 1.465 0.32 0 CA-C-O 121.124 0.488 . . . . 0.0 110.11 179.427 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -84.33 117.32 2.12 Favored 'Trans proline' 0 C--N 1.303 -1.855 0 C-N-CA 122.55 2.167 . . . . 0.0 112.487 -179.215 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 48.2 p -105.37 170.06 8.1 Favored 'General case' 0 CA--C 1.517 -0.326 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.197 179.741 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -130.57 142.27 50.46 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.396 -179.842 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 86.3 m -121.0 119.1 31.56 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.285 179.68 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 21.5 m -97.9 122.12 40.64 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.122 -179.988 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 62.2 m -112.9 132.16 55.43 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.347 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 10.9 p -112.67 138.9 40.22 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.261 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.197 -179.87 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 84.0 tt0 -125.28 134.01 52.43 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.81 -179.714 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 120' ' ' PHE . . . . . 0.605 ' CZ ' ' CE1' ' A' ' 125' ' ' PHE . 48.7 p90 -166.61 158.73 13.52 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.615 179.442 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 52.73 23.01 2.5 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.828 0.347 . . . . 0.0 110.467 179.843 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 74.98 22.27 77.06 Favored Glycine 0 CA--C 1.521 0.44 0 N-CA-C 111.118 -0.793 . . . . 0.0 111.118 179.786 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 63.5 mttp -132.3 152.6 51.31 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 110.355 -0.239 . . . . 0.0 110.355 -179.892 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 124' ' ' VAL . . . . . 0.482 ' O ' HG13 ' A' ' 124' ' ' VAL . 7.2 p -118.99 124.61 73.47 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.23 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.69 -179.994 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 125' ' ' PHE . . . . . 0.605 ' CE1' ' CZ ' ' A' ' 120' ' ' PHE . 50.5 m-85 -108.5 119.8 40.58 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.07 179.79 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 73.4 m -82.49 134.26 35.21 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.383 -179.91 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -91.2 -167.15 40.94 Favored Glycine 0 CA--C 1.524 0.63 0 N-CA-C 110.673 -0.971 . . . . 0.0 110.673 179.846 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 128' ' ' GLU . . . . . 0.54 ' H ' ' CB ' ' A' ' 139' ' ' SER . 35.7 tt0 -98.0 133.89 41.85 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-O 120.968 0.413 . . . . 0.0 110.658 179.716 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 -63.35 151.75 39.96 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.324 179.71 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -171.78 164.36 6.51 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.733 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 61.7 pttt -88.39 32.64 0.77 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.665 179.184 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 3.9 t -156.14 148.13 23.19 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.929 0.395 . . . . 0.0 110.361 179.976 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 99.9 mttt -81.81 -17.14 48.57 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.642 -0.708 . . . . 0.0 109.896 179.738 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -73.29 -56.86 4.51 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.815 -179.702 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 4.3 tp -65.46 -41.34 93.48 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.344 -179.491 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -56.53 -55.12 37.81 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.832 -178.959 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -60.71 -40.29 91.71 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.789 0.328 . . . . 0.0 110.586 -179.729 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 56.7 mtt -61.63 -42.75 99.32 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.46 -179.817 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 139' ' ' SER . . . . . 0.54 ' CB ' ' H ' ' A' ' 128' ' ' GLU . 74.1 m -61.38 -41.03 96.45 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.44 -0.345 . . . . 0.0 110.873 -179.885 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -63.02 -45.76 90.8 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.935 0.398 . . . . 0.0 110.937 -179.927 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -71.07 -24.22 62.28 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.711 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 52.7 tttp -71.95 -49.98 32.85 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.931 0.396 . . . . 0.0 111.254 179.828 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 143' ' ' VAL . . . . . 0.424 HG13 ' N ' ' A' ' 144' ' ' ALA . 7.4 p -68.29 -38.96 80.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.712 -179.67 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 144' ' ' ALA . . . . . 0.424 ' N ' HG13 ' A' ' 143' ' ' VAL . . . -64.44 -48.3 75.84 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.878 -179.647 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 145' ' ' PHE . . . . . 0.422 ' CD1' ' C ' ' A' ' 145' ' ' PHE . 30.7 t80 -58.76 -44.45 90.59 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.922 -179.594 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 146' ' ' MET . . . . . . . . . . . . . 61.6 ttp -60.82 -38.34 85.08 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.881 -179.286 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 6.6 t -67.95 -41.23 82.81 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.879 179.538 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 148' ' ' ILE . . . . . . . . . . . . . 80.8 mt -57.51 -42.85 81.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 115.681 -0.691 . . . . 0.0 111.147 -178.953 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 17.1 ptmt -81.59 -26.6 34.79 Favored 'General case' 0 C--N 1.324 -0.506 0 C-N-CA 120.821 -0.352 . . . . 0.0 110.76 -179.783 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 150' ' ' ASN . . . . . . . . . . . . . 59.3 t-20 -62.89 -41.27 99.35 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.381 -179.602 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.781 0 CA-C-O 118.06 -1.411 . . . . 0.0 110.941 179.827 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 7.9 m . . . . . 0 N--CA 1.49 1.546 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 82' ' ' ALA . . . . . 0.478 ' C ' ' N ' ' A' ' 84' ' ' LYS . . . -154.06 95.9 1.9 Allowed 'General case' 0 N--CA 1.452 -0.347 0 CA-C-O 121.062 0.458 . . . . 0.0 110.051 179.992 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -47.01 -15.79 0.04 OUTLIER 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.93 179.748 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.478 ' N ' ' C ' ' A' ' 82' ' ' ALA . 99.6 mttt -64.13 -42.0 97.0 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.733 -0.667 . . . . 0.0 109.901 179.679 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 92.5 m-20 -64.23 -46.27 84.53 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.786 -179.79 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 6.3 tt -62.35 -40.79 97.56 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.828 -179.848 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.485 HD23 HD11 ' A' ' 90' ' ' ILE . 33.4 mt -57.21 -36.72 71.22 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.05 -179.642 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -70.78 -33.42 70.74 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.932 -0.577 . . . . 0.0 110.537 179.592 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 97.6 mt-10 -63.99 -48.51 76.13 Favored 'General case' 0 N--CA 1.462 0.152 0 C-N-CA 120.694 -0.402 . . . . 0.0 111.1 -179.29 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.485 HD11 HD23 ' A' ' 87' ' ' LEU . 29.4 pt -68.55 -34.77 67.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.75 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -57.72 -51.01 71.3 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.853 -179.535 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 69.3 tp60 -67.46 -41.5 84.58 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.539 179.937 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 65.8 tttm -60.97 -47.35 86.83 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.45 -179.505 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 96.1 mt-10 -72.85 -3.25 24.4 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.466 179.919 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 4.7 t 64.99 5.78 3.1 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.615 179.984 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 96' ' ' SER . . . . . 0.544 ' OG ' ' N ' ' A' ' 97' ' ' LEU . 29.3 t -61.86 -127.85 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.243 179.774 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.544 ' N ' ' OG ' ' A' ' 96' ' ' SER . 94.1 mt -139.35 126.43 21.14 Favored 'General case' 0 CA--C 1.517 -0.3 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.548 179.977 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.588 ' N ' HD12 ' A' ' 98' ' ' LEU . 10.2 mp -45.87 142.35 3.8 Favored Pre-proline 0 C--N 1.326 -0.435 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.658 -179.001 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -71.48 144.06 44.28 Favored 'Trans proline' 0 N--CA 1.494 1.546 0 C-N-CA 122.623 2.215 . . . . 0.0 112.241 179.757 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 87.4 t80 -123.28 126.62 47.23 Favored 'General case' 0 CA--C 1.513 -0.461 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 179.937 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 94.6 m-85 -95.18 142.05 28.06 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.393 -178.969 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -143.84 144.87 31.95 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 110.104 -0.332 . . . . 0.0 110.104 179.691 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 93.0 m -122.45 128.0 50.33 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.394 -179.936 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -114.58 142.77 46.0 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.223 179.848 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 29.4 p -103.68 132.4 49.98 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-O 120.787 0.327 . . . . 0.0 110.244 179.802 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 29.8 p -160.49 165.74 30.38 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.132 -179.837 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 115.4 -176.41 16.59 Favored Glycine 0 CA--C 1.524 0.615 0 N-CA-C 111.141 -0.784 . . . . 0.0 111.141 179.786 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 108' ' ' PRO . . . . . 0.42 ' HG2' ' HB3' ' A' ' 111' ' ' ALA . 29.4 Cg_endo -64.35 156.83 57.74 Favored 'Trans proline' 0 C--N 1.308 -1.565 0 C-N-CA 122.862 2.375 . . . . 0.0 112.272 -179.909 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 26.6 m -69.98 -19.54 63.34 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.14 179.313 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 74.6 m80 -88.84 -39.35 13.91 Favored 'General case' 0 CA--C 1.518 -0.269 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.405 179.894 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 111' ' ' ALA . . . . . 0.453 ' HB1' ' CE ' ' A' ' 131' ' ' LYS . . . -125.17 78.23 66.98 Favored Pre-proline 0 CA--C 1.534 0.344 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.257 179.221 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -80.81 126.38 5.83 Favored 'Trans proline' 0 C--N 1.305 -1.755 0 C-N-CA 122.344 2.029 . . . . 0.0 112.362 -179.725 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 4.3 p -110.36 173.64 6.23 Favored 'General case' 0 CA--C 1.513 -0.463 0 CA-C-O 120.951 0.405 . . . . 0.0 109.952 179.667 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 1.1 m-85 -134.14 148.28 50.93 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.491 -179.599 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 96.6 m -128.32 124.59 36.86 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.144 179.365 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 32.6 p -95.19 120.03 34.73 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.314 -179.649 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 117' ' ' THR . . . . . 0.42 ' CG2' ' CG2' ' A' ' 124' ' ' VAL . 99.8 m -107.92 126.57 52.84 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.17 179.856 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 11.6 p -109.33 137.35 41.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.203 -179.719 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 77.5 tt0 -123.82 131.8 53.66 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.822 -179.808 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 120' ' ' PHE . . . . . 0.615 ' CZ ' ' CE1' ' A' ' 125' ' ' PHE . 44.6 p90 -164.98 156.7 15.24 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.48 179.696 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 52.24 24.55 2.88 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.86 0.362 . . . . 0.0 110.617 179.832 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 73.54 22.22 78.71 Favored Glycine 0 CA--C 1.524 0.649 0 N-CA-C 111.139 -0.785 . . . . 0.0 111.139 179.787 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -131.99 152.25 51.24 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 110.319 -0.252 . . . . 0.0 110.319 -179.969 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 124' ' ' VAL . . . . . 0.477 ' O ' HG13 ' A' ' 124' ' ' VAL . 14.9 p -122.01 128.35 75.59 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.194 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.76 -179.649 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 125' ' ' PHE . . . . . 0.615 ' CE1' ' CZ ' ' A' ' 120' ' ' PHE . 24.5 m-85 -112.35 122.87 48.93 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.285 179.873 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 8.8 m -79.61 127.39 32.11 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.123 179.996 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -85.2 -171.84 48.57 Favored Glycine 0 CA--C 1.528 0.853 0 N-CA-C 110.891 -0.884 . . . . 0.0 110.891 -179.938 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 128' ' ' GLU . . . . . 0.467 ' CG ' ' N ' ' A' ' 129' ' ' GLU . 70.5 tt0 -80.25 167.8 19.85 Favored 'General case' 0 N--CA 1.445 -0.7 0 CA-C-O 120.664 0.269 . . . . 0.0 110.362 -179.915 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 129' ' ' GLU . . . . . 0.547 ' CD ' ' H ' ' A' ' 129' ' ' GLU . 1.3 pm0 -107.66 142.61 37.36 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.129 0.49 . . . . 0.0 110.138 179.242 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -172.11 166.64 6.1 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.856 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 131' ' ' LYS . . . . . 0.453 ' CE ' ' HB1' ' A' ' 111' ' ' ALA . 63.2 mttp -86.12 35.2 0.63 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.35 178.932 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 3.1 t -153.13 146.41 24.79 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.865 179.951 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 99.7 mttt -83.65 -21.65 32.41 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.802 179.692 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -69.26 -54.92 12.23 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.99 -179.187 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 4.0 tp -65.41 -40.19 93.09 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.888 -179.596 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -57.55 -54.99 40.56 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.621 -179.174 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -60.83 -41.39 95.66 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.804 0.335 . . . . 0.0 110.627 -179.741 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 33.3 tpp -60.23 -42.73 95.83 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.359 -179.727 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 139' ' ' SER . . . . . 0.423 ' CB ' ' H ' ' A' ' 128' ' ' GLU . 38.5 m -64.45 -36.81 85.37 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.847 -179.937 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -62.33 -46.46 88.6 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.971 0.415 . . . . 0.0 110.573 -179.822 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -70.38 -23.92 62.86 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.504 179.826 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -71.99 -50.61 27.25 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.291 -179.896 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 143' ' ' VAL . . . . . 0.45 HG13 ' N ' ' A' ' 144' ' ' ALA . 7.4 p -68.11 -40.97 83.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.763 -179.531 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 144' ' ' ALA . . . . . 0.45 ' N ' HG13 ' A' ' 143' ' ' VAL . . . -64.76 -46.88 80.29 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.667 -179.834 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 145' ' ' PHE . . . . . 0.45 ' C ' ' CD1' ' A' ' 145' ' ' PHE . 27.3 t80 -58.31 -45.93 87.1 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.931 -179.487 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 146' ' ' MET . . . . . . . . . . . . . 47.4 tpp -61.24 -38.02 85.14 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.863 -179.323 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 19.1 m -67.4 -41.03 85.58 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.106 -179.874 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 148' ' ' ILE . . . . . . . . . . . . . 81.1 mt -56.78 -42.53 77.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.608 -179.363 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 17.9 ptmt -86.22 -28.27 23.96 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.846 0.355 . . . . 0.0 110.787 179.9 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 150' ' ' ASN . . . . . . . . . . . . . 59.6 t30 -91.44 106.97 18.88 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.42 -179.724 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.754 0 CA-C-O 117.942 -1.477 . . . . 0.0 110.973 -179.852 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 12.4 p . . . . . 0 N--CA 1.49 1.575 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 82' ' ' ALA . . . . . 0.479 ' C ' ' N ' ' A' ' 84' ' ' LYS . . . -153.66 96.71 2.04 Favored 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 179.969 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 2.8 m-85 -48.26 -16.46 0.1 Allowed 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.432 -0.804 . . . . 0.0 109.533 179.62 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.479 ' N ' ' C ' ' A' ' 82' ' ' ALA . 63.9 mttp -63.8 -43.34 96.58 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.465 -0.789 . . . . 0.0 109.891 -179.978 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 41.8 t30 -63.33 -44.1 95.89 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.711 -179.135 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 6.1 tt -61.51 -41.69 97.67 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.982 -179.416 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.485 HD23 HD11 ' A' ' 90' ' ' ILE . 65.1 mt -57.44 -36.52 71.5 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.197 0.522 . . . . 0.0 109.626 -179.638 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 88.9 mt-30 -70.39 -35.59 73.57 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.541 178.996 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 80.9 mm-40 -63.3 -48.44 78.07 Favored 'General case' 0 N--CA 1.462 0.138 0 C-N-CA 120.664 -0.414 . . . . 0.0 111.494 -179.054 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.485 HD11 HD23 ' A' ' 87' ' ' LEU . 14.6 pt -63.7 -43.69 98.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 C-N-CA 120.858 -0.337 . . . . 0.0 110.491 -179.791 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 91' ' ' ALA . . . . . 0.515 ' O ' ' N ' ' A' ' 95' ' ' SER . . . -64.31 -47.69 78.47 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.814 -179.651 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 3.5 tm0? -65.76 -46.51 78.51 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.81 -179.55 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 55.7 mtpt -62.43 -44.78 95.62 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.869 -179.743 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 96.1 mt-10 -91.73 -0.44 57.55 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.225 -179.663 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 95' ' ' SER . . . . . 0.515 ' N ' ' O ' ' A' ' 91' ' ' ALA . 13.8 m 41.33 81.36 0.03 OUTLIER 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.535 -179.658 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 96' ' ' SER . . . . . 0.434 ' O ' ' CB ' ' A' ' 97' ' ' LEU . 75.5 p -139.64 36.19 2.01 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.776 -179.578 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.434 ' CB ' ' O ' ' A' ' 96' ' ' SER . 0.2 OUTLIER 79.59 93.98 0.05 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.939 0.399 . . . . 0.0 110.779 179.749 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.556 ' N ' HD12 ' A' ' 98' ' ' LEU . 10.5 mp -45.74 147.65 1.53 Allowed Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.284 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -68.53 140.95 49.1 Favored 'Trans proline' 0 N--CA 1.495 1.612 0 C-N-CA 122.707 2.271 . . . . 0.0 111.844 -179.859 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 87.0 t80 -126.88 130.04 49.38 Favored 'General case' 0 CA--C 1.511 -0.521 0 N-CA-C 108.417 -0.957 . . . . 0.0 108.417 179.795 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 94.8 m-85 -97.53 143.61 28.06 Favored 'General case' 0 C--N 1.322 -0.597 0 C-N-CA 120.723 -0.391 . . . . 0.0 110.35 -178.972 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -142.61 144.4 32.81 Favored 'General case' 0 N--CA 1.464 0.243 0 N-CA-C 109.986 -0.376 . . . . 0.0 109.986 179.611 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 90.1 m -124.53 130.24 52.1 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.456 -179.971 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -119.54 146.95 45.01 Favored 'General case' 0 N--CA 1.467 0.409 0 N-CA-C 109.851 -0.426 . . . . 0.0 109.851 179.492 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 32.2 p -110.36 138.34 46.87 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 110.175 -0.306 . . . . 0.0 110.175 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 44.3 t -167.4 154.2 8.34 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 110.032 -0.358 . . . . 0.0 110.032 179.85 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 126.08 -175.75 17.6 Favored Glycine 0 CA--C 1.529 0.915 0 N-CA-C 111.307 -0.717 . . . . 0.0 111.307 179.554 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 108' ' ' PRO . . . . . 0.401 ' HG2' ' HB3' ' A' ' 111' ' ' ALA . 19.2 Cg_endo -61.37 153.06 68.42 Favored 'Trans proline' 0 N--CA 1.495 1.599 0 C-N-CA 122.59 2.193 . . . . 0.0 112.366 179.881 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 92.9 p -67.3 -16.53 64.32 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.661 -0.7 . . . . 0.0 109.927 179.202 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 52.7 t-80 -91.79 -41.97 10.37 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-O 120.894 0.378 . . . . 0.0 110.301 -179.942 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 111' ' ' ALA . . . . . 0.401 ' HB3' ' HG2' ' A' ' 108' ' ' PRO . . . -123.95 79.64 57.61 Favored Pre-proline 0 CA--C 1.535 0.373 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.225 179.383 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_endo -83.17 122.68 3.34 Favored 'Trans proline' 0 N--CA 1.491 1.348 0 C-N-CA 122.699 2.266 . . . . 0.0 112.232 179.949 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 63.6 p -102.82 167.31 9.95 Favored 'General case' 0 CA--C 1.515 -0.399 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.003 179.896 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 1.2 m-85 -130.9 144.42 51.45 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.121 -179.897 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 115' ' ' THR . . . . . 0.437 ' OG1' ' OE1' ' A' ' 129' ' ' GLU . 46.5 m -123.82 120.26 32.08 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.659 -0.497 . . . . 0.0 109.659 179.395 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 41.2 t -95.21 121.41 36.83 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.229 -179.821 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 70.6 m -115.83 129.82 56.59 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.29 -0.413 . . . . 0.0 109.932 -179.91 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 12.9 p -113.77 145.74 19.25 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.259 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.164 -179.75 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -127.29 133.41 50.16 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.584 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 120' ' ' PHE . . . . . 0.619 ' CZ ' ' CE1' ' A' ' 125' ' ' PHE . 49.3 p90 -166.3 159.79 15.23 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.525 179.179 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 52.89 19.37 1.3 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.694 0.283 . . . . 0.0 110.761 179.423 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 77.5 21.3 72.84 Favored Glycine 0 CA--C 1.526 0.742 0 N-CA-C 111.249 -0.74 . . . . 0.0 111.249 179.76 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -131.69 151.54 51.56 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 110.192 -0.299 . . . . 0.0 110.192 179.765 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 124' ' ' VAL . . . . . 0.411 ' O ' HG13 ' A' ' 124' ' ' VAL . 6.7 p -121.02 127.71 75.97 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.171 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.643 -179.478 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 125' ' ' PHE . . . . . 0.619 ' CE1' ' CZ ' ' A' ' 120' ' ' PHE . 27.5 m-85 -109.44 154.48 22.57 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.664 179.915 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 37.2 p -117.79 132.99 56.38 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.624 -179.998 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -83.81 -169.79 45.66 Favored Glycine 0 CA--C 1.52 0.394 0 N-CA-C 110.624 -0.99 . . . . 0.0 110.624 179.668 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 128' ' ' GLU . . . . . 0.491 ' H ' ' CB ' ' A' ' 139' ' ' SER . 7.1 pt-20 -94.51 127.75 40.65 Favored 'General case' 0 CA--C 1.529 0.152 0 CA-C-O 120.553 0.216 . . . . 0.0 111.025 -179.373 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 129' ' ' GLU . . . . . 0.437 ' OE1' ' OG1' ' A' ' 115' ' ' THR . 79.8 mm-40 -53.81 143.73 20.25 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 120.457 -0.497 . . . . 0.0 110.209 179.832 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -169.63 161.62 9.5 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.772 179.984 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 22.4 pttp -88.61 33.99 0.76 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.416 179.652 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 4.8 t -154.74 147.86 24.78 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.621 179.493 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 99.7 mttt -79.98 -33.41 39.46 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.877 179.639 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 62.9 mttp -59.9 -54.68 43.29 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.037 -178.826 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 135' ' ' LEU . . . . . 0.4 HD21 ' OE2' ' A' ' 128' ' ' GLU . 3.7 tp -64.81 -38.86 92.39 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.914 0.387 . . . . 0.0 110.388 179.924 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -57.16 -54.94 41.07 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.568 -179.406 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -64.14 -41.01 97.35 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.714 -179.218 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 93.0 mtp -62.41 -41.44 98.69 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.208 -179.826 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 139' ' ' SER . . . . . 0.491 ' CB ' ' H ' ' A' ' 128' ' ' GLU . 68.8 m -66.7 -36.55 82.77 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.724 179.39 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -65.17 -45.84 83.26 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.953 0.406 . . . . 0.0 110.65 179.553 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -72.36 -24.27 61.25 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.419 179.856 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -70.01 -48.68 57.12 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.048 179.757 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 7.2 p -67.98 -37.37 78.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.705 -179.94 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 144' ' ' ALA . . . . . 0.438 ' O ' ' OG ' ' A' ' 147' ' ' SER . . . -65.52 -46.41 79.72 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.903 0.382 . . . . 0.0 110.722 -179.952 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 145' ' ' PHE . . . . . . . . . . . . . 85.6 t80 -60.72 -41.52 95.45 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.797 -179.986 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 146' ' ' MET . . . . . . . . . . . . . 75.4 mmm -60.69 -38.47 85.09 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.627 -179.461 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 147' ' ' SER . . . . . 0.438 ' OG ' ' O ' ' A' ' 144' ' ' ALA . 58.5 p -70.76 -39.81 73.02 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 120.75 -0.38 . . . . 0.0 111.089 179.429 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 148' ' ' ILE . . . . . . . . . . . . . 84.3 mt -58.5 -26.78 31.82 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.242 0 CA-C-O 120.715 0.293 . . . . 0.0 110.622 -179.608 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 36.5 mtmt -58.99 -41.91 88.76 Favored 'General case' 0 C--N 1.323 -0.577 0 C-N-CA 120.326 -0.55 . . . . 0.0 110.576 -179.413 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 150' ' ' ASN . . . . . . . . . . . . . 19.4 t-20 -63.49 -41.39 98.56 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.591 179.854 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.75 0 CA-C-O 118.083 -1.398 . . . . 0.0 110.984 -179.915 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 4.7 t . . . . . 0 N--CA 1.491 1.607 0 N-CA-C 109.232 -0.655 . . . . 0.0 109.232 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 82' ' ' ALA . . . . . 0.472 ' C ' ' N ' ' A' ' 84' ' ' LYS . . . -154.08 97.08 2.02 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-O 121.13 0.49 . . . . 0.0 109.759 -179.869 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -47.63 -16.09 0.06 Allowed 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.72 179.971 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.472 ' N ' ' C ' ' A' ' 82' ' ' ALA . 64.7 mttp -63.88 -42.11 97.58 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.617 -0.719 . . . . 0.0 109.804 179.716 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 89.7 m-20 -63.73 -46.19 86.48 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.884 -179.403 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 7.1 tt -62.64 -39.67 94.59 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.556 -179.724 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.518 HD23 HD11 ' A' ' 90' ' ' ILE . 33.7 mt -57.74 -38.97 76.25 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 -179.689 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 78.7 mt-30 -69.26 -35.11 75.75 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.645 179.122 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 95.7 mt-10 -62.99 -48.73 77.58 Favored 'General case' 0 N--CA 1.466 0.327 0 C-N-CA 120.761 -0.376 . . . . 0.0 111.166 -179.121 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.518 HD11 HD23 ' A' ' 87' ' ' LEU . 29.8 pt -66.42 -34.77 72.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.683 -179.968 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -55.71 -49.09 73.93 Favored 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 120.737 -0.385 . . . . 0.0 110.667 -179.37 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 52.9 tt0 -67.97 -43.49 78.86 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.846 -179.857 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 66.0 tttm -61.82 -48.52 80.2 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.899 0.381 . . . . 0.0 110.555 -179.487 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 80.2 mm-40 -76.84 2.62 14.04 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.576 -179.764 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 4.3 t 64.42 8.04 4.01 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.78 179.766 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 18.7 m -75.21 158.46 32.92 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.437 179.732 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.594 ' N ' HD12 ' A' ' 97' ' ' LEU . 9.4 mp -69.29 131.68 45.24 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.998 0.428 . . . . 0.0 110.393 -179.459 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.56 ' N ' HD12 ' A' ' 98' ' ' LEU . 10.3 mp -46.16 148.23 1.59 Allowed Pre-proline 0 C--N 1.326 -0.426 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.601 -179.727 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -73.07 142.69 34.84 Favored 'Trans proline' 0 N--CA 1.496 1.65 0 C-N-CA 122.828 2.352 . . . . 0.0 111.992 179.541 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 94.6 t80 -124.93 127.4 47.0 Favored 'General case' 0 CA--C 1.51 -0.564 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 179.798 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 84.1 m-85 -96.93 145.98 25.39 Favored 'General case' 0 C--N 1.324 -0.512 0 C-N-CA 120.726 -0.39 . . . . 0.0 110.303 -178.885 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -142.37 143.53 32.75 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.51 -0.314 . . . . 0.0 110.266 179.712 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 97.3 m -125.83 133.03 52.11 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.305 179.809 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -127.17 152.28 47.56 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.176 179.765 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 33.3 p -108.22 135.01 50.26 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-O 120.823 0.344 . . . . 0.0 110.133 -179.891 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 99.5 p -160.08 164.41 33.11 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.461 -179.805 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 117.47 -175.5 15.73 Favored Glycine 0 CA--C 1.527 0.835 0 N-CA-C 111.171 -0.772 . . . . 0.0 111.171 179.618 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 25.0 Cg_endo -62.15 152.3 76.73 Favored 'Trans proline' 0 N--CA 1.497 1.713 0 C-N-CA 122.863 2.376 . . . . 0.0 112.461 179.895 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 89.7 p -67.46 -17.31 64.65 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.016 179.284 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 55.1 t-80 -89.6 -42.73 11.23 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.209 179.956 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -123.93 78.07 58.1 Favored Pre-proline 0 CA--C 1.535 0.391 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.112 179.331 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -79.07 127.95 7.98 Favored 'Trans proline' 0 N--CA 1.49 1.27 0 C-N-CA 122.347 2.031 . . . . 0.0 112.435 179.768 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 52.0 p -110.19 172.87 6.61 Favored 'General case' 0 CA--C 1.519 -0.249 0 CA-C-N 115.793 -0.639 . . . . 0.0 109.86 179.629 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 1.7 m-85 -130.47 143.9 51.06 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.503 -179.377 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 97.9 m -124.59 120.91 33.27 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.265 -0.425 . . . . 0.0 109.965 179.307 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 12.9 t -102.14 128.82 48.46 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.239 179.917 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 97.5 m -129.6 141.44 50.95 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.322 -179.87 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 14.2 p -117.77 152.09 19.75 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.227 0 CA-C-N 116.044 -0.525 . . . . 0.0 109.76 179.86 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -129.03 136.98 51.03 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.004 0.43 . . . . 0.0 110.308 -179.895 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 120' ' ' PHE . . . . . 0.62 ' CZ ' ' CE1' ' A' ' 125' ' ' PHE . 55.0 p90 -169.31 161.42 10.01 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.791 -0.641 . . . . 0.0 110.744 179.14 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 52.87 19.21 1.24 Allowed 'General case' 0 N--CA 1.462 0.166 0 CA-C-O 120.771 0.32 . . . . 0.0 110.712 179.39 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 75.86 20.44 77.92 Favored Glycine 0 CA--C 1.526 0.723 0 N-CA-C 111.05 -0.82 . . . . 0.0 111.05 179.774 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 97.2 mttt -131.82 151.5 51.63 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.955 0.407 . . . . 0.0 110.145 -179.703 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 124' ' ' VAL . . . . . 0.524 HG22 ' N ' ' A' ' 125' ' ' PHE . 7.7 p -103.54 160.29 4.62 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.229 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.606 -179.325 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 125' ' ' PHE . . . . . 0.62 ' CE1' ' CZ ' ' A' ' 120' ' ' PHE . 85.8 m-85 -151.63 105.69 3.17 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.154 179.817 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 126' ' ' SER . . . . . 0.519 ' O ' HG21 ' A' ' 143' ' ' VAL . 34.2 t -88.48 151.92 22.22 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.499 179.7 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -99.93 -159.36 28.5 Favored Glycine 0 N--CA 1.464 0.54 0 N-CA-C 110.652 -0.979 . . . . 0.0 110.652 179.454 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 128' ' ' GLU . . . . . 0.507 ' H ' ' CB ' ' A' ' 139' ' ' SER . 5.7 pt-20 -101.89 135.87 42.7 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-O 120.434 0.159 . . . . 0.0 110.801 -179.381 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -55.05 145.62 20.18 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 120.599 -0.441 . . . . 0.0 110.258 179.384 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -167.13 159.31 12.87 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.881 -179.999 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 48.0 tttp -88.58 32.18 0.8 Allowed 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.209 179.682 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 5.8 t -157.8 150.46 22.75 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.613 179.677 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -79.67 -35.98 38.36 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.054 179.619 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -56.45 -55.12 37.61 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.005 -178.926 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 4.3 tp -65.18 -40.4 94.22 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.269 -179.724 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -55.84 -54.44 44.56 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.501 -179.221 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -60.69 -40.25 91.51 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.897 0.38 . . . . 0.0 110.335 -179.593 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 51.4 ttp -60.16 -48.45 81.68 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.296 -179.722 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 139' ' ' SER . . . . . 0.507 ' CB ' ' H ' ' A' ' 128' ' ' GLU . 57.1 m -60.72 -35.47 76.41 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.7 179.92 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -68.82 -49.28 59.8 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.888 0.375 . . . . 0.0 110.825 179.727 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -60.07 -25.61 65.52 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.645 -179.559 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 30.7 mmtm -68.04 -43.33 78.98 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.87 179.311 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 143' ' ' VAL . . . . . 0.519 HG21 ' O ' ' A' ' 126' ' ' SER . 3.3 t -62.39 -45.42 98.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.576 -179.116 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -63.12 -49.14 75.58 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-O 120.875 0.369 . . . . 0.0 111.012 -179.755 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 145' ' ' PHE . . . . . . . . . . . . . 49.7 t80 -61.53 -44.52 96.9 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.84 -179.367 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 146' ' ' MET . . . . . . . . . . . . . 72.6 mmm -64.36 -40.26 95.5 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.794 0.33 . . . . 0.0 110.883 -179.537 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 16.3 m -69.78 -41.85 74.58 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.935 179.934 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 148' ' ' ILE . . . . . . . . . . . . . 48.1 mt -56.49 -32.58 36.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.369 -179.78 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 55.4 mtpt -61.74 -41.98 98.37 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 120.618 -0.433 . . . . 0.0 110.486 -179.989 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 150' ' ' ASN . . . . . . . . . . . . . 99.0 m-20 -63.44 -40.61 97.6 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.475 179.857 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.701 0 CA-C-O 117.919 -1.489 . . . . 0.0 110.868 179.856 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 4.2 m . . . . . 0 N--CA 1.492 1.663 0 N-CA-C 109.315 -0.624 . . . . 0.0 109.315 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 82' ' ' ALA . . . . . 0.482 ' C ' ' N ' ' A' ' 84' ' ' LYS . . . -154.13 96.57 1.96 Allowed 'General case' 0 N--CA 1.449 -0.504 0 CA-C-O 121.167 0.508 . . . . 0.0 110.155 -179.882 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 2.2 m-85 -46.61 -16.04 0.03 OUTLIER 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.033 179.605 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.482 ' N ' ' C ' ' A' ' 82' ' ' ALA . 68.6 mttm -65.06 -42.37 94.27 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.004 179.604 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 89.9 m-20 -63.72 -45.77 88.46 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.478 -179.66 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 6.4 tt -61.98 -41.55 98.15 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.793 -179.741 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.57 HD23 HD11 ' A' ' 90' ' ' ILE . 37.6 mt -56.76 -37.04 70.52 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.115 -179.618 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 88.1 mt-30 -71.97 -32.68 67.51 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.415 179.737 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 78.5 mm-40 -65.01 -46.6 80.72 Favored 'General case' 0 CA--C 1.522 -0.102 0 C-N-CA 120.761 -0.375 . . . . 0.0 111.087 -179.048 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.57 HD11 HD23 ' A' ' 87' ' ' LEU . 18.1 pt -65.2 -44.45 95.25 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.703 -179.804 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 91' ' ' ALA . . . . . 0.504 ' O ' ' N ' ' A' ' 95' ' ' SER . . . -68.14 -47.77 67.18 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.538 -179.446 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 58.3 tt0 -64.78 -46.25 82.87 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.689 -179.809 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 66.3 tttm -61.67 -47.17 86.55 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.675 -179.923 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 80.9 mm-40 -92.94 8.47 39.65 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.408 -179.953 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 95' ' ' SER . . . . . 0.504 ' N ' ' O ' ' A' ' 91' ' ' ALA . 5.9 p 41.14 42.67 1.71 Allowed 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 120.848 0.356 . . . . 0.0 110.497 -179.882 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 18.7 p -92.74 39.43 1.04 Allowed 'General case' 0 CA--C 1.513 -0.466 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.788 -179.518 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 43.3 mt 69.4 100.4 0.06 Allowed 'General case' 0 CA--C 1.52 -0.21 0 O-C-N 123.451 0.469 . . . . 0.0 110.907 179.888 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 10.0 mp -44.85 155.06 0.41 Allowed Pre-proline 0 N--CA 1.452 -0.34 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.676 179.852 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_endo -64.8 170.17 10.49 Favored 'Trans proline' 0 C--N 1.305 -1.713 0 C-N-CA 122.791 2.328 . . . . 0.0 111.901 179.529 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 36.9 t80 -144.97 116.79 8.22 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.446 178.966 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 98.5 m-85 -98.77 131.95 44.51 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.918 0.39 . . . . 0.0 110.287 179.976 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -141.63 143.17 33.5 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.357 179.842 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 95.9 m -123.1 128.77 50.56 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.316 179.954 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -105.2 134.41 48.35 Favored 'General case' 0 CA--C 1.522 -0.108 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.271 179.714 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 19.4 p -115.21 123.95 50.16 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-O 120.897 0.379 . . . . 0.0 110.463 179.828 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 35.1 t -167.41 151.96 6.89 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.352 179.945 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 132.69 168.43 11.99 Favored Glycine 0 CA--C 1.522 0.491 0 N-CA-C 110.934 -0.867 . . . . 0.0 110.934 179.714 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 22.0 Cg_endo -61.46 151.38 80.12 Favored 'Trans proline' 0 C--N 1.303 -1.825 0 C-N-CA 122.814 2.342 . . . . 0.0 112.122 179.421 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 5.9 m -65.04 -17.42 64.44 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.031 -0.532 . . . . 0.0 110.254 179.395 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 93.4 m-70 -90.83 -41.91 10.94 Favored 'General case' 0 CA--C 1.52 -0.203 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.441 179.817 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -124.36 77.85 61.47 Favored Pre-proline 0 CA--C 1.531 0.248 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.356 179.508 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 112' ' ' PRO . . . . . 0.48 ' O ' HG23 ' A' ' 113' ' ' THR . 61.3 Cg_endo -76.46 160.72 35.13 Favored 'Trans proline' 0 C--N 1.304 -1.801 0 C-N-CA 122.681 2.254 . . . . 0.0 112.492 179.884 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 113' ' ' THR . . . . . 0.48 HG23 ' O ' ' A' ' 112' ' ' PRO . 24.5 p -155.8 150.3 25.95 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.56 179.423 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -132.59 146.05 51.59 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.352 179.98 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 91.6 m -126.12 121.33 32.56 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 116.175 -0.466 . . . . 0.0 109.878 179.197 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 10.4 p -95.76 121.75 37.81 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.601 179.927 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 52.6 m -115.77 130.67 56.94 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.044 179.944 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 9.8 p -112.59 143.79 21.62 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.267 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.208 179.994 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 84.0 tt0 -129.59 138.07 51.06 Favored 'General case' 0 CA--C 1.52 -0.189 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.632 -179.98 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 120' ' ' PHE . . . . . 0.627 ' CZ ' ' CE1' ' A' ' 125' ' ' PHE . 49.9 p90 -170.19 160.32 7.86 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.527 179.5 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 52.35 19.11 1.04 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.883 0.373 . . . . 0.0 110.559 179.419 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 79.55 20.37 69.04 Favored Glycine 0 CA--C 1.522 0.487 0 N-CA-C 111.353 -0.699 . . . . 0.0 111.353 179.697 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -131.9 150.8 52.05 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.661 0.267 . . . . 0.0 110.384 -179.96 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 124' ' ' VAL . . . . . 0.47 ' O ' HG13 ' A' ' 124' ' ' VAL . 7.8 p -119.59 126.41 75.3 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.312 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.972 -179.848 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 125' ' ' PHE . . . . . 0.627 ' CE1' ' CZ ' ' A' ' 120' ' ' PHE . 33.6 m-85 -110.83 118.2 35.49 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.112 179.805 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 11.3 p -76.64 125.25 28.92 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.479 -179.863 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -78.31 -172.67 40.67 Favored Glycine 0 CA--C 1.525 0.666 0 N-CA-C 110.904 -0.878 . . . . 0.0 110.904 179.914 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 18.9 mm-40 -79.62 169.81 17.46 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.649 0.262 . . . . 0.0 110.813 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 129' ' ' GLU . . . . . 0.547 ' CD ' ' H ' ' A' ' 129' ' ' GLU . 1.3 pm0 -109.33 139.17 44.62 Favored 'General case' 0 N--CA 1.464 0.262 0 N-CA-C 109.721 -0.474 . . . . 0.0 109.721 179.516 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -173.2 169.54 4.52 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.729 -179.994 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 22.6 pttp -86.86 36.34 0.72 Allowed 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.282 178.598 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 1.7 t -154.39 147.75 24.98 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.972 0.415 . . . . 0.0 110.665 -179.854 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -84.08 -25.61 29.66 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.027 179.594 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -66.22 -49.33 67.61 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.32 -178.496 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 4.2 tp -65.18 -42.59 93.49 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.573 -179.296 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -62.81 -54.92 31.52 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.391 -179.125 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -57.31 -46.24 83.41 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.739 0.304 . . . . 0.0 110.572 -179.965 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 36.8 ttm -62.98 -39.34 94.41 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.259 -179.969 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 37.5 m -63.01 -38.85 92.86 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.831 179.8 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -62.4 -40.62 97.1 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.622 -179.909 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -68.38 -27.15 65.98 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.911 -179.807 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 92.6 mttt -72.12 -51.1 23.03 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.802 179.233 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 143' ' ' VAL . . . . . 0.449 HG13 ' N ' ' A' ' 144' ' ' ALA . 7.2 p -66.6 -41.28 88.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.742 -179.625 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 144' ' ' ALA . . . . . 0.449 ' N ' HG13 ' A' ' 143' ' ' VAL . . . -64.07 -46.54 83.88 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.59 -179.798 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 145' ' ' PHE . . . . . . . . . . . . . 71.2 t80 -60.52 -42.66 96.89 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.41 -179.74 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 146' ' ' MET . . . . . 0.451 ' C ' ' SD ' ' A' ' 146' ' ' MET . 14.9 tmm? -61.63 -38.66 88.49 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.8 -179.742 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 6.8 t -69.22 -44.58 71.74 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.916 0.389 . . . . 0.0 110.976 179.874 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 148' ' ' ILE . . . . . . . . . . . . . 86.4 mt -56.17 -31.1 31.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.737 -179.466 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 55.0 mtpt -62.26 -42.29 99.2 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.69 -179.939 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 150' ' ' ASN . . . . . . . . . . . . . 62.3 t30 -94.8 103.73 15.63 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.436 -179.917 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.776 0 CA-C-O 118.041 -1.422 . . . . 0.0 110.924 -179.968 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 35.6 m . . . . . 0 N--CA 1.492 1.626 0 N-CA-C 109.43 -0.582 . . . . 0.0 109.43 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 82' ' ' ALA . . . . . 0.48 ' C ' ' N ' ' A' ' 84' ' ' LYS . . . -153.67 95.95 1.95 Allowed 'General case' 0 N--CA 1.449 -0.504 0 CA-C-O 121.26 0.552 . . . . 0.0 110.026 179.795 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -46.68 -16.3 0.03 OUTLIER 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.71 -0.677 . . . . 0.0 109.831 179.674 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.48 ' N ' ' C ' ' A' ' 82' ' ' ALA . 68.6 mttm -63.89 -41.98 97.57 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.953 179.709 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 65.7 t30 -66.38 -46.44 76.69 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.599 179.91 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 2.6 tp -60.59 -42.69 97.25 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.374 -179.482 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.442 HD23 HD11 ' A' ' 90' ' ' ILE . 34.1 mt -56.54 -34.81 67.42 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.152 -179.497 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 99.2 mt-30 -71.74 -35.58 70.17 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.42 179.38 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 94.9 mt-10 -61.7 -48.95 78.44 Favored 'General case' 0 C--O 1.231 0.09 0 CA-C-O 120.913 0.387 . . . . 0.0 111.107 -178.887 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.442 HD11 HD23 ' A' ' 87' ' ' LEU . 21.8 pt -62.3 -36.76 76.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.506 -179.929 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -58.18 -47.6 82.91 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.572 -179.518 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 13.0 mm100 -64.55 -49.09 72.59 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.707 179.973 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 19.3 tptm -62.18 -48.07 81.68 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.724 -179.457 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -71.88 -15.37 62.11 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.429 -179.984 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 1.9 p 74.54 15.52 3.36 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.473 -179.723 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 11.2 p -84.26 161.91 20.32 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.676 -179.984 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 60.2 mt -61.62 124.68 21.37 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.493 -179.948 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.617 ' N ' HD12 ' A' ' 98' ' ' LEU . 9.4 mp -49.09 147.93 4.55 Favored Pre-proline 0 C--N 1.326 -0.436 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.706 -179.513 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_endo -68.45 140.11 47.08 Favored 'Trans proline' 0 C--N 1.311 -1.405 0 C-N-CA 122.508 2.138 . . . . 0.0 112.009 179.452 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 85.9 t80 -132.36 133.84 44.46 Favored 'General case' 0 CA--C 1.517 -0.322 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 179.819 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 45.0 m-85 -103.35 149.32 24.87 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.35 -179.303 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -152.27 93.5 1.82 Allowed 'General case' 0 C--O 1.234 0.265 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.175 179.883 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 103' ' ' THR . . . . . 0.433 ' H ' HG22 ' A' ' 103' ' ' THR . 0.0 OUTLIER -70.93 138.95 50.5 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.178 179.848 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -126.59 152.77 46.18 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.209 179.945 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 43.4 p -105.93 134.6 48.79 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-O 120.819 0.342 . . . . 0.0 110.414 179.798 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 51.0 p -161.7 161.0 29.24 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.229 179.902 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 116.83 -176.9 16.49 Favored Glycine 0 CA--C 1.523 0.584 0 N-CA-C 110.889 -0.884 . . . . 0.0 110.889 179.789 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -62.43 152.59 76.19 Favored 'Trans proline' 0 C--N 1.307 -1.644 0 C-N-CA 122.627 2.218 . . . . 0.0 112.298 -179.717 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 78.7 p -67.66 -15.35 63.6 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 109.46 -0.57 . . . . 0.0 109.46 178.833 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 77.2 m80 -90.13 -43.76 10.24 Favored 'General case' 0 CA--C 1.519 -0.242 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.546 179.981 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -124.89 78.67 65.2 Favored Pre-proline 0 N--CA 1.462 0.17 0 CA-C-N 116.018 -0.537 . . . . 0.0 109.636 179.011 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -82.0 126.91 5.22 Favored 'Trans proline' 0 C--N 1.306 -1.686 0 C-N-CA 122.467 2.112 . . . . 0.0 112.168 -179.716 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 3.9 p -108.16 172.9 6.57 Favored 'General case' 0 CA--C 1.516 -0.339 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.078 179.756 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 1.2 m-85 -131.1 145.46 52.0 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.448 -179.743 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 89.7 m -128.98 123.8 33.37 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.035 179.368 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 116' ' ' SER . . . . . 0.414 ' OG ' ' O ' ' A' ' 136' ' ' ALA . 93.6 p -92.06 119.37 31.69 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.731 -179.865 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 91.2 m -106.22 123.54 48.2 Favored 'General case' 0 N--CA 1.465 0.301 0 N-CA-C 109.991 -0.374 . . . . 0.0 109.991 179.921 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 7.5 p -109.7 137.81 40.15 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.301 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.144 -179.946 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 82.8 tt0 -123.47 131.29 53.6 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.707 -179.907 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 120' ' ' PHE . . . . . 0.626 ' CZ ' ' CE1' ' A' ' 125' ' ' PHE . 47.2 p90 -166.53 157.34 12.49 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.428 179.504 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 53.93 21.72 2.98 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.915 0.388 . . . . 0.0 110.494 179.667 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 75.45 21.51 77.28 Favored Glycine 0 CA--C 1.522 0.499 0 N-CA-C 111.024 -0.83 . . . . 0.0 111.024 -179.991 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -132.51 152.95 51.39 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.536 0.208 . . . . 0.0 110.509 179.944 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 124' ' ' VAL . . . . . 0.471 ' O ' HG13 ' A' ' 124' ' ' VAL . 12.0 p -122.49 128.27 75.33 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.232 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.776 -179.914 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 125' ' ' PHE . . . . . 0.626 ' CE1' ' CZ ' ' A' ' 120' ' ' PHE . 25.5 m-85 -114.02 123.46 49.75 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.257 179.673 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 96.0 p -83.29 137.36 34.02 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.531 -179.912 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -85.12 -171.48 48.28 Favored Glycine 0 CA--C 1.521 0.424 0 N-CA-C 110.711 -0.955 . . . . 0.0 110.711 179.93 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 128' ' ' GLU . . . . . 0.42 ' O ' ' CG ' ' A' ' 128' ' ' GLU . 9.7 pt-20 -92.74 127.57 38.29 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-O 121.003 0.43 . . . . 0.0 110.858 -179.823 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 129' ' ' GLU . . . . . 0.602 ' CD ' ' H ' ' A' ' 129' ' ' GLU . 1.2 pm0 -54.64 145.34 19.3 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 121.066 0.46 . . . . 0.0 110.695 179.305 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -171.66 163.15 6.53 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.645 179.884 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 51.8 tttm -89.2 33.91 0.8 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.986 0.422 . . . . 0.0 110.301 179.447 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -154.43 143.05 20.77 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.667 -179.644 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -78.91 -45.65 20.11 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.247 179.938 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 43.9 pttt -53.32 -46.71 69.56 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.539 -179.433 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 4.1 tp -66.69 -42.11 87.01 Favored 'General case' 0 N--CA 1.443 -0.78 0 CA-C-O 120.741 0.305 . . . . 0.0 110.942 -179.756 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 136' ' ' ALA . . . . . 0.414 ' O ' ' OG ' ' A' ' 116' ' ' SER . . . -59.55 -51.96 67.62 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.48 -179.381 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 95.6 mt-10 -55.77 -44.0 77.26 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.384 -179.667 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 47.9 ttp -61.54 -42.54 98.97 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.266 -179.739 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 23.3 m -63.16 -39.01 93.43 Favored 'General case' 0 CA--C 1.519 -0.221 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.954 -179.841 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -64.27 -44.89 90.32 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.009 0.433 . . . . 0.0 110.589 -179.788 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -72.16 -24.17 61.39 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.389 179.934 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 63.4 tttp -71.11 -48.89 49.68 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.293 179.867 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 7.5 p -68.34 -37.75 78.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.698 -179.734 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -62.9 -44.59 95.67 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.781 -179.544 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 145' ' ' PHE . . . . . . . . . . . . . 60.6 t80 -59.9 -43.12 95.02 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.739 -179.39 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 146' ' ' MET . . . . . . . . . . . . . 47.1 ttp -61.26 -39.43 90.34 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.732 0.301 . . . . 0.0 110.848 -179.242 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 12.2 t -67.44 -44.62 78.25 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.966 -179.999 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 148' ' ' ILE . . . . . . . . . . . . . 91.4 mt -56.22 -33.47 37.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.695 -179.665 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 56.0 mtpt -61.8 -40.88 96.77 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.797 -179.929 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 150' ' ' ASN . . . . . . . . . . . . . 60.8 t30 -84.66 109.26 17.87 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.413 -179.82 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.221 -0.71 0 CA-C-O 117.971 -1.461 . . . . 0.0 110.911 179.973 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 6.7 t . . . . . 0 N--CA 1.49 1.57 0 N-CA-C 109.476 -0.565 . . . . 0.0 109.476 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 82' ' ' ALA . . . . . 0.481 ' C ' ' N ' ' A' ' 84' ' ' LYS . . . -154.31 95.75 1.85 Allowed 'General case' 0 N--CA 1.449 -0.483 0 CA-C-O 121.075 0.464 . . . . 0.0 110.086 179.993 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 -46.7 -16.06 0.03 OUTLIER 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.027 179.533 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.481 ' N ' ' C ' ' A' ' 82' ' ' ALA . 99.4 mttt -64.72 -41.07 96.25 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.844 -0.617 . . . . 0.0 110.125 179.69 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 89.5 m-20 -66.71 -47.2 73.1 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.692 -179.823 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 5.8 tt -60.82 -42.96 98.72 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.723 -179.406 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.432 HD23 HD11 ' A' ' 90' ' ' ILE . 33.8 mt -55.86 -35.23 66.22 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.259 -179.56 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 88.8 mt-30 -70.71 -34.0 71.45 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.303 179.459 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 80.9 mm-40 -63.95 -49.98 70.42 Favored 'General case' 0 C--O 1.231 0.098 0 C-N-CA 120.608 -0.437 . . . . 0.0 111.188 -178.807 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.432 HD11 HD23 ' A' ' 87' ' ' LEU . 30.8 pt -63.37 -35.39 72.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.515 179.982 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -58.53 -48.88 79.38 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.666 -179.187 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 87.6 mt-30 -66.09 -43.94 85.83 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.776 179.932 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 88.9 tttt -63.47 -48.32 78.14 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.478 -179.84 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 98.4 mt-10 -72.87 -10.11 59.44 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.31 -179.937 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 2.0 p 74.08 8.53 4.7 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.462 -179.881 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 10.0 p -77.66 164.14 25.57 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.322 179.93 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.589 ' N ' HD12 ' A' ' 97' ' ' LEU . 9.6 mp -68.31 128.23 35.81 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.981 0.42 . . . . 0.0 110.422 -179.555 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.549 ' N ' HD12 ' A' ' 98' ' ' LEU . 10.7 mp -46.39 148.54 1.6 Allowed Pre-proline 0 N--CA 1.448 -0.54 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.822 -179.846 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_endo -69.02 140.3 45.08 Favored 'Trans proline' 0 C--N 1.311 -1.42 0 C-N-CA 122.649 2.232 . . . . 0.0 112.072 179.834 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 49.9 t80 -132.27 132.39 42.99 Favored 'General case' 0 C--O 1.235 0.338 0 N-CA-C 109.696 -0.483 . . . . 0.0 109.696 179.823 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 33.7 m-85 -101.94 149.08 24.58 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.755 -179.578 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -142.27 91.38 2.33 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-O 120.991 0.424 . . . . 0.0 111.349 179.918 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 43.6 m -71.52 133.19 45.64 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.085 179.655 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -138.17 161.31 37.16 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 110.136 -0.32 . . . . 0.0 110.136 -179.969 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 37.4 p -100.72 134.96 42.91 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-O 120.906 0.384 . . . . 0.0 110.508 179.743 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 34.1 p -160.75 163.64 32.15 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.473 -179.899 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 119.83 -165.13 13.49 Favored Glycine 0 CA--C 1.526 0.723 0 N-CA-C 111.128 -0.789 . . . . 0.0 111.128 179.583 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 108' ' ' PRO . . . . . 0.443 ' HG2' ' HB3' ' A' ' 111' ' ' ALA . 47.3 Cg_endo -70.2 150.72 65.96 Favored 'Trans proline' 0 C--N 1.306 -1.668 0 C-N-CA 122.61 2.207 . . . . 0.0 112.453 -179.422 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 77.8 p -68.47 -20.02 64.59 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.243 178.729 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 73.0 m80 -85.23 -37.88 19.58 Favored 'General case' 0 CA--C 1.518 -0.251 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.413 179.706 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 111' ' ' ALA . . . . . 0.511 ' HB1' ' HE2' ' A' ' 131' ' ' LYS . . . -126.91 78.29 73.96 Favored Pre-proline 0 N--CA 1.465 0.291 0 CA-C-O 121.18 0.515 . . . . 0.0 110.396 178.76 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -62.63 122.46 10.82 Favored 'Trans proline' 0 C--N 1.301 -1.966 0 C-N-CA 122.315 2.01 . . . . 0.0 112.367 -179.693 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 40.8 p -111.69 173.96 6.1 Favored 'General case' 0 CA--C 1.515 -0.391 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.198 179.638 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 1.6 m-85 -130.28 144.37 51.33 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.506 -179.579 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 86.1 m -131.26 127.55 38.03 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.479 179.514 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 10.5 t -97.73 122.01 40.31 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.419 -179.934 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 98.5 m -107.78 127.7 53.94 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.183 -179.95 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 7.4 p -111.82 139.24 37.16 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.303 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.239 -179.945 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 84.1 tt0 -124.27 131.21 53.51 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.53 179.736 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 120' ' ' PHE . . . . . 0.612 ' CZ ' ' CE1' ' A' ' 125' ' ' PHE . 45.2 p90 -167.84 159.1 11.31 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.177 179.249 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 54.57 20.84 3.05 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.145 0.498 . . . . 0.0 109.767 -179.908 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 72.73 23.56 77.68 Favored Glycine 0 CA--C 1.521 0.448 0 N-CA-C 110.937 -0.865 . . . . 0.0 110.937 -179.77 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 62.9 mttp -132.6 152.25 51.69 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.587 0.232 . . . . 0.0 110.382 -179.884 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 124' ' ' VAL . . . . . 0.491 ' O ' HG13 ' A' ' 124' ' ' VAL . 12.7 p -120.19 127.26 75.89 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.167 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.926 -179.742 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 125' ' ' PHE . . . . . 0.612 ' CE1' ' CZ ' ' A' ' 120' ' ' PHE . 39.2 m-85 -112.74 119.88 39.57 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.079 179.312 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 6.8 m -82.26 138.43 34.6 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.638 -179.998 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -86.65 -168.21 44.56 Favored Glycine 0 CA--C 1.523 0.532 0 N-CA-C 110.646 -0.981 . . . . 0.0 110.646 179.724 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 128' ' ' GLU . . . . . 0.414 ' H ' ' CB ' ' A' ' 139' ' ' SER . 9.1 pt-20 -98.87 133.26 43.41 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.819 0.342 . . . . 0.0 110.522 -179.87 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -57.33 148.09 23.93 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.072 0.463 . . . . 0.0 110.545 179.068 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -170.78 162.74 7.72 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.811 179.818 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 131' ' ' LYS . . . . . 0.511 ' HE2' ' HB1' ' A' ' 111' ' ' ALA . 97.2 mttt -88.35 32.79 0.76 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.369 179.22 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 3.1 t -158.43 151.4 22.56 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.741 179.877 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 68.9 mttm -81.56 -36.32 29.22 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.083 0.468 . . . . 0.0 110.442 179.508 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 30.7 mmtp -53.42 -54.28 39.08 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.828 -178.979 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 4.4 tp -64.89 -40.5 95.2 Favored 'General case' 0 N--CA 1.446 -0.639 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.066 -179.906 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -55.64 -54.63 41.81 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.659 -179.172 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 97.3 mt-10 -60.96 -40.01 91.73 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.733 0.302 . . . . 0.0 110.404 -179.458 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 48.2 ttp -62.48 -46.68 87.35 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.735 -179.595 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 139' ' ' SER . . . . . 0.414 ' CB ' ' H ' ' A' ' 128' ' ' GLU . 68.8 m -61.95 -39.07 90.85 Favored 'General case' 0 CA--C 1.518 -0.269 0 CA-C-N 116.554 -0.294 . . . . 0.0 110.965 -179.356 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -63.66 -46.05 87.37 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.981 0.419 . . . . 0.0 110.563 -179.879 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -72.35 -23.5 61.15 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.563 -179.973 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 66.2 tttm -70.35 -48.63 55.53 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.054 0.454 . . . . 0.0 111.428 179.713 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 6.9 p -67.94 -36.41 75.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.614 -179.631 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -64.07 -45.01 90.64 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.614 -179.334 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 145' ' ' PHE . . . . . . . . . . . . . 62.1 t80 -60.46 -41.92 95.13 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.505 -179.615 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 146' ' ' MET . . . . . . . . . . . . . 47.9 ttp -63.74 -40.04 95.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.689 -179.648 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 67.8 m -68.27 -43.64 77.35 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.913 -179.885 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 148' ' ' ILE . . . . . . . . . . . . . 78.5 mt -55.77 -31.85 30.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.704 -179.686 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 54.3 mtpt -62.43 -39.39 93.15 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.462 179.85 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 150' ' ' ASN . . . . . . . . . . . . . 98.8 m-20 -64.33 -39.83 94.67 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.362 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.221 -0.703 0 CA-C-O 118.028 -1.429 . . . . 0.0 110.941 -179.862 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 12.7 p . . . . . 0 N--CA 1.489 1.503 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 82' ' ' ALA . . . . . 0.483 ' C ' ' N ' ' A' ' 84' ' ' LYS . . . -153.82 96.34 1.97 Allowed 'General case' 0 N--CA 1.45 -0.461 0 CA-C-O 121.245 0.545 . . . . 0.0 109.968 -179.913 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -47.48 -15.99 0.06 Allowed 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.616 -0.72 . . . . 0.0 109.777 179.633 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.483 ' N ' ' C ' ' A' ' 82' ' ' ALA . 99.3 mttt -64.59 -41.84 95.98 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.038 179.958 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 57.0 t-20 -65.01 -46.47 81.27 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.615 -179.625 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 5.8 tt -61.21 -41.8 97.48 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.896 -179.665 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.485 HD23 HD11 ' A' ' 90' ' ' ILE . 34.9 mt -57.01 -37.18 71.33 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.223 -0.444 . . . . 0.0 109.939 -179.565 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 87.0 mt-30 -71.29 -34.78 70.96 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.413 179.395 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -63.0 -46.6 86.89 Favored 'General case' 0 N--CA 1.462 0.158 0 C-N-CA 120.727 -0.389 . . . . 0.0 111.412 -179.163 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.485 HD11 HD23 ' A' ' 87' ' ' LEU . 17.5 pt -64.93 -44.15 96.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.891 -179.876 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 91' ' ' ALA . . . . . 0.474 ' O ' ' N ' ' A' ' 95' ' ' SER . . . -67.21 -47.68 70.15 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.955 -179.643 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 52.0 tt0 -66.85 -45.08 79.31 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.83 -179.921 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 88.9 tttt -62.87 -46.98 85.32 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.577 -179.865 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 70.0 mm-40 -90.85 2.1 56.42 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.328 -179.645 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 95' ' ' SER . . . . . 0.474 ' N ' ' O ' ' A' ' 91' ' ' ALA . 3.2 t 40.99 78.01 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.488 179.911 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 96' ' ' SER . . . . . 0.416 ' O ' ' CB ' ' A' ' 97' ' ' LEU . 67.0 p -136.44 38.59 2.68 Favored 'General case' 0 CA--C 1.513 -0.462 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.485 -179.702 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.416 ' CB ' ' O ' ' A' ' 96' ' ' SER . 3.2 tp 78.15 94.47 0.06 Allowed 'General case' 0 N--CA 1.454 -0.254 0 CA-C-O 120.896 0.379 . . . . 0.0 111.026 179.514 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.544 ' N ' HD12 ' A' ' 98' ' ' LEU . 10.8 mp -44.99 148.8 0.93 Allowed Pre-proline 0 C--N 1.326 -0.428 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.484 -179.784 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_endo -68.99 138.3 39.94 Favored 'Trans proline' 0 N--CA 1.495 1.591 0 C-N-CA 122.53 2.154 . . . . 0.0 112.174 -179.879 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 90.8 t80 -125.56 127.32 46.19 Favored 'General case' 0 CA--C 1.513 -0.463 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 179.991 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 92.8 m-85 -93.78 141.26 28.7 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.5 -179.182 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -136.7 138.0 40.57 Favored 'General case' 0 CA--C 1.514 -0.424 0 N-CA-C 110.064 -0.347 . . . . 0.0 110.064 179.619 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 25.2 m -120.31 126.6 50.94 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.455 -179.963 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -127.31 153.57 46.01 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.092 179.654 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 33.7 p -102.69 133.41 47.77 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-O 120.879 0.371 . . . . 0.0 110.196 179.836 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 50.8 p -162.7 166.36 24.51 Favored 'General case' 0 CA--C 1.515 -0.403 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.273 -179.745 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 120.58 -163.2 14.26 Favored Glycine 0 CA--C 1.527 0.79 0 N-CA-C 111.153 -0.779 . . . . 0.0 111.153 179.572 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 40.9 Cg_endo -69.53 147.42 64.28 Favored 'Trans proline' 0 N--CA 1.494 1.533 0 C-N-CA 122.59 2.193 . . . . 0.0 112.335 -179.324 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 78.8 p -68.5 -16.69 63.97 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.848 179.092 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 95.8 m-70 -86.01 -41.32 14.94 Favored 'General case' 0 CA--C 1.516 -0.364 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.181 179.998 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -126.96 78.33 74.11 Favored Pre-proline 0 N--CA 1.467 0.418 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.264 178.562 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_exo -59.92 125.68 18.33 Favored 'Trans proline' 0 C--N 1.304 -1.78 0 C-N-CA 122.465 2.11 . . . . 0.0 112.395 -179.693 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 69.1 p -111.57 173.83 6.16 Favored 'General case' 0 CA--C 1.514 -0.416 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.097 179.825 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 -132.1 146.66 52.19 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.651 -179.714 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 86.4 m -129.55 124.38 33.72 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.023 179.446 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 60.3 m -94.75 121.93 36.85 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.538 -179.953 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 117' ' ' THR . . . . . 0.427 ' CG2' ' CG2' ' A' ' 124' ' ' VAL . 81.3 m -112.92 127.29 56.16 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.218 -179.891 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 11.9 p -112.89 144.91 19.62 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.23 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.015 -179.792 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 82.9 tt0 -126.28 133.03 51.54 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.695 -179.867 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 120' ' ' PHE . . . . . 0.628 ' CZ ' ' CE1' ' A' ' 125' ' ' PHE . 48.7 p90 -166.73 157.96 12.59 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.508 179.478 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 53.38 19.98 1.81 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.871 0.367 . . . . 0.0 110.755 179.599 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 77.51 21.43 72.48 Favored Glycine 0 CA--C 1.524 0.655 0 N-CA-C 111.131 -0.788 . . . . 0.0 111.131 179.872 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -132.67 152.04 51.8 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 110.198 -0.297 . . . . 0.0 110.198 179.917 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 124' ' ' VAL . . . . . 0.49 ' O ' HG13 ' A' ' 124' ' ' VAL . 13.1 p -120.69 127.69 75.96 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.301 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.861 -179.804 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 125' ' ' PHE . . . . . 0.628 ' CE1' ' CZ ' ' A' ' 120' ' ' PHE . 53.0 m-85 -113.08 120.12 40.2 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.159 179.879 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 72.0 m -83.32 138.78 33.4 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.468 179.955 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -85.0 -169.38 45.92 Favored Glycine 0 CA--C 1.52 0.379 0 N-CA-C 110.591 -1.004 . . . . 0.0 110.591 179.871 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 128' ' ' GLU . . . . . 0.428 ' H ' ' CB ' ' A' ' 139' ' ' SER . 6.6 pt-20 -97.34 132.99 42.54 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-O 120.839 0.352 . . . . 0.0 110.95 -179.711 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 98.1 mt-10 -55.38 146.0 20.8 Favored 'General case' 0 C--N 1.32 -0.717 0 C-N-CA 120.508 -0.477 . . . . 0.0 110.484 179.522 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -169.53 160.4 9.04 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.524 -179.997 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 29.3 ttpt -91.12 32.48 1.02 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.044 0.449 . . . . 0.0 110.479 179.789 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -151.49 140.9 21.51 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.573 -179.75 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 28.6 ttmt -74.66 -47.08 33.86 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.352 179.885 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 134' ' ' LYS . . . . . 0.404 ' HG3' ' N ' ' A' ' 135' ' ' LEU . 47.1 pttt -53.7 -46.22 70.66 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.509 -179.252 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 135' ' ' LEU . . . . . 0.404 ' N ' ' HG3' ' A' ' 134' ' ' LYS . 4.7 tp -65.32 -39.44 92.45 Favored 'General case' 0 N--CA 1.444 -0.768 0 CA-C-O 120.811 0.338 . . . . 0.0 110.977 -179.678 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -57.68 -52.06 66.97 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.745 -179.311 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 69.9 mm-40 -57.85 -41.26 82.02 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.866 0.365 . . . . 0.0 110.608 -179.75 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 94.8 mtp -63.81 -41.39 97.88 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.575 -179.789 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 139' ' ' SER . . . . . 0.428 ' CB ' ' H ' ' A' ' 128' ' ' GLU . 15.2 m -64.05 -39.2 93.54 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-N 116.544 -0.298 . . . . 0.0 110.72 -179.687 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -65.69 -44.38 86.36 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.819 -179.896 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -71.74 -24.79 61.84 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.568 179.983 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 38.1 ttmt -71.24 -48.56 50.39 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.201 179.773 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 143' ' ' VAL . . . . . 0.401 HG13 ' N ' ' A' ' 144' ' ' ALA . 7.1 p -70.11 -37.81 73.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.799 -179.626 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 144' ' ' ALA . . . . . 0.401 ' N ' HG13 ' A' ' 143' ' ' VAL . . . -63.89 -47.08 82.06 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-O 120.838 0.352 . . . . 0.0 110.801 -179.764 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 145' ' ' PHE . . . . . . . . . . . . . 63.7 t80 -60.55 -43.47 97.19 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.795 179.935 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 146' ' ' MET . . . . . . . . . . . . . 63.9 ttp -60.24 -38.64 84.05 Favored 'General case' 0 C--N 1.327 -0.407 0 O-C-N 123.331 0.394 . . . . 0.0 111.077 -179.433 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 48.8 m -72.26 -42.61 65.4 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.165 179.81 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 148' ' ' ILE . . . . . . . . . . . . . 71.9 mt -54.87 -25.33 15.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.63 -179.695 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 36.6 mtmt -59.31 -41.24 88.57 Favored 'General case' 0 C--N 1.319 -0.728 0 C-N-CA 120.573 -0.451 . . . . 0.0 110.556 -179.617 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 150' ' ' ASN . . . . . . . . . . . . . 97.6 m-20 -63.68 -40.62 97.28 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.591 179.85 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.67 0 CA-C-O 117.912 -1.493 . . . . 0.0 110.9 -179.934 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 20.3 m . . . . . 0 N--CA 1.49 1.536 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 82' ' ' ALA . . . . . 0.481 ' O ' ' N ' ' A' ' 84' ' ' LYS . . . -154.04 95.75 1.88 Allowed 'General case' 0 N--CA 1.45 -0.45 0 CA-C-O 120.895 0.379 . . . . 0.0 110.379 179.85 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 -46.63 -15.83 0.03 OUTLIER 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.203 179.509 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.481 ' N ' ' O ' ' A' ' 82' ' ' ALA . 63.8 mttp -64.45 -41.64 96.43 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.182 179.311 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 93.2 m-20 -65.29 -47.14 77.68 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.522 -179.33 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 7.0 tt -59.74 -43.65 94.16 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.692 -179.126 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.454 HD23 HD11 ' A' ' 90' ' ' ILE . 59.0 mt -55.93 -35.56 66.76 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.523 -179.937 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 88.9 mt-30 -70.84 -34.98 72.24 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.425 179.496 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -63.78 -48.12 78.22 Favored 'General case' 0 C--O 1.23 0.054 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.001 -178.794 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.454 HD11 HD23 ' A' ' 87' ' ' LEU . 29.8 pt -66.48 -35.09 74.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.606 179.919 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -58.05 -49.65 76.17 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.36 -179.398 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 56.8 tt0 -65.19 -44.26 88.96 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.707 -179.656 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 65.2 tttm -63.43 -47.15 83.12 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.557 -179.938 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -76.47 -0.45 23.0 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.351 -179.825 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 3.9 t 65.49 7.4 4.33 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.653 -179.813 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 26.0 m -75.15 158.03 33.69 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.483 -179.93 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.562 ' N ' HD12 ' A' ' 97' ' ' LEU . 10.2 mp -64.39 128.19 34.7 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.398 -179.789 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.574 ' N ' HD12 ' A' ' 98' ' ' LEU . 10.2 mp -50.13 148.02 6.52 Favored Pre-proline 0 N--CA 1.451 -0.396 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.609 179.764 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -71.08 142.96 43.35 Favored 'Trans proline' 0 C--N 1.311 -1.401 0 C-N-CA 122.772 2.314 . . . . 0.0 112.173 179.539 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 74.4 t80 -130.72 132.96 45.66 Favored 'General case' 0 C--O 1.233 0.237 0 N-CA-C 109.809 -0.441 . . . . 0.0 109.809 -179.994 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 39.0 m-85 -103.81 149.53 24.96 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.655 -179.734 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -150.02 92.99 1.95 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.924 0.392 . . . . 0.0 111.025 -179.908 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 103' ' ' THR . . . . . 0.479 ' H ' HG22 ' A' ' 103' ' ' THR . 0.0 OUTLIER -70.4 136.99 50.07 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.195 179.911 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -128.25 153.32 47.08 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 120.866 0.365 . . . . 0.0 110.244 179.873 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 35.0 p -103.86 135.71 44.89 Favored 'General case' 0 N--CA 1.455 -0.208 0 CA-C-O 120.912 0.387 . . . . 0.0 110.642 179.9 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 24.8 m -163.1 161.81 25.41 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.447 179.987 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 116.68 -175.07 15.55 Favored Glycine 0 CA--C 1.522 0.52 0 N-CA-C 111.035 -0.826 . . . . 0.0 111.035 179.592 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_endo -64.66 152.22 82.72 Favored 'Trans proline' 0 C--N 1.301 -1.962 0 C-N-CA 122.725 2.283 . . . . 0.0 112.251 -179.904 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 78.1 p -66.39 -19.29 65.76 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.351 178.93 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 57.7 t-80 -86.84 -43.65 12.31 Favored 'General case' 0 CA--C 1.52 -0.188 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.541 179.821 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -124.66 77.75 63.9 Favored Pre-proline 0 N--CA 1.463 0.211 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.261 179.19 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -78.94 128.5 8.44 Favored 'Trans proline' 0 C--N 1.305 -1.716 0 C-N-CA 122.595 2.197 . . . . 0.0 112.375 -179.452 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 2.9 p -109.68 173.7 6.2 Favored 'General case' 0 CA--C 1.517 -0.305 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.321 179.485 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -131.25 143.89 50.9 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.526 -179.657 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 88.3 m -127.13 125.5 41.3 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.642 179.489 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 7.3 t -97.27 120.4 37.56 Favored 'General case' 0 CA--C 1.518 -0.258 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.389 -179.958 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 94.9 m -105.93 127.37 53.09 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.163 179.916 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 8.8 p -110.2 137.14 43.82 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.271 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.272 -179.901 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 9.1 tm-20 -124.16 130.42 52.52 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.613 -179.909 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 120' ' ' PHE . . . . . 0.626 ' CZ ' ' CE1' ' A' ' 125' ' ' PHE . 45.4 p90 -164.93 158.12 16.8 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.566 179.006 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 53.61 23.42 3.56 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.606 179.819 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 73.85 22.49 78.06 Favored Glycine 0 CA--C 1.521 0.461 0 N-CA-C 110.881 -0.888 . . . . 0.0 110.881 179.874 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -133.25 153.81 51.22 Favored 'General case' 0 CA--C 1.516 -0.337 0 CA-C-O 120.889 0.376 . . . . 0.0 110.606 179.789 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 124' ' ' VAL . . . . . 0.431 ' O ' HG13 ' A' ' 124' ' ' VAL . 7.2 p -122.2 128.61 75.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.862 -179.75 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 125' ' ' PHE . . . . . 0.626 ' CE1' ' CZ ' ' A' ' 120' ' ' PHE . 26.1 m-85 -113.33 122.33 47.09 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.249 179.408 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 4.8 p -81.97 136.64 35.26 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.512 -179.898 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -88.86 -170.26 45.23 Favored Glycine 0 CA--C 1.522 0.51 0 N-CA-C 110.785 -0.926 . . . . 0.0 110.785 179.902 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 128' ' ' GLU . . . . . 0.497 ' H ' ' CB ' ' A' ' 139' ' ' SER . 14.9 tt0 -96.55 133.98 40.34 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-O 120.872 0.368 . . . . 0.0 110.71 179.581 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -58.93 149.39 27.27 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.501 179.209 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -171.17 160.78 6.46 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.613 179.982 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -86.59 33.55 0.64 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.624 179.011 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 4.6 t -158.42 150.82 21.92 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.579 179.833 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 133' ' ' LYS . . . . . 0.417 ' NZ ' ' OG1' ' A' ' 103' ' ' THR . 68.4 mttm -82.41 -21.85 35.59 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.741 179.66 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -68.92 -54.79 13.52 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.774 -179.106 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 4.3 tp -63.61 -41.67 98.3 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 116.51 -0.314 . . . . 0.0 111.046 -179.635 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -55.46 -54.91 38.0 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.497 -179.365 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -61.01 -38.31 85.64 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.46 179.847 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 48.0 ttp -62.85 -42.7 99.85 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.387 -179.512 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 139' ' ' SER . . . . . 0.497 ' CB ' ' H ' ' A' ' 128' ' ' GLU . 63.3 m -65.23 -38.65 91.05 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.893 -179.781 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -63.42 -46.44 86.36 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.962 0.411 . . . . 0.0 110.717 -179.892 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -71.21 -22.98 61.94 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.449 179.95 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 65.7 tttm -71.62 -49.27 41.72 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.327 179.674 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 143' ' ' VAL . . . . . 0.407 HG13 ' N ' ' A' ' 144' ' ' ALA . 6.4 p -67.45 -39.03 81.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.652 -179.4 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 144' ' ' ALA . . . . . 0.407 ' N ' HG13 ' A' ' 143' ' ' VAL . . . -61.96 -44.91 95.77 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.564 -179.3 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 145' ' ' PHE . . . . . . . . . . . . . 60.2 t80 -58.48 -42.74 88.2 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.522 -179.261 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 146' ' ' MET . . . . . . . . . . . . . 56.3 mtt -63.74 -39.62 94.72 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.943 -179.604 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 68.1 m -67.18 -45.69 76.19 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.974 -179.946 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 148' ' ' ILE . . . . . . . . . . . . . 81.5 mt -52.56 -36.24 21.99 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.54 -179.509 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 54.7 mtpt -59.12 -42.75 91.35 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.782 -179.484 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 150' ' ' ASN . . . . . . . . . . . . . 94.6 m-20 -62.93 -40.12 96.68 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.362 179.803 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.743 0 CA-C-O 117.896 -1.502 . . . . 0.0 110.847 179.933 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . 0.489 ' O ' ' N ' ' A' ' 84' ' ' LYS . . . . . . . . 0 N--CA 1.453 -0.296 0 CA-C-O 120.795 0.331 . . . . 0.0 110.548 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 1.9 m-85 -45.41 -16.37 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.336 179.887 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.489 ' N ' ' O ' ' A' ' 82' ' ' ALA . 67.8 mttm -64.41 -40.13 95.18 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.11 179.677 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 13.6 m120 -66.08 -47.47 74.13 Favored 'General case' 0 N--CA 1.457 -0.098 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.485 -179.658 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 6.5 tt -60.95 -42.06 97.49 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.549 -179.319 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 34.7 mt -55.78 -37.32 68.42 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.062 -179.576 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 86.6 mt-30 -71.32 -36.69 71.68 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.981 0.419 . . . . 0.0 110.511 179.577 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 70.6 mm-40 -59.63 -49.26 78.44 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.994 -179.222 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 30.3 pt -64.29 -32.3 56.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.637 179.576 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -55.85 -49.3 73.69 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.178 -179.404 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 59.4 tt0 -67.14 -49.76 63.71 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.914 -179.683 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 65.4 tttm -58.95 -50.78 72.78 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.534 -179.335 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . 0.467 ' O ' ' CB ' ' A' ' 95' ' ' SER . 97.6 mt-10 -69.95 -15.76 63.1 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.6 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' SER . . . . . 0.467 ' CB ' ' O ' ' A' ' 94' ' ' GLU . 0.7 OUTLIER 79.17 9.91 1.64 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.433 -179.731 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 20.7 m -77.61 162.86 26.74 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.531 -179.793 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.574 HD12 ' N ' ' A' ' 97' ' ' LEU . 9.7 mp -70.22 127.49 32.97 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.683 -179.959 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.593 ' N ' HD12 ' A' ' 98' ' ' LEU . 10.1 mp -45.31 120.58 4.7 Favored Pre-proline 0 N--CA 1.452 -0.358 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.488 179.756 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -49.34 149.02 9.81 Favored 'Trans proline' 0 C--N 1.308 -1.563 0 C-N-CA 122.941 2.428 . . . . 0.0 112.866 179.404 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 85.1 t80 -130.73 133.48 46.08 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-O 121.119 0.485 . . . . 0.0 110.598 -179.32 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 88.2 m-85 -96.41 143.74 27.17 Favored 'General case' 0 N--CA 1.463 0.182 0 C-N-CA 120.745 -0.382 . . . . 0.0 111.251 -179.346 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -146.41 147.58 31.42 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.999 0.428 . . . . 0.0 110.93 -179.698 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -133.55 143.31 48.63 Favored 'General case' 0 CA--C 1.516 -0.348 0 CA-C-O 120.82 0.343 . . . . 0.0 110.463 179.594 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -120.68 146.83 46.03 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 120.882 0.373 . . . . 0.0 110.342 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 21.1 p -115.4 126.96 55.03 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.51 179.767 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 47.6 t -165.46 156.2 13.71 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.58 179.879 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 127.83 166.06 11.98 Favored Glycine 0 CA--C 1.524 0.602 0 N-CA-C 111.208 -0.757 . . . . 0.0 111.208 179.678 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' PRO . . . . . 0.57 ' HG2' ' HB3' ' A' ' 111' ' ' ALA . 29.1 Cg_endo -61.46 152.45 72.95 Favored 'Trans proline' 0 C--N 1.301 -1.957 0 C-N-CA 122.736 2.29 . . . . 0.0 112.467 179.67 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 78.1 p -64.27 -19.65 65.54 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.279 179.509 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 70.0 m80 -90.03 -38.73 13.39 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.298 179.699 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . 0.57 ' HB3' ' HG2' ' A' ' 108' ' ' PRO . . . -125.21 79.0 66.61 Favored Pre-proline 0 C--O 1.234 0.268 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.216 179.581 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 112' ' ' PRO . . . . . 0.502 ' O ' HG23 ' A' ' 113' ' ' THR . 57.3 Cg_endo -76.33 158.11 37.04 Favored 'Trans proline' 0 C--N 1.3 -2.007 0 C-N-CA 122.883 2.388 . . . . 0.0 112.111 179.657 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 113' ' ' THR . . . . . 0.502 HG23 ' O ' ' A' ' 112' ' ' PRO . 25.2 p -156.48 150.96 25.57 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.612 179.648 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -133.91 147.34 51.09 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.375 179.941 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 92.3 m -129.79 124.72 34.05 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.368 179.567 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 11.2 t -99.57 125.93 45.46 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.246 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 81.2 m -122.95 136.21 54.78 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.661 -179.527 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 12.3 p -114.83 147.89 17.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 120.962 0.41 . . . . 0.0 110.322 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 85.2 tt0 -127.23 134.32 50.11 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.415 -179.9 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . 0.623 ' CZ ' ' CE1' ' A' ' 125' ' ' PHE . 49.6 p90 -167.84 159.95 12.0 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.336 179.431 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 54.25 20.7 2.74 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.485 179.462 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 75.62 22.37 75.27 Favored Glycine 0 CA--C 1.522 0.526 0 N-CA-C 110.767 -0.933 . . . . 0.0 110.767 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -131.94 152.5 51.04 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-O 120.876 0.369 . . . . 0.0 110.567 179.839 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . 0.521 ' O ' HG13 ' A' ' 124' ' ' VAL . 7.4 p -120.35 126.61 75.45 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.289 0 CA-C-O 120.916 0.388 . . . . 0.0 110.532 -179.907 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 125' ' ' PHE . . . . . 0.623 ' CE1' ' CZ ' ' A' ' 120' ' ' PHE . 35.6 m-85 -111.42 120.01 40.73 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.294 -0.412 . . . . 0.0 109.913 179.623 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 5.2 p -83.35 137.75 33.82 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.498 -179.777 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -84.71 -168.87 45.06 Favored Glycine 0 CA--C 1.521 0.423 0 N-CA-C 110.618 -0.993 . . . . 0.0 110.618 179.908 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . 0.585 ' H ' ' CB ' ' A' ' 139' ' ' SER . 8.4 pt-20 -98.68 132.97 43.65 Favored 'General case' 0 C--N 1.33 -0.266 0 O-C-N 122.701 -0.293 . . . . 0.0 110.699 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -54.13 144.71 18.96 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.224 179.258 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -169.76 159.92 8.36 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.319 -179.729 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 25.7 pttm -90.9 33.65 0.93 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.527 179.702 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 3.4 t -158.05 149.35 21.24 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.586 -179.612 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -79.65 -32.76 41.63 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.213 179.579 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -59.17 -52.97 63.43 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.005 -178.893 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 4.0 tp -65.32 -40.2 93.43 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.292 -179.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -56.35 -54.91 39.97 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.357 -179.597 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -57.92 -39.93 79.18 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.515 -179.83 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 50.7 ttp -63.47 -41.52 98.6 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.767 -179.753 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 139' ' ' SER . . . . . 0.585 ' CB ' ' H ' ' A' ' 128' ' ' GLU . 78.0 p -63.95 -35.73 81.66 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.777 -179.53 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -67.64 -47.03 70.73 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.785 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -71.24 -25.47 62.5 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.93 179.934 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -70.94 -49.36 46.44 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.184 179.832 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 143' ' ' VAL . . . . . 0.452 HG13 ' N ' ' A' ' 144' ' ' ALA . 8.3 p -68.39 -40.05 81.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.885 -179.8 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 144' ' ' ALA . . . . . 0.452 ' N ' HG13 ' A' ' 143' ' ' VAL . . . -62.21 -46.3 89.48 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.941 -179.471 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 145' ' ' PHE . . . . . . . . . . . . . 74.9 t80 -60.26 -42.08 94.58 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.925 0.393 . . . . 0.0 110.621 179.993 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 146' ' ' MET . . . . . . . . . . . . . 33.5 ttm -62.37 -39.58 93.65 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.044 -179.829 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 35.9 t -68.66 -43.45 76.16 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.99 -179.783 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 148' ' ' ILE . . . . . . . . . . . . . 85.4 mt -56.98 -29.94 32.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.796 -179.598 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 25.0 mtpp . . . . . 0 C--N 1.325 -0.483 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.766 -179.944 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . 0.493 ' C ' ' N ' ' A' ' 84' ' ' LYS . . . . . . . . 0 N--CA 1.451 -0.422 0 CA-C-O 121.166 0.508 . . . . 0.0 110.332 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 3.0 m-85 -47.43 -15.5 0.05 OUTLIER 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.788 -0.642 . . . . 0.0 109.766 179.452 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.493 ' N ' ' C ' ' A' ' 82' ' ' ALA . 99.4 mttt -63.74 -39.95 95.52 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.05 179.795 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . 0.416 ' OD1' ' OE2' ' A' ' 89' ' ' GLU . 24.6 t-20 -66.19 -46.5 77.1 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.675 -0.693 . . . . 0.0 111.049 -179.689 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 6.0 tt -60.54 -42.64 96.94 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.677 -179.547 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 56.9 mt -56.22 -35.06 66.91 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.117 179.794 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 88.6 mt-30 -74.68 -37.46 62.67 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.08 179.26 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . 0.416 ' OE2' ' OD1' ' A' ' 85' ' ' ASN . 97.6 mt-10 -63.32 -50.34 70.43 Favored 'General case' 0 C--O 1.232 0.142 0 C-N-CA 120.776 -0.369 . . . . 0.0 111.415 -179.173 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.462 HD12 ' N ' ' A' ' 91' ' ' ALA . 2.2 pp -66.21 -41.73 89.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.304 179.78 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . 0.462 ' N ' HD12 ' A' ' 90' ' ' ILE . . . -57.18 -48.7 78.07 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.527 -179.871 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 88.6 mt-30 -71.8 -41.33 68.4 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.802 179.779 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 88.9 tttt -60.88 -49.27 78.13 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.551 -179.576 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . 0.429 ' C ' ' H ' ' A' ' 96' ' ' SER . 98.0 mt-10 -75.95 9.21 2.55 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.379 179.947 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' SER . . . . . 0.436 ' O ' ' O ' ' A' ' 96' ' ' SER . 13.9 t 55.06 9.03 0.28 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.571 179.955 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . 0.436 ' O ' ' O ' ' A' ' 95' ' ' SER . 5.4 t -59.89 -130.82 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.226 179.724 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 92.3 mt -134.85 124.73 25.51 Favored 'General case' 0 CA--C 1.515 -0.388 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.588 179.895 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.544 ' N ' HD12 ' A' ' 98' ' ' LEU . 10.7 mp -44.94 151.29 0.65 Allowed Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.439 -179.385 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_endo -66.88 170.88 11.96 Favored 'Trans proline' 0 C--N 1.308 -1.559 0 C-N-CA 122.836 2.357 . . . . 0.0 111.931 -179.896 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 32.8 t80 -143.82 114.76 7.79 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.178 179.246 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 97.7 m-85 -96.2 129.93 43.39 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.933 0.397 . . . . 0.0 110.253 -179.948 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -147.44 147.86 30.66 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.427 -179.81 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 1.5 t -136.3 146.16 46.31 Favored 'General case' 0 CA--C 1.518 -0.252 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.563 179.866 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -121.35 146.17 47.13 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.156 179.935 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 12.1 p -114.64 126.2 54.62 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-O 120.978 0.418 . . . . 0.0 110.39 179.839 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 52.8 p -160.72 164.17 31.83 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.275 179.817 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 119.64 163.8 12.41 Favored Glycine 0 CA--C 1.525 0.698 0 N-CA-C 111.005 -0.838 . . . . 0.0 111.005 179.681 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 22.4 Cg_endo -61.15 151.75 76.6 Favored 'Trans proline' 0 C--N 1.304 -1.811 0 C-N-CA 122.938 2.425 . . . . 0.0 112.127 179.537 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 38.8 t -62.94 -19.35 64.17 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.209 179.193 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 58.3 m170 -89.39 -44.09 10.43 Favored 'General case' 0 CA--C 1.517 -0.301 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.499 179.91 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -124.56 77.56 63.21 Favored Pre-proline 0 N--CA 1.467 0.387 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.156 179.244 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 112' ' ' PRO . . . . . 0.457 ' O ' HG23 ' A' ' 113' ' ' THR . 72.9 Cg_endo -77.33 165.09 28.15 Favored 'Trans proline' 0 C--N 1.306 -1.672 0 C-N-CA 122.661 2.24 . . . . 0.0 112.367 -179.694 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 113' ' ' THR . . . . . 0.457 HG23 ' O ' ' A' ' 112' ' ' PRO . 38.8 p -156.17 151.4 26.6 Favored 'General case' 0 CA--C 1.516 -0.352 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.314 179.929 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -132.49 145.79 51.44 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.442 -179.853 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 88.7 m -133.45 128.15 34.84 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.184 -0.462 . . . . 0.0 109.991 179.63 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 27.6 t -102.19 129.76 48.66 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.471 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 65.4 m -119.09 132.63 56.03 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.032 -179.908 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 12.8 p -113.64 146.15 18.6 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.214 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.104 -179.597 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 81.2 tt0 -131.07 139.2 49.86 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.724 179.929 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . 0.626 ' CZ ' ' CE1' ' A' ' 125' ' ' PHE . 52.4 p90 -168.89 160.26 10.09 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.576 179.739 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 51.87 22.42 1.74 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.992 0.425 . . . . 0.0 110.683 179.697 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 75.88 22.74 73.82 Favored Glycine 0 CA--C 1.524 0.65 0 N-CA-C 111.132 -0.787 . . . . 0.0 111.132 179.825 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -132.19 151.02 52.02 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 110.089 -0.337 . . . . 0.0 110.089 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . 0.446 ' O ' HG13 ' A' ' 124' ' ' VAL . 6.5 p -118.23 125.06 73.99 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.225 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.93 -179.644 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 125' ' ' PHE . . . . . 0.626 ' CE1' ' CZ ' ' A' ' 120' ' ' PHE . 63.0 m-85 -110.14 117.53 33.96 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 116.185 -0.461 . . . . 0.0 109.888 179.903 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 6.0 p -80.6 132.12 35.59 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.503 -179.909 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -84.69 -167.64 43.24 Favored Glycine 0 CA--C 1.52 0.391 0 N-CA-C 110.614 -0.995 . . . . 0.0 110.614 179.689 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . 0.441 ' H ' ' CB ' ' A' ' 139' ' ' SER . 4.6 pt-20 -90.77 -178.6 5.3 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.835 0.35 . . . . 0.0 110.182 -179.905 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 129' ' ' GLU . . . . . 0.539 ' N ' ' OE1' ' A' ' 129' ' ' GLU . 55.1 mp0 -110.8 145.7 37.69 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.235 178.995 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -170.24 163.35 8.91 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.689 -179.936 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 62.1 mttp -85.83 35.31 0.62 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.37 179.354 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 7.5 t -157.54 150.54 23.32 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.676 179.887 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 63.2 mttp -82.06 -34.73 29.3 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.824 179.398 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . 0.405 ' N ' ' CD ' ' A' ' 134' ' ' LYS . 13.6 mptt -56.66 -54.34 47.18 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.84 -178.789 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 11.6 tp -63.34 -38.43 91.12 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.559 -179.696 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -58.13 -54.48 46.51 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.808 -179.574 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 81.1 mm-40 -58.75 -42.74 89.59 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.797 0.332 . . . . 0.0 110.403 -179.674 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 26.1 ttm -61.48 -41.41 97.21 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.664 179.882 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 139' ' ' SER . . . . . 0.441 ' CB ' ' H ' ' A' ' 128' ' ' GLU . 15.7 m -58.81 -39.93 82.6 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.786 -179.699 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -64.88 -42.23 95.0 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.93 0.395 . . . . 0.0 111.046 -179.897 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -69.66 -28.81 66.2 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.95 179.97 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 85.5 mttt -71.73 -49.79 36.09 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.79 179.694 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 143' ' ' VAL . . . . . 0.484 HG13 ' N ' ' A' ' 144' ' ' ALA . 7.3 p -67.34 -42.52 87.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.737 -179.581 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 144' ' ' ALA . . . . . 0.484 ' N ' HG13 ' A' ' 143' ' ' VAL . . . -63.16 -46.47 87.04 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.901 -179.81 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 145' ' ' PHE . . . . . . . . . . . . . 69.6 t80 -60.21 -42.69 95.68 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.534 -179.757 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 146' ' ' MET . . . . . . . . . . . . . 54.6 ttp -61.43 -37.57 84.01 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.631 -179.487 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 37.6 t -71.29 -44.28 65.48 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.962 0.41 . . . . 0.0 111.133 179.858 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 148' ' ' ILE . . . . . . . . . . . . . 90.6 mt -55.95 -30.44 28.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.525 -179.752 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 53.3 mtpt . . . . . 0 C--N 1.323 -0.55 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.789 179.888 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . 0.493 ' C ' ' N ' ' A' ' 84' ' ' LYS . . . . . . . . 0 N--CA 1.447 -0.589 0 CA-C-O 121.253 0.549 . . . . 0.0 110.187 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 2.2 m-85 -46.46 -16.09 0.03 OUTLIER 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 115.845 -0.616 . . . . 0.0 109.929 179.633 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.493 ' N ' ' C ' ' A' ' 82' ' ' ALA . 68.4 mttm -63.9 -39.74 94.89 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.089 179.67 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 45.2 t30 -66.58 -47.07 73.92 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.679 -179.838 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 7.0 tt -61.76 -41.34 97.56 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.812 -179.905 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 32.3 mt -55.79 -36.24 67.18 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.139 -0.482 . . . . 0.0 109.856 -179.527 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 90.5 mt-30 -72.29 -36.05 68.85 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.294 179.29 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 70.3 mm-40 -60.34 -47.3 86.64 Favored 'General case' 0 C--O 1.233 0.216 0 C-N-CA 120.779 -0.368 . . . . 0.0 111.043 -179.131 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 28.0 pt -65.08 -32.89 60.23 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.499 179.869 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -55.49 -49.28 72.95 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.541 -179.604 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . 0.606 HE21 HD11 ' A' ' 98' ' ' LEU . 90.4 mm-40 -67.92 -49.46 61.74 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.301 -0.408 . . . . 0.0 111.116 179.798 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -58.88 -51.25 70.85 Favored 'General case' 0 C--N 1.331 -0.203 0 C-N-CA 120.702 -0.399 . . . . 0.0 110.786 -179.379 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . 0.406 ' O ' ' CB ' ' A' ' 95' ' ' SER . 80.4 mm-40 -68.97 -13.75 62.64 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.666 179.748 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' SER . . . . . 0.406 ' CB ' ' O ' ' A' ' 94' ' ' GLU . 1.0 OUTLIER 75.45 10.37 3.52 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.287 -179.861 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 8.6 p -79.71 166.2 22.04 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.659 -179.518 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 70.3 mt -72.7 133.8 44.76 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.932 0.396 . . . . 0.0 110.739 -179.706 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.606 HD11 HE21 ' A' ' 92' ' ' GLN . 11.0 mp -44.81 152.92 0.51 Allowed Pre-proline 0 C--N 1.327 -0.405 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.71 -179.651 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_endo -61.17 170.0 5.55 Favored 'Trans proline' 0 N--CA 1.496 1.654 0 C-N-CA 122.847 2.365 . . . . 0.0 111.889 179.964 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 42.6 t80 -145.9 117.92 8.28 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.454 179.172 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' TYR . . . . . 0.471 ' CE2' ' NZ ' ' A' ' 84' ' ' LYS . 96.9 m-85 -102.79 136.62 42.28 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.898 0.38 . . . . 0.0 110.349 179.949 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -145.98 146.68 31.1 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.455 -179.803 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 92.2 m -124.31 130.86 53.25 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.314 179.926 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -111.35 139.8 46.45 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.529 -0.305 . . . . 0.0 110.224 179.825 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 22.7 p -117.22 122.71 44.76 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-O 121.019 0.438 . . . . 0.0 110.803 179.499 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 51.8 p -162.52 162.6 27.45 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.325 179.893 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 126.4 165.45 11.99 Favored Glycine 0 CA--C 1.523 0.54 0 N-CA-C 111.118 -0.793 . . . . 0.0 111.118 179.511 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -60.54 150.9 79.1 Favored 'Trans proline' 0 C--N 1.304 -1.796 0 C-N-CA 122.787 2.325 . . . . 0.0 112.036 179.378 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 99.0 p -63.2 -16.74 61.1 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.416 179.379 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 84.6 t60 -92.66 -43.4 9.11 Favored 'General case' 0 CA--C 1.519 -0.23 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.627 179.759 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -124.24 78.16 60.45 Favored Pre-proline 0 CA--C 1.531 0.219 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.527 179.807 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 112' ' ' PRO . . . . . 0.473 ' O ' HG23 ' A' ' 113' ' ' THR . 70.2 Cg_endo -76.43 163.22 32.49 Favored 'Trans proline' 0 C--N 1.305 -1.718 0 C-N-CA 122.669 2.246 . . . . 0.0 112.192 -179.949 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 113' ' ' THR . . . . . 0.473 HG23 ' O ' ' A' ' 112' ' ' PRO . 31.0 p -156.61 151.32 25.81 Favored 'General case' 0 CA--C 1.514 -0.431 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.132 179.375 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -131.27 144.52 51.35 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.022 -0.535 . . . . 0.0 109.734 -179.801 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 115' ' ' THR . . . . . 0.424 ' OG1' ' OE1' ' A' ' 129' ' ' GLU . 72.4 m -130.33 125.5 34.84 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.932 0.396 . . . . 0.0 110.16 179.822 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 11.7 t -96.94 122.4 39.88 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.018 179.779 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 52.2 m -114.24 130.62 56.64 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.131 179.911 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 10.8 p -113.33 143.51 22.88 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.234 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.908 -179.953 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 80.9 tt0 -128.05 135.32 49.7 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.64 179.957 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . 0.622 ' CZ ' ' CE1' ' A' ' 125' ' ' PHE . 52.6 p90 -167.26 158.5 11.93 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.5 179.709 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 54.64 21.56 3.51 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.857 0.361 . . . . 0.0 110.594 179.587 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 76.0 22.59 73.81 Favored Glycine 0 CA--C 1.521 0.468 0 N-CA-C 110.869 -0.893 . . . . 0.0 110.869 179.927 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -132.34 151.99 51.61 Favored 'General case' 0 C--N 1.328 -0.338 0 O-C-N 122.768 -0.254 . . . . 0.0 110.413 -179.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . 0.428 ' O ' HG13 ' A' ' 124' ' ' VAL . 7.1 p -121.34 127.77 75.8 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.555 -179.782 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 125' ' ' PHE . . . . . 0.622 ' CE1' ' CZ ' ' A' ' 120' ' ' PHE . 24.1 m-85 -113.11 120.3 40.81 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.163 179.782 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 84.4 p -81.21 136.07 35.81 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.544 179.895 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -83.82 -169.89 45.79 Favored Glycine 0 CA--C 1.524 0.629 0 N-CA-C 110.689 -0.964 . . . . 0.0 110.689 179.806 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . 0.491 ' H ' ' CB ' ' A' ' 139' ' ' SER . 12.2 tt0 -99.1 134.18 42.31 Favored 'General case' 0 N--CA 1.448 -0.525 0 CA-C-O 121.014 0.435 . . . . 0.0 110.715 179.596 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 129' ' ' GLU . . . . . 0.424 ' OE1' ' OG1' ' A' ' 115' ' ' THR . 70.4 mm-40 -56.06 146.05 23.9 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.385 179.109 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -169.5 159.95 8.82 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.517 -179.936 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 52.4 mtpt -88.97 33.07 0.79 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.63 179.462 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 3.6 t -158.49 150.17 21.18 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.688 179.835 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 55.8 mtmt -82.58 -21.44 35.24 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.785 179.364 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 59.5 mttp -69.59 -53.95 16.39 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.788 -179.447 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 4.1 tp -64.3 -40.24 95.54 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-O 120.789 0.328 . . . . 0.0 111.002 -179.796 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -57.29 -54.29 48.41 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.355 -179.111 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 75.8 mm-40 -56.51 -40.87 75.73 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.854 0.359 . . . . 0.0 110.512 -179.869 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 51.8 mtt -62.99 -41.39 99.55 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.967 -179.616 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 139' ' ' SER . . . . . 0.491 ' CB ' ' H ' ' A' ' 128' ' ' GLU . 68.7 m -62.92 -40.74 98.51 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 121.04 -0.264 . . . . 0.0 111.19 -179.95 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -62.37 -45.82 91.44 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.102 0.477 . . . . 0.0 110.59 -179.583 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -69.83 -25.49 63.77 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.936 179.991 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 142' ' ' LYS . . . . . 0.513 ' O ' ' SD ' ' A' ' 146' ' ' MET . 37.5 ttpt -71.43 -49.72 38.88 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.042 0.449 . . . . 0.0 111.597 -179.992 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 143' ' ' VAL . . . . . 0.424 HG13 ' N ' ' A' ' 144' ' ' ALA . 7.6 p -67.33 -39.62 83.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.067 -179.693 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 144' ' ' ALA . . . . . 0.424 ' N ' HG13 ' A' ' 143' ' ' VAL . . . -63.28 -46.48 86.62 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-N 116.339 -0.392 . . . . 0.0 111.079 -179.098 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 145' ' ' PHE . . . . . . . . . . . . . 65.6 t80 -59.84 -42.28 93.24 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.484 -0.325 . . . . 0.0 110.573 -179.71 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 146' ' ' MET . . . . . 0.581 ' N ' ' SD ' ' A' ' 146' ' ' MET . 0.0 OUTLIER -63.07 -39.34 94.44 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.764 -179.601 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 72.8 p -67.76 -42.1 82.29 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.989 -179.858 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 148' ' ' ILE . . . . . . . . . . . . . 93.3 mt -59.05 -30.85 44.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.78 -179.675 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 54.9 mtpt . . . . . 0 C--N 1.328 -0.344 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.802 -179.996 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . 0.486 ' C ' ' N ' ' A' ' 84' ' ' LYS . . . . . . . . 0 N--CA 1.45 -0.44 0 CA-C-O 121.118 0.485 . . . . 0.0 109.723 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -47.58 -16.35 0.06 Allowed 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.526 -0.761 . . . . 0.0 109.761 179.792 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.486 ' N ' ' C ' ' A' ' 82' ' ' ALA . 51.9 mtmt -63.73 -41.08 98.11 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.027 179.843 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 34.1 t30 -64.68 -47.91 76.65 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.934 -179.517 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 6.3 tt -61.92 -39.69 92.93 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.885 -179.684 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.513 HD23 HD11 ' A' ' 90' ' ' ILE . 29.9 mt -56.75 -38.71 72.8 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 -179.628 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 84.5 mt-30 -68.96 -36.2 77.64 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.682 179.214 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 80.7 mm-40 -61.74 -48.14 82.04 Favored 'General case' 0 C--O 1.232 0.154 0 C-N-CA 120.67 -0.412 . . . . 0.0 111.355 -179.066 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.513 HD11 HD23 ' A' ' 87' ' ' LEU . 27.2 pt -65.0 -35.15 74.79 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.501 179.804 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -58.83 -49.88 76.07 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.687 -179.516 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 68.4 tp60 -66.77 -47.33 72.51 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.992 -179.738 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -61.48 -47.83 83.85 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.607 -179.31 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . 0.432 ' O ' ' CB ' ' A' ' 95' ' ' SER . 80.3 mm-40 -71.68 -14.42 62.03 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.575 179.806 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' SER . . . . . 0.432 ' CB ' ' O ' ' A' ' 94' ' ' GLU . 0.7 OUTLIER 78.94 9.11 1.85 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.383 -179.996 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 17.5 m -77.81 164.39 25.25 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.504 179.918 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 69.2 mt -69.68 129.24 39.07 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.495 -179.654 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.569 ' N ' HD12 ' A' ' 98' ' ' LEU . 10.3 mp -45.63 147.93 1.4 Allowed Pre-proline 0 CA--C 1.533 0.321 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.54 -179.491 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -69.77 140.76 43.45 Favored 'Trans proline' 0 N--CA 1.494 1.513 0 C-N-CA 122.74 2.293 . . . . 0.0 111.767 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 88.9 t80 -125.95 128.77 48.03 Favored 'General case' 0 CA--C 1.511 -0.529 0 N-CA-C 108.542 -0.91 . . . . 0.0 108.542 -179.966 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 88.5 m-85 -97.51 145.32 26.34 Favored 'General case' 0 C--N 1.324 -0.53 0 C-N-CA 120.706 -0.398 . . . . 0.0 110.321 -179.07 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -144.19 145.67 32.23 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 110.174 -0.306 . . . . 0.0 110.174 179.651 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 96.8 m -125.97 132.11 52.12 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.499 179.927 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -125.45 151.85 45.69 Favored 'General case' 0 N--CA 1.467 0.391 0 N-CA-C 109.999 -0.371 . . . . 0.0 109.999 179.798 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 22.1 p -110.4 135.38 51.19 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-O 120.834 0.349 . . . . 0.0 110.258 179.85 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 30.3 p -161.33 163.06 31.02 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.26 179.903 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 120.07 -176.09 16.08 Favored Glycine 0 CA--C 1.527 0.836 0 N-CA-C 111.328 -0.709 . . . . 0.0 111.328 179.556 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -61.75 153.44 67.63 Favored 'Trans proline' 0 N--CA 1.495 1.59 0 C-N-CA 122.655 2.236 . . . . 0.0 112.276 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 6.5 m -68.3 -16.26 63.88 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.735 -0.666 . . . . 0.0 109.97 179.156 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 55.4 t-80 -90.81 -43.63 9.94 Favored 'General case' 0 CA--C 1.518 -0.253 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.442 179.774 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -124.4 78.52 61.52 Favored Pre-proline 0 CA--C 1.533 0.303 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.413 179.271 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -81.08 129.74 7.02 Favored 'Trans proline' 0 C--N 1.313 -1.31 0 C-N-CA 122.464 2.109 . . . . 0.0 112.466 179.835 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 72.2 p -111.2 173.44 6.34 Favored 'General case' 0 CA--C 1.515 -0.388 0 CA-C-N 115.885 -0.598 . . . . 0.0 109.895 179.926 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -130.81 145.19 51.91 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.444 -179.768 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 88.4 m -125.25 120.36 31.02 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.198 -0.455 . . . . 0.0 109.821 179.493 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . 0.422 ' O ' ' HB2' ' A' ' 140' ' ' ALA . 35.9 t -95.66 122.77 38.78 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.36 -179.837 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . 0.517 HG22 ' N ' ' A' ' 118' ' ' VAL . 54.0 m -107.17 159.89 15.99 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.029 179.937 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 118' ' ' VAL . . . . . 0.517 ' N ' HG22 ' A' ' 117' ' ' THR . 14.7 p -141.25 137.94 33.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.187 -0.46 . . . . 0.0 109.965 179.664 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 81.2 tt0 -121.82 127.15 50.23 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.634 179.848 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . 0.403 ' CZ ' ' CE1' ' A' ' 125' ' ' PHE . 42.1 p90 -159.6 154.57 24.82 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.519 179.225 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 52.18 25.66 3.44 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.888 0.375 . . . . 0.0 110.902 179.557 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 72.75 23.68 77.46 Favored Glycine 0 CA--C 1.522 0.501 0 N-CA-C 111.002 -0.839 . . . . 0.0 111.002 179.849 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 45.7 mmtt -130.93 150.57 52.03 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 110.224 -0.288 . . . . 0.0 110.224 -179.78 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . 0.431 ' O ' HG13 ' A' ' 124' ' ' VAL . 6.2 p -120.59 125.74 74.45 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.627 -179.987 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 125' ' ' PHE . . . . . 0.403 ' CE1' ' CZ ' ' A' ' 120' ' ' PHE . 41.9 m-85 -112.05 120.6 42.4 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.262 179.774 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 43.1 t -82.29 137.11 34.91 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.515 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -84.76 -169.63 46.07 Favored Glycine 0 CA--C 1.521 0.466 0 N-CA-C 110.559 -1.017 . . . . 0.0 110.559 179.802 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -99.28 136.06 39.78 Favored 'General case' 0 CA--C 1.532 0.264 0 O-C-N 122.769 -0.254 . . . . 0.0 111.068 -179.577 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 18.4 pt-20 -54.29 142.59 25.9 Favored 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 120.403 -0.519 . . . . 0.0 110.138 179.589 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -162.94 155.74 19.1 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.602 179.835 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 51.2 tttm -90.49 31.09 1.05 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.302 179.918 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 7.4 t -159.06 149.53 19.57 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.765 179.798 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -73.7 -40.61 63.48 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.188 179.388 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -53.36 -55.17 27.07 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.949 -178.75 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 12.1 tp -64.32 -39.44 93.92 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.785 0.326 . . . . 0.0 110.845 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -57.08 -55.18 38.1 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.678 -179.305 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -59.86 -42.12 92.96 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.841 0.353 . . . . 0.0 110.46 -179.54 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 41.5 tpp -60.19 -46.32 90.13 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.371 -179.606 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 37.1 m -61.3 -37.04 81.78 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.009 -179.812 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . 0.422 ' HB2' ' O ' ' A' ' 116' ' ' SER . . . -63.97 -47.57 79.86 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.936 0.398 . . . . 0.0 110.725 179.781 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -73.2 -23.48 60.4 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.742 179.901 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -70.81 -49.58 44.82 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.227 179.968 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 143' ' ' VAL . . . . . 0.468 HG13 ' N ' ' A' ' 144' ' ' ALA . 7.1 p -68.87 -41.49 82.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.786 -179.767 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 144' ' ' ALA . . . . . 0.468 ' N ' HG13 ' A' ' 143' ' ' VAL . . . -63.72 -46.09 86.99 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.698 -179.857 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 145' ' ' PHE . . . . . . . . . . . . . 84.7 t80 -60.56 -43.41 97.3 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.809 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 146' ' ' MET . . . . . . . . . . . . . 79.8 mmm -63.02 -37.56 87.69 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.476 -179.773 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 37.8 m -72.29 -43.14 64.67 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 120.784 -0.366 . . . . 0.0 111.044 179.569 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 148' ' ' ILE . . . . . . . . . . . . . 71.5 mt -55.87 -27.3 22.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 C-N-CA 120.956 -0.298 . . . . 0.0 110.78 -179.559 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 41.6 mttt . . . . . 0 C--N 1.325 -0.488 0 C-N-CA 120.653 -0.419 . . . . 0.0 111.242 179.662 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . 0.49 ' C ' ' N ' ' A' ' 84' ' ' LYS . . . . . . . . 0 N--CA 1.452 -0.35 0 CA-C-O 121.143 0.497 . . . . 0.0 110.019 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -47.07 -15.75 0.04 OUTLIER 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.689 -0.687 . . . . 0.0 109.885 179.551 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.49 ' N ' ' C ' ' A' ' 82' ' ' ALA . 99.4 mttt -64.44 -40.51 95.87 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.08 179.759 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . 0.414 ' O ' ' OE2' ' A' ' 89' ' ' GLU . 94.5 m-20 -65.12 -47.82 75.81 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.843 -179.769 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 6.3 tt -60.68 -40.54 92.53 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.908 -179.631 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.608 HD23 HD11 ' A' ' 90' ' ' ILE . 38.2 mt -56.6 -37.68 70.98 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.269 -0.423 . . . . 0.0 109.995 -179.779 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 87.4 mt-30 -69.83 -36.97 76.03 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.429 179.526 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . 0.521 ' OE1' ' N ' ' A' ' 89' ' ' GLU . 0.3 OUTLIER -61.63 -48.85 79.01 Favored 'General case' 0 C--O 1.233 0.22 0 C-N-CA 120.774 -0.37 . . . . 0.0 111.037 -178.932 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.608 HD11 HD23 ' A' ' 87' ' ' LEU . 19.2 pt -63.74 -40.47 89.17 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.663 -179.693 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . 0.401 ' N ' HG13 ' A' ' 90' ' ' ILE . . . -59.57 -48.88 79.93 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.657 -179.78 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 58.6 tt0 -68.71 -41.98 78.35 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.722 179.717 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 65.1 tttm -61.7 -49.5 76.2 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.693 -179.73 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . 0.419 ' O ' ' CB ' ' A' ' 95' ' ' SER . 98.1 mt-10 -66.6 -19.58 65.8 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.456 179.627 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' SER . . . . . 0.419 ' CB ' ' O ' ' A' ' 94' ' ' GLU . 1.1 t 76.02 21.21 1.58 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.013 -179.654 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 12.8 p -79.56 -114.73 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.283 -179.874 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 54.4 tp -141.03 126.55 18.83 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.398 179.747 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.561 ' N ' HD12 ' A' ' 98' ' ' LEU . 10.4 mp -44.91 143.94 2.1 Favored Pre-proline 0 C--N 1.327 -0.375 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.704 -179.503 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -70.26 139.35 38.31 Favored 'Trans proline' 0 N--CA 1.495 1.601 0 C-N-CA 122.508 2.139 . . . . 0.0 111.899 -179.897 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 86.8 t80 -128.05 129.08 46.09 Favored 'General case' 0 CA--C 1.514 -0.422 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 -179.527 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 81.6 m-85 -96.53 146.14 25.07 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.588 -179.126 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -147.35 148.14 31.04 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.242 179.967 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 1.2 t -130.67 138.22 49.94 Favored 'General case' 0 CA--C 1.519 -0.217 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.666 179.75 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -123.02 150.77 42.62 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.289 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 30.1 p -108.79 136.5 48.26 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-O 120.863 0.363 . . . . 0.0 110.152 179.757 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 38.6 t -164.01 160.97 22.4 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.22 -179.812 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 119.43 -179.13 16.67 Favored Glycine 0 CA--C 1.522 0.521 0 N-CA-C 111.21 -0.756 . . . . 0.0 111.21 179.908 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_endo -61.07 148.57 92.44 Favored 'Trans proline' 0 C--N 1.308 -1.57 0 C-N-CA 122.828 2.352 . . . . 0.0 112.139 -179.881 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 32.7 t -63.5 -16.63 61.26 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.819 -0.628 . . . . 0.0 109.872 179.124 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 61.3 t-80 -89.22 -44.0 10.59 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.396 179.872 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -125.58 77.81 68.97 Favored Pre-proline 0 N--CA 1.465 0.286 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.38 179.124 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -81.42 128.97 6.41 Favored 'Trans proline' 0 C--N 1.306 -1.677 0 C-N-CA 122.467 2.111 . . . . 0.0 112.253 179.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 4.4 p -108.77 173.07 6.48 Favored 'General case' 0 CA--C 1.515 -0.38 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.049 179.712 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -133.62 147.42 51.48 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.493 -179.455 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 85.6 m -129.11 123.1 31.32 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.137 179.602 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 35.0 t -96.74 125.17 41.01 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.25 -179.861 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 98.2 m -121.86 133.8 54.88 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.289 -179.74 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 13.8 p -118.51 152.3 20.66 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.208 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.255 -179.622 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -131.01 139.15 49.94 Favored 'General case' 0 CA--C 1.52 -0.185 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.592 -179.803 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . 0.626 ' CZ ' ' CE1' ' A' ' 125' ' ' PHE . 54.1 p90 -166.71 159.04 13.57 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.718 179.964 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 51.72 24.28 2.35 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.873 0.368 . . . . 0.0 110.519 179.701 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 73.21 23.02 78.37 Favored Glycine 0 CA--C 1.524 0.613 0 N-CA-C 111.009 -0.836 . . . . 0.0 111.009 179.829 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -131.22 150.41 52.16 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.885 0.374 . . . . 0.0 110.322 -179.893 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . 0.541 HG22 ' N ' ' A' ' 125' ' ' PHE . 14.9 p -104.73 160.38 5.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.792 -179.461 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 125' ' ' PHE . . . . . 0.626 ' CE1' ' CZ ' ' A' ' 120' ' ' PHE . 85.8 m-85 -153.4 108.92 3.24 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.413 179.908 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 69.1 m -84.29 142.24 30.37 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.799 -179.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -85.85 -167.3 43.29 Favored Glycine 0 CA--C 1.519 0.317 0 N-CA-C 110.536 -1.026 . . . . 0.0 110.536 179.783 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . 0.416 ' H ' ' CB ' ' A' ' 139' ' ' SER . 5.3 pt-20 -99.38 134.52 42.14 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-O 120.803 0.335 . . . . 0.0 110.902 -179.676 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 97.3 mt-10 -51.2 138.63 20.12 Favored 'General case' 0 C--N 1.322 -0.599 0 C-N-CA 120.489 -0.485 . . . . 0.0 110.296 179.642 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -160.53 155.03 23.61 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.661 -179.964 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 40.9 tttp -88.19 32.33 0.77 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.987 0.422 . . . . 0.0 110.334 179.867 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 4.9 t -160.57 153.95 22.0 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.531 179.875 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -79.68 -37.35 36.01 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.019 179.854 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -56.63 -54.41 46.35 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.991 -178.948 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 4.9 tp -63.99 -39.17 93.52 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-O 120.654 0.264 . . . . 0.0 110.76 -179.807 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -59.25 -54.44 46.82 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.712 -179.502 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 99.1 mt-10 -57.15 -44.98 83.94 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.714 0.293 . . . . 0.0 110.677 -179.535 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 72.3 mtm -62.78 -41.04 99.07 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.528 -179.75 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 139' ' ' SER . . . . . 0.416 ' CB ' ' H ' ' A' ' 128' ' ' GLU . 20.4 m -60.0 -39.26 85.15 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 120.999 -0.281 . . . . 0.0 110.585 -179.938 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -64.43 -42.29 96.1 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.962 0.41 . . . . 0.0 110.672 -179.842 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -69.49 -27.52 65.28 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.684 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 65.7 mttm -71.63 -49.85 36.17 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.379 179.83 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 143' ' ' VAL . . . . . 0.441 HG13 ' N ' ' A' ' 144' ' ' ALA . 7.5 p -67.56 -41.11 85.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.622 -179.763 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 144' ' ' ALA . . . . . 0.441 ' N ' HG13 ' A' ' 143' ' ' VAL . . . -64.01 -45.97 86.61 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.804 0.335 . . . . 0.0 110.473 -179.986 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 145' ' ' PHE . . . . . . . . . . . . . 70.9 t80 -60.89 -43.98 97.76 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.606 -179.737 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 146' ' ' MET . . . . . . . . . . . . . 48.8 ttp -60.96 -38.78 87.11 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.688 -179.653 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 37.7 t -67.61 -42.27 82.65 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.927 0.394 . . . . 0.0 111.193 -179.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 148' ' ' ILE . . . . . . . . . . . . . 93.7 mt -60.85 -29.16 44.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.076 -179.386 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 53.6 mtpt . . . . . 0 C--N 1.324 -0.525 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.139 179.973 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . 0.491 ' C ' ' N ' ' A' ' 84' ' ' LYS . . . . . . . . 0 N--CA 1.45 -0.44 0 CA-C-O 121.135 0.493 . . . . 0.0 110.344 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 -46.55 -15.29 0.03 OUTLIER 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.109 179.302 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.491 ' N ' ' C ' ' A' ' 82' ' ' ALA . 99.4 mttt -64.87 -40.63 95.44 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.118 179.342 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 66.3 t30 -66.11 -48.24 71.52 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.549 -0.751 . . . . 0.0 110.803 -179.632 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 6.5 tt -60.21 -42.37 94.98 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.809 -179.33 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.475 HD23 HD11 ' A' ' 90' ' ' ILE . 38.1 mt -55.7 -35.96 66.64 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.118 -179.561 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 88.7 mt-30 -71.59 -36.12 70.75 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.401 179.328 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 81.1 mm-40 -61.11 -48.96 79.25 Favored 'General case' 0 N--CA 1.462 0.146 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.793 -179.041 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.475 HD11 HD23 ' A' ' 87' ' ' LEU . 26.8 pt -66.11 -35.87 76.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.584 179.802 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -59.43 -50.34 74.31 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.518 -179.511 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 87.8 mt-30 -70.65 -43.76 68.52 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.804 179.845 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -60.32 -50.91 71.73 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.67 -179.595 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 -69.35 -2.61 11.33 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.29 179.848 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 1.5 m 62.3 16.67 8.68 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.367 -179.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . 0.468 ' OG ' ' N ' ' A' ' 97' ' ' LEU . 66.7 p -73.08 -124.82 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.25 -179.72 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.468 ' N ' ' OG ' ' A' ' 96' ' ' SER . 89.6 mt -137.62 128.35 26.98 Favored 'General case' 0 CA--C 1.52 -0.197 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.701 -179.831 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.485 ' N ' HD12 ' A' ' 98' ' ' LEU . 11.1 mp -44.77 152.25 0.56 Allowed Pre-proline 0 N--CA 1.452 -0.332 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.714 -179.734 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -64.69 169.7 11.07 Favored 'Trans proline' 0 C--N 1.308 -1.579 0 C-N-CA 122.879 2.386 . . . . 0.0 112.194 -179.917 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 55.5 t80 -145.05 114.53 7.16 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.417 179.236 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 93.2 m-85 -99.33 133.64 43.33 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.306 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -145.5 146.51 31.49 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.405 -179.694 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 88.9 m -126.36 132.19 51.62 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.235 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -117.13 145.23 43.93 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.247 -0.433 . . . . 0.0 109.888 179.651 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 17.6 p -114.42 125.48 53.89 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-O 120.813 0.34 . . . . 0.0 110.605 179.761 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' SER . . . . . 0.464 ' O ' ' O ' ' A' ' 113' ' ' THR . 34.6 p -164.04 160.77 22.09 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.553 179.974 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 130.4 170.57 12.73 Favored Glycine 0 CA--C 1.52 0.372 0 N-CA-C 110.814 -0.915 . . . . 0.0 110.814 179.533 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 27.2 Cg_endo -63.31 149.1 92.16 Favored 'Trans proline' 0 C--N 1.302 -1.877 0 C-N-CA 122.772 2.314 . . . . 0.0 111.905 179.471 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 50.2 m -65.16 -16.32 63.38 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.059 -0.518 . . . . 0.0 110.07 178.965 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 52.6 t-80 -88.96 -41.94 12.08 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.354 179.366 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -126.93 78.82 73.52 Favored Pre-proline 0 N--CA 1.464 0.251 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.557 178.711 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 112' ' ' PRO . . . . . 0.482 ' O ' HG23 ' A' ' 113' ' ' THR . 24.4 Cg_exo -62.43 158.24 41.82 Favored 'Trans proline' 0 C--N 1.301 -1.958 0 C-N-CA 122.723 2.282 . . . . 0.0 112.363 -180.0 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 113' ' ' THR . . . . . 0.482 HG23 ' O ' ' A' ' 112' ' ' PRO . 23.7 p -155.83 150.97 26.6 Favored 'General case' 0 CA--C 1.517 -0.29 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.864 179.719 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -131.59 145.51 51.74 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.304 -179.955 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 99.3 m -126.11 119.72 28.3 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.561 179.338 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 59.8 p -94.23 122.0 36.32 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.351 -179.894 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . 0.479 HG22 ' N ' ' A' ' 118' ' ' VAL . 91.5 m -105.88 157.03 17.77 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.195 179.808 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 118' ' ' VAL . . . . . 0.479 ' N ' HG22 ' A' ' 117' ' ' THR . 9.9 p -140.45 138.13 36.36 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.459 179.566 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . 0.428 ' OE2' ' N ' ' A' ' 123' ' ' LYS . 5.2 tm-20 -124.58 130.84 53.2 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.735 179.73 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . 0.622 ' CZ ' ' CE1' ' A' ' 125' ' ' PHE . 49.8 p90 -164.84 156.76 15.62 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.52 179.225 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 53.45 21.23 2.34 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.767 0.318 . . . . 0.0 110.609 179.565 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 76.56 22.32 72.92 Favored Glycine 0 CA--C 1.523 0.534 0 N-CA-C 110.983 -0.847 . . . . 0.0 110.983 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . 0.428 ' N ' ' OE2' ' A' ' 119' ' ' GLU . 51.8 mtpt -132.67 151.81 51.86 Favored 'General case' 0 CA--C 1.517 -0.293 0 O-C-N 122.75 -0.265 . . . . 0.0 110.487 179.832 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . 0.492 ' O ' HG13 ' A' ' 124' ' ' VAL . 12.7 p -122.13 128.7 75.63 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.159 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.872 -179.669 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 125' ' ' PHE . . . . . 0.622 ' CE1' ' CZ ' ' A' ' 120' ' ' PHE . 22.2 m-85 -116.05 123.27 47.51 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.3 179.707 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 66.1 m -81.99 136.11 35.3 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.486 179.893 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -80.46 -171.37 43.51 Favored Glycine 0 CA--C 1.522 0.485 0 N-CA-C 110.665 -0.974 . . . . 0.0 110.665 179.834 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . 0.667 ' H ' ' CB ' ' A' ' 139' ' ' SER . 13.6 tt0 -94.89 130.16 41.6 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-O 120.931 0.396 . . . . 0.0 110.668 179.643 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 129' ' ' GLU . . . . . 0.403 ' H ' ' CD ' ' A' ' 129' ' ' GLU . 56.4 mp0 -56.22 144.18 30.83 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 116.04 -0.527 . . . . 0.0 109.978 179.087 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -172.96 166.78 5.09 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.78 -179.661 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 22.6 pttp -93.3 33.38 1.22 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.567 179.022 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . 0.436 ' HG1' ' HG2' ' A' ' 134' ' ' LYS . 0.3 OUTLIER -153.66 142.82 21.39 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.512 -179.826 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 58.1 mttp -79.27 -45.03 20.54 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.195 0.522 . . . . 0.0 110.729 179.779 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . 0.436 ' HG2' ' HG1' ' A' ' 132' ' ' THR . 16.3 pttp -53.63 -46.5 70.52 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.932 -179.4 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 4.4 tp -66.33 -41.84 89.02 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.677 179.871 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -60.21 -53.07 62.04 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 -179.451 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 96.1 mt-10 -54.19 -40.67 67.78 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 -179.727 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 50.1 mtt -61.34 -42.47 98.74 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.217 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 139' ' ' SER . . . . . 0.667 ' CB ' ' H ' ' A' ' 128' ' ' GLU . 90.9 p -60.09 -38.75 83.86 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.658 -179.316 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -65.54 -44.24 87.47 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.999 0.428 . . . . 0.0 110.818 -179.619 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -69.31 -30.16 68.16 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.719 -179.462 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 57.5 mttp -71.94 -51.15 23.47 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.905 0.383 . . . . 0.0 111.56 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 143' ' ' VAL . . . . . 0.54 HG13 ' N ' ' A' ' 144' ' ' ALA . 11.3 p -66.15 -43.32 92.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.555 -179.207 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 144' ' ' ALA . . . . . 0.54 ' N ' HG13 ' A' ' 143' ' ' VAL . . . -61.67 -46.15 90.96 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.625 -179.584 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 145' ' ' PHE . . . . . . . . . . . . . 64.6 t80 -60.67 -42.27 96.72 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.528 -179.598 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 146' ' ' MET . . . . . . . . . . . . . 59.6 mtt -62.8 -39.16 93.4 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.816 -179.638 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 78.1 p -69.21 -42.1 76.2 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.847 0.356 . . . . 0.0 110.904 -179.709 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 148' ' ' ILE . . . . . . . . . . . . . 87.2 mt -59.05 -29.23 40.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.769 -179.646 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 55.2 mtpt . . . . . 0 C--N 1.325 -0.457 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.669 179.688 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . 0.479 ' C ' ' N ' ' A' ' 84' ' ' LYS . . . . . . . . 0 N--CA 1.448 -0.543 0 CA-C-O 121.209 0.528 . . . . 0.0 109.679 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 2.8 m-85 -48.02 -16.58 0.09 Allowed 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.542 -0.754 . . . . 0.0 109.716 179.857 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.479 ' N ' ' C ' ' A' ' 82' ' ' ALA . 60.5 mttp -64.3 -42.73 96.23 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.479 -0.782 . . . . 0.0 109.932 179.916 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 13.5 m120 -63.57 -45.66 89.43 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.9 -179.376 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 6.0 tt -61.21 -41.57 97.08 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.777 -179.388 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.478 HD23 HD11 ' A' ' 90' ' ' ILE . 56.3 mt -57.92 -38.11 75.28 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.111 -0.495 . . . . 0.0 109.77 179.962 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 87.4 mt-30 -70.22 -35.3 73.79 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.355 179.102 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 96.2 mt-10 -63.41 -48.58 77.22 Favored 'General case' 0 N--CA 1.462 0.161 0 C-N-CA 120.668 -0.413 . . . . 0.0 111.426 -179.022 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.478 HD11 HD23 ' A' ' 87' ' ' LEU . 15.3 pt -62.82 -44.31 99.44 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 116.449 -0.342 . . . . 0.0 110.765 -179.542 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . 0.482 ' O ' ' N ' ' A' ' 95' ' ' SER . . . -68.81 -45.48 71.12 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.015 -179.622 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -63.27 -47.7 81.25 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.62 -179.417 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -63.34 -42.52 98.95 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.766 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -92.81 7.56 43.23 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.449 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' SER . . . . . 0.482 ' N ' ' O ' ' A' ' 91' ' ' ALA . 14.2 m 39.49 47.15 1.54 Allowed 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 120.91 0.386 . . . . 0.0 110.641 -179.936 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 60.2 p -100.48 44.7 1.0 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.435 -179.273 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.563 HD12 ' N ' ' A' ' 97' ' ' LEU . 9.9 mp 64.66 93.17 0.06 Allowed 'General case' 0 N--CA 1.461 0.092 0 CA-C-O 121.042 0.449 . . . . 0.0 110.705 -179.445 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.569 ' N ' HD12 ' A' ' 98' ' ' LEU . 10.3 mp -45.59 146.69 1.7 Allowed Pre-proline 0 CA--C 1.532 0.278 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.324 -179.712 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -70.28 145.42 54.09 Favored 'Trans proline' 0 N--CA 1.493 1.452 0 C-N-CA 122.496 2.131 . . . . 0.0 111.863 -179.8 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 84.4 t80 -127.76 131.59 49.63 Favored 'General case' 0 CA--C 1.514 -0.436 0 N-CA-C 108.771 -0.825 . . . . 0.0 108.771 179.972 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 95.7 m-85 -97.52 143.18 28.48 Favored 'General case' 0 C--N 1.324 -0.521 0 C-N-CA 120.741 -0.384 . . . . 0.0 110.474 -179.191 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -143.85 145.28 32.21 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.075 179.681 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 98.6 m -122.57 127.21 49.15 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.514 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -123.24 150.91 42.86 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 110.007 -0.368 . . . . 0.0 110.007 179.785 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 35.1 p -106.85 137.42 44.92 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-O 120.761 0.315 . . . . 0.0 110.23 179.97 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 31.2 m -161.75 163.35 29.65 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.253 179.965 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 118.04 -178.34 16.84 Favored Glycine 0 CA--C 1.527 0.82 0 N-CA-C 111.281 -0.728 . . . . 0.0 111.281 179.535 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' PRO . . . . . 0.637 ' HG2' ' HB3' ' A' ' 111' ' ' ALA . 19.7 Cg_endo -61.4 154.42 59.01 Favored 'Trans proline' 0 N--CA 1.497 1.715 0 C-N-CA 122.702 2.268 . . . . 0.0 112.337 179.964 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 28.3 m -67.68 -18.16 64.83 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.627 -0.715 . . . . 0.0 109.978 179.29 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 94.9 m-70 -91.95 -36.54 13.38 Favored 'General case' 0 CA--C 1.52 -0.179 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.164 179.735 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . 0.637 ' HB3' ' HG2' ' A' ' 108' ' ' PRO . . . -124.21 79.77 59.31 Favored Pre-proline 0 CA--C 1.538 0.519 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.077 179.232 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -81.45 121.39 3.81 Favored 'Trans proline' 0 N--CA 1.489 1.24 0 C-N-CA 122.481 2.121 . . . . 0.0 112.194 -179.917 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 4.9 p -109.26 172.8 6.64 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.004 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 -132.2 146.76 52.24 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.167 -179.765 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 88.5 m -131.52 126.95 36.22 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.152 -0.476 . . . . 0.0 109.86 179.138 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 68.2 m -94.4 121.23 35.71 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.367 -179.834 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . 0.421 ' CG2' ' CG2' ' A' ' 124' ' ' VAL . 98.6 m -108.95 125.33 51.92 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.385 -179.869 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 11.0 p -110.55 139.66 33.12 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.3 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.004 -179.945 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 84.1 tt0 -123.25 130.35 52.63 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.619 179.925 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . 0.584 ' CZ ' ' CE1' ' A' ' 125' ' ' PHE . 47.7 p90 -163.72 157.45 19.13 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.533 179.214 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 52.59 21.85 1.98 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.788 0.328 . . . . 0.0 110.86 179.503 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 75.7 21.89 76.0 Favored Glycine 0 CA--C 1.523 0.568 0 N-CA-C 111.185 -0.766 . . . . 0.0 111.185 179.836 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 61.0 mttp -131.66 151.2 51.81 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 120.723 0.297 . . . . 0.0 110.303 179.898 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . 0.457 ' O ' HG13 ' A' ' 124' ' ' VAL . 13.6 p -123.03 129.77 74.86 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.27 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.763 -179.572 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 125' ' ' PHE . . . . . 0.584 ' CE1' ' CZ ' ' A' ' 120' ' ' PHE . 18.5 m-85 -117.56 123.34 46.01 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.167 179.979 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 12.3 p -83.66 141.55 31.42 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.594 -179.976 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -86.18 -169.62 46.12 Favored Glycine 0 CA--C 1.523 0.584 0 N-CA-C 110.704 -0.959 . . . . 0.0 110.704 179.847 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . 0.626 ' H ' ' CB ' ' A' ' 139' ' ' SER . 5.8 pt-20 -93.86 128.89 40.38 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-O 120.765 0.317 . . . . 0.0 111.056 -179.564 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -55.15 144.14 25.11 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 120.45 -0.5 . . . . 0.0 110.172 179.703 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -170.63 163.67 8.18 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.931 179.837 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 31.0 mtmm -89.71 32.84 0.86 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.366 179.226 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 4.0 t -156.43 149.5 24.16 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.601 179.493 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 58.8 mttp -80.57 -31.8 36.76 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.921 179.708 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . 0.496 ' O ' ' SD ' ' A' ' 138' ' ' MET . 25.9 mtpp -59.19 -51.18 71.09 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.038 -178.901 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 11.6 tp -64.76 -39.3 93.4 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-O 120.838 0.351 . . . . 0.0 110.936 -179.654 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -59.36 -54.81 42.48 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.8 -179.351 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 80.6 mm-40 -58.15 -43.61 87.46 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 120.847 -0.341 . . . . 0.0 110.436 -179.382 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 138' ' ' MET . . . . . 0.571 ' N ' ' SD ' ' A' ' 138' ' ' MET . 0.0 OUTLIER -62.02 -41.98 98.67 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.458 -179.979 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 139' ' ' SER . . . . . 0.626 ' CB ' ' H ' ' A' ' 128' ' ' GLU . 77.4 p -65.06 -36.16 83.48 Favored 'General case' 0 C--N 1.329 -0.317 0 C-N-CA 120.922 -0.311 . . . . 0.0 111.022 -179.934 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -65.83 -47.32 75.38 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.047 0.451 . . . . 0.0 110.645 179.94 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -71.7 -24.41 61.81 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.738 -179.907 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -70.62 -49.35 48.53 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.246 179.812 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 143' ' ' VAL . . . . . 0.405 HG13 ' N ' ' A' ' 144' ' ' ALA . 7.1 p -68.37 -38.9 80.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.88 -179.545 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 144' ' ' ALA . . . . . 0.405 ' N ' HG13 ' A' ' 143' ' ' VAL . . . -64.08 -44.95 90.8 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.82 0.343 . . . . 0.0 110.95 -179.612 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 145' ' ' PHE . . . . . . . . . . . . . 64.7 t80 -57.11 -44.21 83.03 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.472 -179.713 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 146' ' ' MET . . . . . . . . . . . . . 63.3 mtt -63.79 -38.98 93.13 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.88 179.907 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 78.0 p -67.91 -44.98 75.68 Favored 'General case' 0 C--N 1.332 -0.189 0 C-N-CA 120.702 -0.399 . . . . 0.0 110.936 -179.752 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 148' ' ' ILE . . . . . . . . . . . . . 82.2 mt -52.1 -39.14 25.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.085 -179.521 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 32.6 mttm . . . . . 0 C--N 1.326 -0.444 0 C-N-CA 120.593 -0.443 . . . . 0.0 110.932 179.424 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . 0.477 ' C ' ' N ' ' A' ' 84' ' ' LYS . . . . . . . . 0 N--CA 1.447 -0.576 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 3.9 m-85 -48.56 -15.77 0.09 Allowed 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.515 -0.766 . . . . 0.0 109.575 179.709 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.477 ' N ' ' C ' ' A' ' 82' ' ' ALA . 99.6 mttt -63.02 -39.47 94.84 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.758 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 93.0 m-20 -63.1 -44.84 94.54 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.739 -179.912 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 7.2 tt -71.92 -33.72 68.49 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.667 -179.515 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 17.7 mt -59.63 -41.71 91.07 Favored 'General case' 0 CA--C 1.52 -0.206 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.424 -178.839 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 17.0 pt20 -73.04 -29.43 62.98 Favored 'General case' 0 C--N 1.316 -0.866 0 C-N-CA 120.424 -0.51 . . . . 0.0 110.509 179.191 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 92.2 mt-10 -65.71 -42.87 90.63 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 120.693 -0.403 . . . . 0.0 111.251 -179.809 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 29.2 pt -72.13 -35.26 52.67 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.882 179.698 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -55.68 -49.53 72.7 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.937 -179.215 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 13.5 pt20 -67.96 -38.05 82.29 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.526 179.557 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 64.1 tttp -62.66 -47.72 82.46 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.384 -179.894 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 72.2 mm-40 -76.39 -2.83 33.77 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.494 -179.755 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 74.64 4.62 4.41 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.08 -0.509 . . . . 0.0 109.916 -179.724 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 18.9 m -74.17 162.71 28.68 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.287 179.89 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.559 ' N ' HD12 ' A' ' 97' ' ' LEU . 10.5 mp -73.16 132.57 43.4 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.952 0.406 . . . . 0.0 110.052 -179.73 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.546 ' N ' HD12 ' A' ' 98' ' ' LEU . 10.6 mp -45.63 149.21 1.12 Allowed Pre-proline 0 CA--C 1.534 0.336 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.68 -179.618 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -72.55 143.52 38.44 Favored 'Trans proline' 0 N--CA 1.49 1.315 0 C-N-CA 122.681 2.254 . . . . 0.0 111.59 179.881 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 87.7 t80 -127.57 130.47 49.13 Favored 'General case' 0 CA--C 1.511 -0.545 0 N-CA-C 108.542 -0.911 . . . . 0.0 108.542 179.956 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 76.3 m-85 -100.15 147.32 25.82 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 110.012 -0.366 . . . . 0.0 110.012 -179.092 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -146.17 146.89 31.0 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.379 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 99.8 m -121.57 128.14 51.68 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.368 179.732 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -116.27 144.13 44.62 Favored 'General case' 0 N--CA 1.467 0.389 0 N-CA-C 109.93 -0.396 . . . . 0.0 109.93 179.737 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 30.2 p -106.75 134.85 49.27 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 109.97 -0.382 . . . . 0.0 109.97 179.775 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 41.0 t -164.42 162.12 21.88 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.148 179.926 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 122.7 -177.87 16.45 Favored Glycine 0 CA--C 1.528 0.876 0 N-CA-C 111.268 -0.733 . . . . 0.0 111.268 179.459 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' PRO . . . . . 0.598 ' HG2' ' HB3' ' A' ' 111' ' ' ALA . 23.4 Cg_endo -61.3 150.33 85.29 Favored 'Trans proline' 0 N--CA 1.497 1.718 0 C-N-CA 122.789 2.326 . . . . 0.0 112.317 179.902 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 36.9 t -63.99 -18.24 64.1 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.702 -0.681 . . . . 0.0 109.794 179.076 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 73.9 m80 -91.27 -38.19 12.82 Favored 'General case' 0 CA--C 1.518 -0.263 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.285 179.804 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . 0.598 ' HB3' ' HG2' ' A' ' 108' ' ' PRO . . . -123.96 79.61 57.73 Favored Pre-proline 0 CA--C 1.538 0.508 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.185 179.463 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -80.8 122.07 4.28 Favored 'Trans proline' 0 N--CA 1.491 1.338 0 C-N-CA 122.619 2.213 . . . . 0.0 112.15 179.68 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 3.5 p -109.12 171.26 7.54 Favored 'General case' 0 CA--C 1.517 -0.307 0 CA-C-N 115.646 -0.706 . . . . 0.0 109.978 -179.961 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -133.89 148.56 51.25 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.182 -179.702 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 94.8 m -129.73 126.61 38.64 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.104 179.398 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 11.2 t -96.39 121.47 38.23 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.276 179.829 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . 0.439 ' CG2' ' CG2' ' A' ' 124' ' ' VAL . 70.8 m -112.86 130.35 56.13 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.017 -179.913 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 7.7 p -113.73 141.8 28.48 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.357 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.03 -179.748 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 79.0 tt0 -125.14 131.86 53.18 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.49 -179.764 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . 0.625 ' CZ ' ' CE1' ' A' ' 125' ' ' PHE . 48.4 p90 -166.63 159.51 14.18 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.435 179.372 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 53.32 19.05 1.44 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.8 0.333 . . . . 0.0 110.904 179.711 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 78.24 20.0 73.32 Favored Glycine 0 CA--C 1.525 0.687 0 N-CA-C 111.323 -0.711 . . . . 0.0 111.323 179.617 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -132.13 152.91 50.99 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.806 0.336 . . . . 0.0 110.408 179.872 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . 0.482 ' O ' HG13 ' A' ' 124' ' ' VAL . 14.9 p -121.38 127.88 75.8 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.288 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.713 -179.904 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 125' ' ' PHE . . . . . 0.625 ' CE1' ' CZ ' ' A' ' 120' ' ' PHE . 36.8 m-85 -111.38 120.55 42.58 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.346 179.911 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 5.7 m -78.8 129.24 34.39 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.283 179.707 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -84.05 -173.25 49.66 Favored Glycine 0 CA--C 1.521 0.444 0 N-CA-C 111.139 -0.785 . . . . 0.0 111.139 -179.938 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . 0.446 ' CG ' ' N ' ' A' ' 129' ' ' GLU . 69.1 tt0 -77.75 165.89 23.64 Favored 'General case' 0 N--CA 1.442 -0.842 0 CA-C-O 120.671 0.272 . . . . 0.0 110.443 179.894 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 129' ' ' GLU . . . . . 0.446 ' N ' ' CG ' ' A' ' 128' ' ' GLU . 18.7 pt-20 -105.94 140.7 38.55 Favored 'General case' 0 C--N 1.332 -0.168 0 N-CA-C 109.879 -0.415 . . . . 0.0 109.879 179.106 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -171.57 166.48 6.75 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.86 179.596 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -86.12 35.36 0.64 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.041 179.065 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 4.3 t -152.47 144.77 23.97 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.844 179.772 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -82.54 -21.95 35.17 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.965 179.44 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 56.3 mtpt -68.79 -54.49 15.56 Favored 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 120.632 -0.427 . . . . 0.0 111.208 -179.278 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 3.6 tp -64.02 -38.9 92.77 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.959 -179.504 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -58.91 -54.64 44.83 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.67 -179.527 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 81.0 mm-40 -60.07 -43.03 95.75 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.866 0.365 . . . . 0.0 110.766 -179.777 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 60.3 mtt -61.77 -41.88 98.27 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.319 -179.509 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 37.8 m -65.07 -36.61 84.87 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.014 179.775 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -63.32 -46.37 86.95 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 121.046 0.45 . . . . 0.0 110.524 -179.962 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -70.21 -24.25 63.08 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.686 179.849 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 38.7 ttmt -70.76 -49.94 41.36 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.29 -0.413 . . . . 0.0 111.276 179.711 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 143' ' ' VAL . . . . . 0.407 HG13 ' N ' ' A' ' 144' ' ' ALA . 7.1 p -67.98 -40.9 84.07 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.151 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.019 -179.501 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 144' ' ' ALA . . . . . 0.407 ' N ' HG13 ' A' ' 143' ' ' VAL . . . -62.29 -45.79 91.67 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.935 0.398 . . . . 0.0 110.526 -179.997 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 145' ' ' PHE . . . . . . . . . . . . . 69.8 t80 -59.19 -44.33 92.21 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.564 -179.656 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 146' ' ' MET . . . . . . . . . . . . . 64.1 ttp -61.68 -39.1 90.22 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.965 -179.711 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 11.7 t -67.34 -44.33 79.34 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 120.743 -0.383 . . . . 0.0 110.873 179.844 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 148' ' ' ILE . . . . . . . . . . . . . 94.2 mt -57.72 -29.57 35.23 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.204 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.994 -179.642 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 25.8 mtpp . . . . . 0 C--N 1.327 -0.413 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.51 179.87 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . 0.485 ' O ' ' N ' ' A' ' 84' ' ' LYS . . . . . . . . 0 N--CA 1.455 -0.209 0 CA-C-O 120.775 0.322 . . . . 0.0 110.528 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 2.1 m-85 -46.05 -15.89 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.27 179.709 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.485 ' N ' ' O ' ' A' ' 82' ' ' ALA . 99.4 mttt -64.79 -40.75 95.76 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.447 179.266 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 38.8 t30 -64.92 -44.69 88.71 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.63 -179.91 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 5.3 tt -60.03 -43.36 95.34 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.588 -179.304 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.432 HD23 HD11 ' A' ' 90' ' ' ILE . 74.0 mt -56.25 -37.74 70.19 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.402 179.976 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 88.4 mt-30 -70.8 -35.26 72.46 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.578 179.651 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 79.9 mm-40 -62.27 -48.43 79.93 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.807 -179.169 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.435 HG13 ' N ' ' A' ' 91' ' ' ALA . 19.9 pt -65.13 -41.34 91.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.655 -179.52 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . 0.519 ' O ' ' N ' ' A' ' 95' ' ' SER . . . -68.85 -49.9 54.45 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.852 -179.464 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 84.4 mt-30 -65.01 -45.68 84.5 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.865 -179.604 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 88.9 tttt -60.02 -47.35 86.19 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.562 -179.77 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . 0.408 ' O ' ' C ' ' A' ' 95' ' ' SER . 96.4 mt-10 -96.03 10.15 38.43 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.544 -179.928 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' SER . . . . . 0.519 ' N ' ' O ' ' A' ' 91' ' ' ALA . 13.9 t 39.24 40.84 0.56 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.47 -179.754 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . 0.44 ' O ' ' CB ' ' A' ' 97' ' ' LEU . 44.7 m -87.47 33.26 0.69 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.653 -179.436 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.44 ' CB ' ' O ' ' A' ' 96' ' ' SER . 2.6 tp 76.93 100.58 0.07 Allowed 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.866 179.907 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.509 ' N ' HD12 ' A' ' 98' ' ' LEU . 11.0 mp -44.21 152.02 0.51 Allowed Pre-proline 0 C--N 1.325 -0.474 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.431 179.817 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_endo -65.86 171.16 10.28 Favored 'Trans proline' 0 C--N 1.304 -1.77 0 C-N-CA 122.951 2.434 . . . . 0.0 111.998 179.611 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 31.8 t80 -144.62 117.2 8.62 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.7 179.6 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 93.4 m-85 -96.95 129.03 44.47 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.505 -179.929 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -147.68 148.16 30.74 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.478 -179.781 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 1.5 t -135.26 145.21 47.36 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.63 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -129.39 153.93 47.42 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.521 -179.925 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 16.2 p -110.28 138.43 46.67 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.576 179.631 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 40.3 t -163.5 153.62 15.48 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.664 179.804 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 125.65 -175.94 17.41 Favored Glycine 0 CA--C 1.524 0.612 0 N-CA-C 111.039 -0.824 . . . . 0.0 111.039 179.643 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 25.9 Cg_endo -62.45 150.46 87.32 Favored 'Trans proline' 0 C--N 1.303 -1.824 0 C-N-CA 122.785 2.323 . . . . 0.0 112.278 -179.883 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 37.1 t -65.05 -16.09 63.07 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.36 179.038 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 49.6 t-80 -90.51 -43.43 10.24 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.472 179.646 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -126.21 77.2 72.12 Favored Pre-proline 0 CA--C 1.53 0.178 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.21 179.213 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -80.62 126.52 6.02 Favored 'Trans proline' 0 C--N 1.303 -1.847 0 C-N-CA 122.611 2.208 . . . . 0.0 112.261 -179.588 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 5.6 p -103.97 170.89 7.65 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.362 179.609 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -133.46 146.71 51.4 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.589 -179.665 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 86.9 m -127.82 122.42 32.63 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.434 179.733 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 25.4 m -96.06 122.55 39.0 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.013 0.435 . . . . 0.0 110.556 -179.758 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 57.5 m -112.29 128.13 56.18 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.514 -179.894 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 8.6 p -110.42 140.82 27.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.506 179.928 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -127.27 136.78 52.45 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.566 179.99 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . 0.619 ' CZ ' ' CE1' ' A' ' 125' ' ' PHE . 50.7 p90 -170.15 160.2 7.86 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.385 179.85 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 51.56 21.38 1.27 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.511 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 77.08 21.22 74.25 Favored Glycine 0 CA--C 1.522 0.503 0 N-CA-C 111.098 -0.801 . . . . 0.0 111.098 179.732 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -131.99 151.59 51.64 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.786 0.327 . . . . 0.0 110.614 179.909 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . 0.447 ' O ' HG13 ' A' ' 124' ' ' VAL . 8.5 p -121.38 127.84 75.79 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-O 120.965 0.412 . . . . 0.0 110.842 -179.65 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 125' ' ' PHE . . . . . 0.619 ' CE1' ' CZ ' ' A' ' 120' ' ' PHE . 26.4 m-85 -112.63 120.48 41.69 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.367 179.56 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 43.5 t -80.09 132.16 35.9 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.707 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -80.26 -172.42 44.68 Favored Glycine 0 CA--C 1.525 0.688 0 N-CA-C 110.77 -0.932 . . . . 0.0 110.77 179.808 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . 0.42 ' O ' ' CG ' ' A' ' 128' ' ' GLU . 8.9 pt-20 -96.46 131.69 42.78 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.612 0.244 . . . . 0.0 110.475 -179.833 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -54.06 142.09 26.38 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.373 179.541 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -165.43 157.9 15.46 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.559 179.993 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 51.0 tttm -86.65 33.56 0.64 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.597 179.704 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 4.8 t -159.64 152.19 21.3 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.509 -179.712 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -81.84 -33.56 30.6 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.001 0.429 . . . . 0.0 110.978 179.896 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -58.28 -54.25 49.16 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.892 -178.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 4.0 tp -65.08 -38.75 91.78 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.66 179.938 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -57.7 -55.03 40.2 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.833 -179.358 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -60.84 -41.59 96.09 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.434 -179.752 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 78.9 mmm -62.61 -41.39 98.95 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.552 -179.472 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 20.2 m -64.4 -38.46 91.1 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.632 -179.946 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -64.73 -43.77 92.33 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.595 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -72.21 -24.99 61.48 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.456 179.671 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 63.0 tttp -70.31 -47.16 62.41 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.046 -179.935 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 7.7 p -70.55 -37.34 69.58 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.83 -179.542 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -64.06 -46.3 84.96 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.662 -179.857 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 145' ' ' PHE . . . . . . . . . . . . . 66.0 t80 -58.33 -43.44 88.25 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.553 -179.734 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 146' ' ' MET . . . . . . . . . . . . . 59.2 ttp -61.06 -37.41 82.54 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.577 -179.536 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 35.8 t -70.55 -45.59 65.17 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.955 -179.86 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 148' ' ' ILE . . . . . . . . . . . . . 93.9 mt -55.01 -31.52 25.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.617 -179.459 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 10.2 mtpm? . . . . . 0 C--N 1.327 -0.412 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.671 179.752 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . 0.486 ' O ' ' N ' ' A' ' 84' ' ' LYS . . . . . . . . 0 N--CA 1.451 -0.404 0 CA-C-O 121.06 0.457 . . . . 0.0 110.318 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 2.1 m-85 -46.13 -15.87 0.03 OUTLIER 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.172 179.728 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.486 ' N ' ' O ' ' A' ' 82' ' ' ALA . 65.0 mttp -63.67 -40.26 96.39 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.169 179.509 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 63.6 t30 -65.95 -48.78 70.19 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.777 -179.467 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 6.4 tt -60.8 -40.98 94.68 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.791 -179.5 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.496 HD23 HD11 ' A' ' 90' ' ' ILE . 34.3 mt -56.11 -36.8 68.6 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.295 -179.591 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 89.4 mt-30 -69.81 -35.69 75.04 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.57 179.432 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 14.6 mm-40 -61.71 -49.7 75.41 Favored 'General case' 0 C--N 1.333 -0.11 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.107 -178.836 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.496 HD11 HD23 ' A' ' 87' ' ' LEU . 28.6 pt -65.02 -34.46 70.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.633 179.916 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -54.61 -50.44 68.05 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.529 -179.335 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 78.7 mt-30 -65.32 -42.32 93.09 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.851 -179.944 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 69.2 mmtt -61.35 -47.42 85.97 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.549 -179.512 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 80.9 mm-40 -68.15 -20.16 64.86 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.419 179.943 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 1.2 t 72.76 19.67 3.88 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.596 -179.825 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 75.3 m -80.43 -117.4 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.242 -179.898 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 40.9 tp -143.27 125.27 15.26 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.652 179.691 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.607 ' N ' HD12 ' A' ' 98' ' ' LEU . 9.9 mp -44.36 142.65 2.24 Favored Pre-proline 0 N--CA 1.452 -0.359 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.871 -179.812 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_endo -69.63 145.42 57.84 Favored 'Trans proline' 0 C--N 1.311 -1.442 0 C-N-CA 122.524 2.149 . . . . 0.0 112.008 -179.781 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 92.6 t80 -127.2 128.73 46.57 Favored 'General case' 0 C--O 1.235 0.321 0 N-CA-C 109.544 -0.539 . . . . 0.0 109.544 179.643 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 85.6 m-85 -96.23 144.48 26.39 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.939 -179.596 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -143.74 145.4 32.37 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.439 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 98.0 m -122.83 127.67 49.37 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.466 -179.913 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -105.5 135.22 47.28 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.174 179.78 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 18.8 p -114.42 119.29 36.38 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-O 120.876 0.369 . . . . 0.0 110.414 179.592 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 11.4 p -160.66 163.96 32.11 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.403 179.934 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 122.24 168.78 13.34 Favored Glycine 0 CA--C 1.523 0.536 0 N-CA-C 110.888 -0.885 . . . . 0.0 110.888 179.659 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 24.9 Cg_endo -62.43 151.02 85.26 Favored 'Trans proline' 0 C--N 1.301 -1.928 0 C-N-CA 122.78 2.32 . . . . 0.0 112.143 179.63 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 77.7 p -63.99 -17.58 63.44 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.327 179.002 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 66.0 m80 -90.42 -43.14 10.49 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.501 179.628 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -125.04 78.02 66.58 Favored Pre-proline 0 N--CA 1.464 0.243 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.357 179.637 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 112' ' ' PRO . . . . . 0.493 ' O ' HG23 ' A' ' 113' ' ' THR . 56.8 Cg_endo -76.28 164.44 31.01 Favored 'Trans proline' 0 C--N 1.303 -1.866 0 C-N-CA 122.711 2.274 . . . . 0.0 112.279 -179.995 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 113' ' ' THR . . . . . 0.493 HG23 ' O ' ' A' ' 112' ' ' PRO . 33.8 p -156.83 152.01 26.33 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.641 179.555 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -131.68 144.14 50.79 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.335 -179.628 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 93.0 m -130.33 125.73 35.42 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.46 179.438 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 46.1 t -97.19 122.91 40.74 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.612 -179.827 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . 0.408 ' CG2' ' CG2' ' A' ' 124' ' ' VAL . 54.3 m -114.81 131.45 56.81 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.357 -179.834 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 9.9 p -111.75 141.83 26.01 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.285 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.267 -179.949 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 79.3 tt0 -125.79 133.77 51.92 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.623 -179.672 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . 0.627 ' CZ ' ' CE1' ' A' ' 125' ' ' PHE . 45.9 p90 -166.53 157.56 12.68 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.368 179.466 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 52.61 24.86 3.33 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.518 179.719 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 72.64 22.82 78.78 Favored Glycine 0 CA--C 1.521 0.466 0 N-CA-C 111.083 -0.807 . . . . 0.0 111.083 179.913 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 62.9 mttp -131.66 151.66 51.45 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.807 0.337 . . . . 0.0 110.331 179.826 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . 0.464 ' O ' HG13 ' A' ' 124' ' ' VAL . 12.2 p -122.21 128.47 75.53 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.227 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.768 -179.7 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 125' ' ' PHE . . . . . 0.627 ' CE1' ' CZ ' ' A' ' 120' ' ' PHE . 27.0 m-85 -112.93 123.35 50.12 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.434 179.919 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 4.2 p -79.37 126.76 31.23 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.195 179.843 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -82.65 -172.53 48.32 Favored Glycine 0 CA--C 1.525 0.676 0 N-CA-C 110.97 -0.852 . . . . 0.0 110.97 -179.664 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . 0.459 ' CG ' ' N ' ' A' ' 129' ' ' GLU . 67.5 tt0 -78.7 167.09 21.73 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-O 120.759 0.314 . . . . 0.0 110.491 179.972 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 129' ' ' GLU . . . . . 0.459 ' N ' ' CG ' ' A' ' 128' ' ' GLU . 3.0 pp20? -109.61 145.31 36.64 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.979 0.419 . . . . 0.0 110.343 178.952 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -174.19 170.41 3.72 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.617 179.663 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -86.28 36.13 0.68 Allowed 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.238 178.849 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 5.1 t -156.41 148.66 23.33 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.893 0.378 . . . . 0.0 110.538 -179.637 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -82.54 -33.14 28.28 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.103 179.591 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 69.5 mmtt -58.82 -52.66 64.76 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.01 -178.213 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 10.3 tp -63.78 -39.76 95.03 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.466 -0.333 . . . . 0.0 110.973 -179.531 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -60.31 -54.78 41.57 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.53 -179.142 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -59.19 -44.43 92.19 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.708 -179.456 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 38.3 ttm -60.63 -41.8 95.64 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.478 -179.775 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 139' ' ' SER . . . . . 0.413 ' CB ' ' H ' ' A' ' 128' ' ' GLU . 38.1 m -65.04 -35.17 80.3 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.754 179.763 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -62.7 -45.57 92.14 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.759 -179.733 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -72.41 -23.12 61.04 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.667 -179.771 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -71.6 -50.15 33.64 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.327 179.876 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 143' ' ' VAL . . . . . 0.443 HG13 ' N ' ' A' ' 144' ' ' ALA . 6.9 p -66.67 -41.01 87.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.696 -179.508 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 144' ' ' ALA . . . . . 0.443 ' N ' HG13 ' A' ' 143' ' ' VAL . . . -61.43 -43.56 98.65 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.479 -179.936 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 145' ' ' PHE . . . . . . . . . . . . . 65.4 t80 -60.2 -41.87 93.91 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.4 -179.832 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 146' ' ' MET . . . . . . . . . . . . . 89.9 mmm -63.85 -39.92 95.36 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.018 -179.349 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 9.1 t -67.48 -44.94 77.32 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.077 179.916 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 148' ' ' ILE . . . . . . . . . . . . . 78.7 mt -54.08 -33.5 24.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.582 -179.26 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 55.5 mtpt . . . . . 0 C--N 1.325 -0.491 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.532 -179.908 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . 0.481 ' O ' ' N ' ' A' ' 84' ' ' LYS . . . . . . . . 0 N--CA 1.451 -0.403 0 CA-C-O 121.079 0.466 . . . . 0.0 110.059 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -46.49 -16.36 0.03 OUTLIER 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.08 179.609 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.481 ' N ' ' O ' ' A' ' 82' ' ' ALA . 99.4 mttt -63.97 -41.96 97.4 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.314 179.328 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 35.9 t30 -64.79 -43.67 92.44 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.357 -179.523 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 2.6 tp -60.95 -43.36 98.81 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.6 -179.241 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 74.4 mt -55.83 -35.85 66.85 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.309 -179.767 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 88.6 mt-30 -71.01 -34.58 71.48 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.546 179.64 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -62.36 -48.08 81.34 Favored 'General case' 0 C--N 1.334 -0.08 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.044 -179.013 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 22.1 pt -65.2 -35.71 76.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.691 -179.996 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -59.17 -50.66 73.2 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.559 -179.648 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 56.0 tt0 -65.3 -44.93 86.34 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.859 -179.668 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -63.34 -47.58 81.59 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.702 -179.808 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . 0.445 ' O ' ' CB ' ' A' ' 95' ' ' SER . 16.0 mm-40 -72.64 -16.38 61.71 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.292 -179.832 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' SER . . . . . 0.445 ' CB ' ' O ' ' A' ' 94' ' ' GLU . 0.7 OUTLIER 79.69 11.36 1.27 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.516 -179.91 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 9.7 p -80.89 165.28 21.96 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.458 -179.911 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 57.5 tp -67.39 126.11 28.26 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.647 -179.974 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.574 ' N ' HD12 ' A' ' 98' ' ' LEU . 10.5 mp -46.4 148.37 1.66 Allowed Pre-proline 0 N--CA 1.45 -0.43 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.75 179.887 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -70.63 143.96 48.09 Favored 'Trans proline' 0 C--N 1.31 -1.474 0 C-N-CA 122.764 2.31 . . . . 0.0 111.996 179.63 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 91.5 t80 -129.97 131.37 45.9 Favored 'General case' 0 C--O 1.234 0.261 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 179.57 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 79.5 m-85 -98.72 146.17 26.16 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.823 -179.444 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -144.18 145.7 32.26 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.503 -179.883 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 94.4 m -123.97 129.76 51.47 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.423 -179.939 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -113.23 141.05 47.43 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.147 179.933 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 13.4 p -115.15 120.79 40.95 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-O 120.874 0.368 . . . . 0.0 110.627 179.452 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 35.6 p -159.02 164.67 35.3 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.425 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 122.8 164.97 12.27 Favored Glycine 0 CA--C 1.522 0.473 0 N-CA-C 110.834 -0.906 . . . . 0.0 110.834 179.721 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 20.4 Cg_endo -60.9 151.46 77.53 Favored 'Trans proline' 0 C--N 1.3 -1.98 0 C-N-CA 122.854 2.369 . . . . 0.0 112.16 179.344 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 91.2 p -63.68 -18.41 63.96 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.186 179.326 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 99.2 m-70 -89.9 -43.25 10.73 Favored 'General case' 0 CA--C 1.519 -0.234 0 CA-C-O 120.889 0.376 . . . . 0.0 110.538 179.409 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -124.2 77.75 60.31 Favored Pre-proline 0 CA--C 1.532 0.267 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.378 179.445 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 112' ' ' PRO . . . . . 0.513 ' O ' HG23 ' A' ' 113' ' ' THR . 59.7 Cg_endo -75.41 162.73 35.63 Favored 'Trans proline' 0 C--N 1.305 -1.743 0 C-N-CA 122.572 2.181 . . . . 0.0 112.295 179.836 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 113' ' ' THR . . . . . 0.513 HG23 ' O ' ' A' ' 112' ' ' PRO . 25.4 p -157.51 153.63 27.33 Favored 'General case' 0 CA--C 1.515 -0.378 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.629 179.488 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -130.75 143.14 50.53 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.287 -179.877 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 97.5 m -130.5 126.17 36.19 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.575 179.454 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 29.1 t -97.5 123.19 41.28 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.408 -179.922 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . 0.427 ' CG2' ' CG2' ' A' ' 124' ' ' VAL . 51.7 m -112.97 129.14 56.59 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.196 -179.805 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 9.4 p -111.87 142.02 25.55 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.305 179.993 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 81.6 tt0 -124.64 132.71 53.4 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.767 179.908 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . 0.635 ' CZ ' ' CE1' ' A' ' 125' ' ' PHE . 48.3 p90 -167.3 158.57 11.92 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.51 179.168 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 54.12 21.47 3.02 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.605 179.685 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 75.52 21.88 76.43 Favored Glycine 0 CA--C 1.522 0.481 0 N-CA-C 111.075 -0.81 . . . . 0.0 111.075 -179.947 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -132.73 153.0 51.61 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.652 0.263 . . . . 0.0 110.575 179.872 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . 0.499 ' O ' HG13 ' A' ' 124' ' ' VAL . 14.2 p -121.4 126.81 75.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-O 120.91 0.386 . . . . 0.0 110.558 -179.826 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 125' ' ' PHE . . . . . 0.635 ' CE1' ' CZ ' ' A' ' 120' ' ' PHE . 41.9 m-85 -111.44 121.3 44.84 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.314 179.646 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 5.9 p -83.26 137.78 33.86 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.416 180.0 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -86.15 -169.07 45.54 Favored Glycine 0 CA--C 1.521 0.454 0 N-CA-C 110.654 -0.978 . . . . 0.0 110.654 179.826 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -97.88 132.88 43.07 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-O 120.653 0.263 . . . . 0.0 110.788 -179.91 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 98.4 mt-10 -56.55 146.98 23.32 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 120.924 0.392 . . . . 0.0 110.416 179.221 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -169.77 161.75 9.29 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.652 -179.962 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 77.5 tttt -88.84 33.03 0.78 Allowed 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.173 0.511 . . . . 0.0 110.311 179.532 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 2.5 t -159.28 150.6 20.12 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.789 -179.683 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -81.06 -32.83 33.83 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.933 179.758 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . 0.423 ' N ' ' CD ' ' A' ' 134' ' ' LYS . 4.5 mptp? -58.5 -51.87 68.03 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.644 -178.628 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 3.5 tp -65.8 -39.72 91.19 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-O 120.845 0.355 . . . . 0.0 110.824 179.916 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -57.79 -55.17 38.3 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.572 -179.157 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -59.24 -43.35 92.4 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.398 -179.433 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 47.8 ttp -61.4 -44.66 96.77 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.443 -179.573 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 18.1 m -62.08 -39.97 94.23 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.748 -179.854 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -62.88 -46.44 87.84 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.702 -179.946 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -71.88 -23.72 61.55 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.547 179.895 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 64.4 tttp -70.54 -48.73 54.02 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.261 179.78 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 143' ' ' VAL . . . . . 0.402 HG13 ' N ' ' A' ' 144' ' ' ALA . 7.6 p -69.16 -37.97 77.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.69 -179.542 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 144' ' ' ALA . . . . . 0.402 ' N ' HG13 ' A' ' 143' ' ' VAL . . . -63.19 -45.86 89.76 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.642 -179.622 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 145' ' ' PHE . . . . . . . . . . . . . 60.7 t80 -60.24 -43.01 96.45 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.566 -179.326 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 146' ' ' MET . . . . . . . . . . . . . 62.7 ttp -61.63 -39.63 91.97 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.95 -179.73 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 33.1 t -67.04 -43.6 82.36 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.901 -179.999 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 148' ' ' ILE . . . . . . . . . . . . . 89.6 mt -57.28 -31.82 39.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.695 -179.411 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 53.9 mtpt . . . . . 0 C--N 1.327 -0.395 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.819 179.864 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . 0.476 ' C ' ' N ' ' A' ' 84' ' ' LYS . . . . . . . . 0 N--CA 1.449 -0.51 0 CA-C-O 121.082 0.468 . . . . 0.0 110.274 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -47.01 -16.38 0.04 OUTLIER 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.914 -0.585 . . . . 0.0 109.804 179.603 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.476 ' N ' ' C ' ' A' ' 82' ' ' ALA . 69.1 mttm -63.73 -42.51 97.89 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.686 -0.688 . . . . 0.0 109.993 179.86 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 89.5 m-20 -63.12 -44.49 95.49 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.525 -179.748 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 6.2 tt -63.71 -40.95 98.04 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.832 -179.879 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.44 HD23 HD11 ' A' ' 90' ' ' ILE . 39.4 mt -56.79 -36.19 69.57 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.092 -179.703 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 88.3 mt-30 -71.63 -31.36 66.78 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.59 179.672 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -66.07 -47.26 74.89 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.301 -179.386 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.44 HD11 HD23 ' A' ' 87' ' ' LEU . 30.4 pt -66.88 -34.96 73.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-O 120.929 0.395 . . . . 0.0 110.463 179.957 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -58.32 -49.89 75.58 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.706 -179.416 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 89.0 mt-30 -65.67 -44.24 86.87 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.754 179.809 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 64.4 tttp -62.28 -47.94 82.12 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.621 -179.745 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 98.1 mt-10 -74.92 -2.91 29.09 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.508 179.995 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 2.7 t 67.79 6.31 5.0 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.603 -179.996 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 7.6 p -75.03 160.72 30.18 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.261 -179.873 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 51.7 tp -67.15 129.8 41.05 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.879 -179.521 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 10.3 mp -45.47 155.01 0.48 Allowed Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.2 179.258 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -65.1 171.65 8.61 Favored 'Trans proline' 0 C--N 1.307 -1.637 0 C-N-CA 122.826 2.351 . . . . 0.0 111.737 179.621 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 29.0 t80 -144.27 122.57 12.29 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.124 179.191 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 -103.59 132.96 49.39 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.416 -179.682 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -144.07 145.1 31.95 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.328 179.883 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 97.7 m -126.2 133.53 51.5 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.656 -179.672 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -124.28 149.08 46.91 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.339 179.925 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 20.3 p -108.06 135.4 49.48 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-O 120.864 0.364 . . . . 0.0 110.706 179.814 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 26.5 m -162.73 161.71 26.46 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.499 179.905 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 119.3 179.19 16.68 Favored Glycine 0 CA--C 1.522 0.479 0 N-CA-C 110.668 -0.973 . . . . 0.0 110.668 179.884 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 108' ' ' PRO . . . . . 0.667 ' HG2' ' HB3' ' A' ' 111' ' ' ALA . 28.6 Cg_endo -60.91 151.51 77.2 Favored 'Trans proline' 0 C--N 1.302 -1.91 0 C-N-CA 122.87 2.38 . . . . 0.0 112.392 -179.664 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 37.5 t -63.56 -18.86 64.31 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.172 179.433 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 52.3 t-80 -90.31 -37.0 14.35 Favored 'General case' 0 CA--C 1.519 -0.243 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.118 179.55 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . 0.667 ' HB3' ' HG2' ' A' ' 108' ' ' PRO . . . -124.35 81.14 59.06 Favored Pre-proline 0 N--CA 1.465 0.32 0 CA-C-O 121.124 0.488 . . . . 0.0 110.11 179.427 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -84.33 117.32 2.12 Favored 'Trans proline' 0 C--N 1.303 -1.855 0 C-N-CA 122.55 2.167 . . . . 0.0 112.487 -179.215 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 48.2 p -105.37 170.06 8.1 Favored 'General case' 0 CA--C 1.517 -0.326 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.197 179.741 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -130.57 142.27 50.46 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.396 -179.842 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 86.3 m -121.0 119.1 31.56 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.285 179.68 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 21.5 m -97.9 122.12 40.64 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.122 -179.988 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 62.2 m -112.9 132.16 55.43 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.347 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 10.9 p -112.67 138.9 40.22 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.261 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.197 -179.87 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 84.0 tt0 -125.28 134.01 52.43 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.81 -179.714 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . 0.605 ' CZ ' ' CE1' ' A' ' 125' ' ' PHE . 48.7 p90 -166.61 158.73 13.52 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.615 179.442 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 52.73 23.01 2.5 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.828 0.347 . . . . 0.0 110.467 179.843 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 74.98 22.27 77.06 Favored Glycine 0 CA--C 1.521 0.44 0 N-CA-C 111.118 -0.793 . . . . 0.0 111.118 179.786 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 63.5 mttp -132.3 152.6 51.31 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 110.355 -0.239 . . . . 0.0 110.355 -179.892 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . 0.482 ' O ' HG13 ' A' ' 124' ' ' VAL . 7.2 p -118.99 124.61 73.47 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.23 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.69 -179.994 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 125' ' ' PHE . . . . . 0.605 ' CE1' ' CZ ' ' A' ' 120' ' ' PHE . 50.5 m-85 -108.5 119.8 40.58 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.07 179.79 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 73.4 m -82.49 134.26 35.21 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.383 -179.91 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -91.2 -167.15 40.94 Favored Glycine 0 CA--C 1.524 0.63 0 N-CA-C 110.673 -0.971 . . . . 0.0 110.673 179.846 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . 0.54 ' H ' ' CB ' ' A' ' 139' ' ' SER . 35.7 tt0 -98.0 133.89 41.85 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-O 120.968 0.413 . . . . 0.0 110.658 179.716 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 -63.35 151.75 39.96 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.324 179.71 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -171.78 164.36 6.51 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.733 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 61.7 pttt -88.39 32.64 0.77 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.665 179.184 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 3.9 t -156.14 148.13 23.19 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.929 0.395 . . . . 0.0 110.361 179.976 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 99.9 mttt -81.81 -17.14 48.57 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.642 -0.708 . . . . 0.0 109.896 179.738 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -73.29 -56.86 4.51 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.815 -179.702 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 4.3 tp -65.46 -41.34 93.48 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.344 -179.491 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -56.53 -55.12 37.81 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.832 -178.959 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -60.71 -40.29 91.71 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.789 0.328 . . . . 0.0 110.586 -179.729 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 56.7 mtt -61.63 -42.75 99.32 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.46 -179.817 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 139' ' ' SER . . . . . 0.54 ' CB ' ' H ' ' A' ' 128' ' ' GLU . 74.1 m -61.38 -41.03 96.45 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.44 -0.345 . . . . 0.0 110.873 -179.885 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -63.02 -45.76 90.8 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.935 0.398 . . . . 0.0 110.937 -179.927 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -71.07 -24.22 62.28 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.711 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 52.7 tttp -71.95 -49.98 32.85 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.931 0.396 . . . . 0.0 111.254 179.828 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 143' ' ' VAL . . . . . 0.424 HG13 ' N ' ' A' ' 144' ' ' ALA . 7.4 p -68.29 -38.96 80.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.712 -179.67 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 144' ' ' ALA . . . . . 0.424 ' N ' HG13 ' A' ' 143' ' ' VAL . . . -64.44 -48.3 75.84 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.878 -179.647 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 145' ' ' PHE . . . . . 0.422 ' CD1' ' C ' ' A' ' 145' ' ' PHE . 30.7 t80 -58.76 -44.45 90.59 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.922 -179.594 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 146' ' ' MET . . . . . . . . . . . . . 61.6 ttp -60.82 -38.34 85.08 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.881 -179.286 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 6.6 t -67.95 -41.23 82.81 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.879 179.538 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 148' ' ' ILE . . . . . . . . . . . . . 80.8 mt -57.51 -42.85 81.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 115.681 -0.691 . . . . 0.0 111.147 -178.953 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 17.1 ptmt . . . . . 0 C--N 1.324 -0.506 0 C-N-CA 120.821 -0.352 . . . . 0.0 110.76 -179.783 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . 0.478 ' C ' ' N ' ' A' ' 84' ' ' LYS . . . . . . . . 0 N--CA 1.452 -0.347 0 CA-C-O 121.062 0.458 . . . . 0.0 110.051 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -47.01 -15.79 0.04 OUTLIER 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.93 179.748 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.478 ' N ' ' C ' ' A' ' 82' ' ' ALA . 99.6 mttt -64.13 -42.0 97.0 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.733 -0.667 . . . . 0.0 109.901 179.679 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 92.5 m-20 -64.23 -46.27 84.53 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.786 -179.79 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 6.3 tt -62.35 -40.79 97.56 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.828 -179.848 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.485 HD23 HD11 ' A' ' 90' ' ' ILE . 33.4 mt -57.21 -36.72 71.22 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.05 -179.642 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -70.78 -33.42 70.74 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.932 -0.577 . . . . 0.0 110.537 179.592 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 97.6 mt-10 -63.99 -48.51 76.13 Favored 'General case' 0 N--CA 1.462 0.152 0 C-N-CA 120.694 -0.402 . . . . 0.0 111.1 -179.29 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.485 HD11 HD23 ' A' ' 87' ' ' LEU . 29.4 pt -68.55 -34.77 67.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.75 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -57.72 -51.01 71.3 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.853 -179.535 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 69.3 tp60 -67.46 -41.5 84.58 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.539 179.937 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 65.8 tttm -60.97 -47.35 86.83 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.45 -179.505 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 96.1 mt-10 -72.85 -3.25 24.4 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.466 179.919 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 4.7 t 64.99 5.78 3.1 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.615 179.984 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . 0.544 ' OG ' ' N ' ' A' ' 97' ' ' LEU . 29.3 t -61.86 -127.85 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.243 179.774 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.544 ' N ' ' OG ' ' A' ' 96' ' ' SER . 94.1 mt -139.35 126.43 21.14 Favored 'General case' 0 CA--C 1.517 -0.3 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.548 179.977 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.588 ' N ' HD12 ' A' ' 98' ' ' LEU . 10.2 mp -45.87 142.35 3.8 Favored Pre-proline 0 C--N 1.326 -0.435 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.658 -179.001 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -71.48 144.06 44.28 Favored 'Trans proline' 0 N--CA 1.494 1.546 0 C-N-CA 122.623 2.215 . . . . 0.0 112.241 179.757 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 87.4 t80 -123.28 126.62 47.23 Favored 'General case' 0 CA--C 1.513 -0.461 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 179.937 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 94.6 m-85 -95.18 142.05 28.06 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.393 -178.969 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -143.84 144.87 31.95 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 110.104 -0.332 . . . . 0.0 110.104 179.691 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 93.0 m -122.45 128.0 50.33 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.394 -179.936 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -114.58 142.77 46.0 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.223 179.848 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 29.4 p -103.68 132.4 49.98 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-O 120.787 0.327 . . . . 0.0 110.244 179.802 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 29.8 p -160.49 165.74 30.38 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.132 -179.837 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 115.4 -176.41 16.59 Favored Glycine 0 CA--C 1.524 0.615 0 N-CA-C 111.141 -0.784 . . . . 0.0 111.141 179.786 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 108' ' ' PRO . . . . . 0.42 ' HG2' ' HB3' ' A' ' 111' ' ' ALA . 29.4 Cg_endo -64.35 156.83 57.74 Favored 'Trans proline' 0 C--N 1.308 -1.565 0 C-N-CA 122.862 2.375 . . . . 0.0 112.272 -179.909 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 26.6 m -69.98 -19.54 63.34 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.14 179.313 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 74.6 m80 -88.84 -39.35 13.91 Favored 'General case' 0 CA--C 1.518 -0.269 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.405 179.894 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . 0.453 ' HB1' ' CE ' ' A' ' 131' ' ' LYS . . . -125.17 78.23 66.98 Favored Pre-proline 0 CA--C 1.534 0.344 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.257 179.221 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -80.81 126.38 5.83 Favored 'Trans proline' 0 C--N 1.305 -1.755 0 C-N-CA 122.344 2.029 . . . . 0.0 112.362 -179.725 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 4.3 p -110.36 173.64 6.23 Favored 'General case' 0 CA--C 1.513 -0.463 0 CA-C-O 120.951 0.405 . . . . 0.0 109.952 179.667 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 1.1 m-85 -134.14 148.28 50.93 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.491 -179.599 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 96.6 m -128.32 124.59 36.86 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.144 179.365 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 32.6 p -95.19 120.03 34.73 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.314 -179.649 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . 0.42 ' CG2' ' CG2' ' A' ' 124' ' ' VAL . 99.8 m -107.92 126.57 52.84 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.17 179.856 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 11.6 p -109.33 137.35 41.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.203 -179.719 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 77.5 tt0 -123.82 131.8 53.66 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.822 -179.808 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . 0.615 ' CZ ' ' CE1' ' A' ' 125' ' ' PHE . 44.6 p90 -164.98 156.7 15.24 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.48 179.696 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 52.24 24.55 2.88 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.86 0.362 . . . . 0.0 110.617 179.832 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 73.54 22.22 78.71 Favored Glycine 0 CA--C 1.524 0.649 0 N-CA-C 111.139 -0.785 . . . . 0.0 111.139 179.787 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -131.99 152.25 51.24 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 110.319 -0.252 . . . . 0.0 110.319 -179.969 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . 0.477 ' O ' HG13 ' A' ' 124' ' ' VAL . 14.9 p -122.01 128.35 75.59 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.194 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.76 -179.649 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 125' ' ' PHE . . . . . 0.615 ' CE1' ' CZ ' ' A' ' 120' ' ' PHE . 24.5 m-85 -112.35 122.87 48.93 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.285 179.873 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 8.8 m -79.61 127.39 32.11 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.123 179.996 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -85.2 -171.84 48.57 Favored Glycine 0 CA--C 1.528 0.853 0 N-CA-C 110.891 -0.884 . . . . 0.0 110.891 -179.938 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . 0.467 ' CG ' ' N ' ' A' ' 129' ' ' GLU . 70.5 tt0 -80.25 167.8 19.85 Favored 'General case' 0 N--CA 1.445 -0.7 0 CA-C-O 120.664 0.269 . . . . 0.0 110.362 -179.915 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 129' ' ' GLU . . . . . 0.547 ' CD ' ' H ' ' A' ' 129' ' ' GLU . 1.3 pm0 -107.66 142.61 37.36 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.129 0.49 . . . . 0.0 110.138 179.242 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -172.11 166.64 6.1 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.856 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . 0.453 ' CE ' ' HB1' ' A' ' 111' ' ' ALA . 63.2 mttp -86.12 35.2 0.63 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.35 178.932 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 3.1 t -153.13 146.41 24.79 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.865 179.951 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 99.7 mttt -83.65 -21.65 32.41 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.802 179.692 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -69.26 -54.92 12.23 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.99 -179.187 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 4.0 tp -65.41 -40.19 93.09 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.888 -179.596 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -57.55 -54.99 40.56 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.621 -179.174 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -60.83 -41.39 95.66 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.804 0.335 . . . . 0.0 110.627 -179.741 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 33.3 tpp -60.23 -42.73 95.83 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.359 -179.727 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 139' ' ' SER . . . . . 0.423 ' CB ' ' H ' ' A' ' 128' ' ' GLU . 38.5 m -64.45 -36.81 85.37 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.847 -179.937 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -62.33 -46.46 88.6 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.971 0.415 . . . . 0.0 110.573 -179.822 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -70.38 -23.92 62.86 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.504 179.826 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -71.99 -50.61 27.25 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.291 -179.896 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 143' ' ' VAL . . . . . 0.45 HG13 ' N ' ' A' ' 144' ' ' ALA . 7.4 p -68.11 -40.97 83.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.763 -179.531 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 144' ' ' ALA . . . . . 0.45 ' N ' HG13 ' A' ' 143' ' ' VAL . . . -64.76 -46.88 80.29 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.667 -179.834 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 145' ' ' PHE . . . . . 0.45 ' C ' ' CD1' ' A' ' 145' ' ' PHE . 27.3 t80 -58.31 -45.93 87.1 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.931 -179.487 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 146' ' ' MET . . . . . . . . . . . . . 47.4 tpp -61.24 -38.02 85.14 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.863 -179.323 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 19.1 m -67.4 -41.03 85.58 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.106 -179.874 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 148' ' ' ILE . . . . . . . . . . . . . 81.1 mt -56.78 -42.53 77.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.608 -179.363 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 17.9 ptmt . . . . . 0 C--N 1.328 -0.367 0 CA-C-O 120.846 0.355 . . . . 0.0 110.787 179.9 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . 0.479 ' C ' ' N ' ' A' ' 84' ' ' LYS . . . . . . . . 0 N--CA 1.45 -0.457 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 2.8 m-85 -48.26 -16.46 0.1 Allowed 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.432 -0.804 . . . . 0.0 109.533 179.62 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.479 ' N ' ' C ' ' A' ' 82' ' ' ALA . 63.9 mttp -63.8 -43.34 96.58 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.465 -0.789 . . . . 0.0 109.891 -179.978 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 41.8 t30 -63.33 -44.1 95.89 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.711 -179.135 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 6.1 tt -61.51 -41.69 97.67 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.982 -179.416 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.485 HD23 HD11 ' A' ' 90' ' ' ILE . 65.1 mt -57.44 -36.52 71.5 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.197 0.522 . . . . 0.0 109.626 -179.638 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 88.9 mt-30 -70.39 -35.59 73.57 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.541 178.996 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 80.9 mm-40 -63.3 -48.44 78.07 Favored 'General case' 0 N--CA 1.462 0.138 0 C-N-CA 120.664 -0.414 . . . . 0.0 111.494 -179.054 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.485 HD11 HD23 ' A' ' 87' ' ' LEU . 14.6 pt -63.7 -43.69 98.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 C-N-CA 120.858 -0.337 . . . . 0.0 110.491 -179.791 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . 0.515 ' O ' ' N ' ' A' ' 95' ' ' SER . . . -64.31 -47.69 78.47 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.814 -179.651 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 3.5 tm0? -65.76 -46.51 78.51 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.81 -179.55 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 55.7 mtpt -62.43 -44.78 95.62 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.869 -179.743 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 96.1 mt-10 -91.73 -0.44 57.55 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.225 -179.663 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' SER . . . . . 0.515 ' N ' ' O ' ' A' ' 91' ' ' ALA . 13.8 m 41.33 81.36 0.03 OUTLIER 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.535 -179.658 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . 0.434 ' O ' ' CB ' ' A' ' 97' ' ' LEU . 75.5 p -139.64 36.19 2.01 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.776 -179.578 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.434 ' CB ' ' O ' ' A' ' 96' ' ' SER . 0.2 OUTLIER 79.59 93.98 0.05 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.939 0.399 . . . . 0.0 110.779 179.749 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.556 ' N ' HD12 ' A' ' 98' ' ' LEU . 10.5 mp -45.74 147.65 1.53 Allowed Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.284 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -68.53 140.95 49.1 Favored 'Trans proline' 0 N--CA 1.495 1.612 0 C-N-CA 122.707 2.271 . . . . 0.0 111.844 -179.859 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 87.0 t80 -126.88 130.04 49.38 Favored 'General case' 0 CA--C 1.511 -0.521 0 N-CA-C 108.417 -0.957 . . . . 0.0 108.417 179.795 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 94.8 m-85 -97.53 143.61 28.06 Favored 'General case' 0 C--N 1.322 -0.597 0 C-N-CA 120.723 -0.391 . . . . 0.0 110.35 -178.972 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -142.61 144.4 32.81 Favored 'General case' 0 N--CA 1.464 0.243 0 N-CA-C 109.986 -0.376 . . . . 0.0 109.986 179.611 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 90.1 m -124.53 130.24 52.1 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.456 -179.971 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -119.54 146.95 45.01 Favored 'General case' 0 N--CA 1.467 0.409 0 N-CA-C 109.851 -0.426 . . . . 0.0 109.851 179.492 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 32.2 p -110.36 138.34 46.87 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 110.175 -0.306 . . . . 0.0 110.175 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 44.3 t -167.4 154.2 8.34 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 110.032 -0.358 . . . . 0.0 110.032 179.85 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 126.08 -175.75 17.6 Favored Glycine 0 CA--C 1.529 0.915 0 N-CA-C 111.307 -0.717 . . . . 0.0 111.307 179.554 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 108' ' ' PRO . . . . . 0.401 ' HG2' ' HB3' ' A' ' 111' ' ' ALA . 19.2 Cg_endo -61.37 153.06 68.42 Favored 'Trans proline' 0 N--CA 1.495 1.599 0 C-N-CA 122.59 2.193 . . . . 0.0 112.366 179.881 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 92.9 p -67.3 -16.53 64.32 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.661 -0.7 . . . . 0.0 109.927 179.202 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 52.7 t-80 -91.79 -41.97 10.37 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-O 120.894 0.378 . . . . 0.0 110.301 -179.942 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . 0.401 ' HB3' ' HG2' ' A' ' 108' ' ' PRO . . . -123.95 79.64 57.61 Favored Pre-proline 0 CA--C 1.535 0.373 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.225 179.383 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_endo -83.17 122.68 3.34 Favored 'Trans proline' 0 N--CA 1.491 1.348 0 C-N-CA 122.699 2.266 . . . . 0.0 112.232 179.949 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 63.6 p -102.82 167.31 9.95 Favored 'General case' 0 CA--C 1.515 -0.399 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.003 179.896 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 1.2 m-85 -130.9 144.42 51.45 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.121 -179.897 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 115' ' ' THR . . . . . 0.437 ' OG1' ' OE1' ' A' ' 129' ' ' GLU . 46.5 m -123.82 120.26 32.08 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.659 -0.497 . . . . 0.0 109.659 179.395 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 41.2 t -95.21 121.41 36.83 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.229 -179.821 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 70.6 m -115.83 129.82 56.59 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.29 -0.413 . . . . 0.0 109.932 -179.91 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 12.9 p -113.77 145.74 19.25 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.259 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.164 -179.75 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -127.29 133.41 50.16 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.584 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . 0.619 ' CZ ' ' CE1' ' A' ' 125' ' ' PHE . 49.3 p90 -166.3 159.79 15.23 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.525 179.179 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 52.89 19.37 1.3 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.694 0.283 . . . . 0.0 110.761 179.423 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 77.5 21.3 72.84 Favored Glycine 0 CA--C 1.526 0.742 0 N-CA-C 111.249 -0.74 . . . . 0.0 111.249 179.76 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -131.69 151.54 51.56 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 110.192 -0.299 . . . . 0.0 110.192 179.765 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . 0.411 ' O ' HG13 ' A' ' 124' ' ' VAL . 6.7 p -121.02 127.71 75.97 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.171 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.643 -179.478 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 125' ' ' PHE . . . . . 0.619 ' CE1' ' CZ ' ' A' ' 120' ' ' PHE . 27.5 m-85 -109.44 154.48 22.57 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.664 179.915 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 37.2 p -117.79 132.99 56.38 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.624 -179.998 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -83.81 -169.79 45.66 Favored Glycine 0 CA--C 1.52 0.394 0 N-CA-C 110.624 -0.99 . . . . 0.0 110.624 179.668 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . 0.491 ' H ' ' CB ' ' A' ' 139' ' ' SER . 7.1 pt-20 -94.51 127.75 40.65 Favored 'General case' 0 CA--C 1.529 0.152 0 CA-C-O 120.553 0.216 . . . . 0.0 111.025 -179.373 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 129' ' ' GLU . . . . . 0.437 ' OE1' ' OG1' ' A' ' 115' ' ' THR . 79.8 mm-40 -53.81 143.73 20.25 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 120.457 -0.497 . . . . 0.0 110.209 179.832 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -169.63 161.62 9.5 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.772 179.984 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 22.4 pttp -88.61 33.99 0.76 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.416 179.652 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 4.8 t -154.74 147.86 24.78 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.621 179.493 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 99.7 mttt -79.98 -33.41 39.46 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.877 179.639 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 62.9 mttp -59.9 -54.68 43.29 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.037 -178.826 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . 0.4 HD21 ' OE2' ' A' ' 128' ' ' GLU . 3.7 tp -64.81 -38.86 92.39 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.914 0.387 . . . . 0.0 110.388 179.924 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -57.16 -54.94 41.07 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.568 -179.406 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -64.14 -41.01 97.35 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.714 -179.218 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 93.0 mtp -62.41 -41.44 98.69 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.208 -179.826 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 139' ' ' SER . . . . . 0.491 ' CB ' ' H ' ' A' ' 128' ' ' GLU . 68.8 m -66.7 -36.55 82.77 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.724 179.39 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -65.17 -45.84 83.26 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.953 0.406 . . . . 0.0 110.65 179.553 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -72.36 -24.27 61.25 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.419 179.856 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -70.01 -48.68 57.12 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.048 179.757 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 7.2 p -67.98 -37.37 78.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.705 -179.94 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 144' ' ' ALA . . . . . 0.438 ' O ' ' OG ' ' A' ' 147' ' ' SER . . . -65.52 -46.41 79.72 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.903 0.382 . . . . 0.0 110.722 -179.952 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 145' ' ' PHE . . . . . . . . . . . . . 85.6 t80 -60.72 -41.52 95.45 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.797 -179.986 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 146' ' ' MET . . . . . . . . . . . . . 75.4 mmm -60.69 -38.47 85.09 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.627 -179.461 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 147' ' ' SER . . . . . 0.438 ' OG ' ' O ' ' A' ' 144' ' ' ALA . 58.5 p -70.76 -39.81 73.02 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 120.75 -0.38 . . . . 0.0 111.089 179.429 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 148' ' ' ILE . . . . . . . . . . . . . 84.3 mt -58.5 -26.78 31.82 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.242 0 CA-C-O 120.715 0.293 . . . . 0.0 110.622 -179.608 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 36.5 mtmt . . . . . 0 C--N 1.323 -0.577 0 C-N-CA 120.326 -0.55 . . . . 0.0 110.576 -179.413 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . 0.472 ' C ' ' N ' ' A' ' 84' ' ' LYS . . . . . . . . 0 N--CA 1.451 -0.422 0 CA-C-O 121.13 0.49 . . . . 0.0 109.759 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -47.63 -16.09 0.06 Allowed 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.72 179.971 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.472 ' N ' ' C ' ' A' ' 82' ' ' ALA . 64.7 mttp -63.88 -42.11 97.58 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.617 -0.719 . . . . 0.0 109.804 179.716 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 13.7 m120 -63.73 -46.19 86.48 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.884 -179.403 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 7.1 tt -62.64 -39.67 94.59 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.556 -179.724 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.518 HD23 HD11 ' A' ' 90' ' ' ILE . 33.7 mt -57.74 -38.97 76.25 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 -179.689 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 78.7 mt-30 -69.26 -35.11 75.75 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.645 179.122 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 95.7 mt-10 -62.99 -48.73 77.58 Favored 'General case' 0 N--CA 1.466 0.327 0 C-N-CA 120.761 -0.376 . . . . 0.0 111.166 -179.121 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.518 HD11 HD23 ' A' ' 87' ' ' LEU . 29.8 pt -66.42 -34.77 72.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.683 -179.968 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -55.71 -49.09 73.93 Favored 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 120.737 -0.385 . . . . 0.0 110.667 -179.37 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 52.9 tt0 -67.97 -43.49 78.86 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.846 -179.857 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 66.0 tttm -61.82 -48.52 80.2 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.899 0.381 . . . . 0.0 110.555 -179.487 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 80.2 mm-40 -76.84 2.62 14.04 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.576 -179.764 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 4.3 t 64.42 8.04 4.01 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.78 179.766 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 18.7 m -75.21 158.46 32.92 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.437 179.732 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.594 ' N ' HD12 ' A' ' 97' ' ' LEU . 9.4 mp -69.29 131.68 45.24 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.998 0.428 . . . . 0.0 110.393 -179.459 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.56 ' N ' HD12 ' A' ' 98' ' ' LEU . 10.3 mp -46.16 148.23 1.59 Allowed Pre-proline 0 C--N 1.326 -0.426 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.601 -179.727 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -73.07 142.69 34.84 Favored 'Trans proline' 0 N--CA 1.496 1.65 0 C-N-CA 122.828 2.352 . . . . 0.0 111.992 179.541 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 94.6 t80 -124.93 127.4 47.0 Favored 'General case' 0 CA--C 1.51 -0.564 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 179.798 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 84.1 m-85 -96.93 145.98 25.39 Favored 'General case' 0 C--N 1.324 -0.512 0 C-N-CA 120.726 -0.39 . . . . 0.0 110.303 -178.885 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -142.37 143.53 32.75 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.51 -0.314 . . . . 0.0 110.266 179.712 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 97.3 m -125.83 133.03 52.11 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.305 179.809 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -127.17 152.28 47.56 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.176 179.765 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 33.3 p -108.22 135.01 50.26 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-O 120.823 0.344 . . . . 0.0 110.133 -179.891 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 99.5 p -160.08 164.41 33.11 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.461 -179.805 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 117.47 -175.5 15.73 Favored Glycine 0 CA--C 1.527 0.835 0 N-CA-C 111.171 -0.772 . . . . 0.0 111.171 179.618 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 25.0 Cg_endo -62.15 152.3 76.73 Favored 'Trans proline' 0 N--CA 1.497 1.713 0 C-N-CA 122.863 2.376 . . . . 0.0 112.461 179.895 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 89.7 p -67.46 -17.31 64.65 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.016 179.284 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 55.1 t-80 -89.6 -42.73 11.23 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.209 179.956 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -123.93 78.07 58.1 Favored Pre-proline 0 CA--C 1.535 0.391 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.112 179.331 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -79.07 127.95 7.98 Favored 'Trans proline' 0 N--CA 1.49 1.27 0 C-N-CA 122.347 2.031 . . . . 0.0 112.435 179.768 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 52.0 p -110.19 172.87 6.61 Favored 'General case' 0 CA--C 1.519 -0.249 0 CA-C-N 115.793 -0.639 . . . . 0.0 109.86 179.629 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 1.7 m-85 -130.47 143.9 51.06 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.503 -179.377 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 97.9 m -124.59 120.91 33.27 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.265 -0.425 . . . . 0.0 109.965 179.307 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 12.9 t -102.14 128.82 48.46 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.239 179.917 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 97.5 m -129.6 141.44 50.95 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.322 -179.87 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 14.2 p -117.77 152.09 19.75 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.227 0 CA-C-N 116.044 -0.525 . . . . 0.0 109.76 179.86 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -129.03 136.98 51.03 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.004 0.43 . . . . 0.0 110.308 -179.895 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . 0.62 ' CZ ' ' CE1' ' A' ' 125' ' ' PHE . 55.0 p90 -169.31 161.42 10.01 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.791 -0.641 . . . . 0.0 110.744 179.14 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 52.87 19.21 1.24 Allowed 'General case' 0 N--CA 1.462 0.166 0 CA-C-O 120.771 0.32 . . . . 0.0 110.712 179.39 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 75.86 20.44 77.92 Favored Glycine 0 CA--C 1.526 0.723 0 N-CA-C 111.05 -0.82 . . . . 0.0 111.05 179.774 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 97.2 mttt -131.82 151.5 51.63 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.955 0.407 . . . . 0.0 110.145 -179.703 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . 0.524 HG22 ' N ' ' A' ' 125' ' ' PHE . 7.7 p -103.54 160.29 4.62 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.229 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.606 -179.325 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 125' ' ' PHE . . . . . 0.62 ' CE1' ' CZ ' ' A' ' 120' ' ' PHE . 85.8 m-85 -151.63 105.69 3.17 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.154 179.817 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 126' ' ' SER . . . . . 0.519 ' O ' HG21 ' A' ' 143' ' ' VAL . 34.2 t -88.48 151.92 22.22 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.499 179.7 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -99.93 -159.36 28.5 Favored Glycine 0 N--CA 1.464 0.54 0 N-CA-C 110.652 -0.979 . . . . 0.0 110.652 179.454 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . 0.507 ' H ' ' CB ' ' A' ' 139' ' ' SER . 5.7 pt-20 -101.89 135.87 42.7 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-O 120.434 0.159 . . . . 0.0 110.801 -179.381 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -55.05 145.62 20.18 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 120.599 -0.441 . . . . 0.0 110.258 179.384 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -167.13 159.31 12.87 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.881 -179.999 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 48.0 tttp -88.58 32.18 0.8 Allowed 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.209 179.682 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 5.8 t -157.8 150.46 22.75 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.613 179.677 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -79.67 -35.98 38.36 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.054 179.619 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -56.45 -55.12 37.61 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.005 -178.926 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 4.3 tp -65.18 -40.4 94.22 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.269 -179.724 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -55.84 -54.44 44.56 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.501 -179.221 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -60.69 -40.25 91.51 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.897 0.38 . . . . 0.0 110.335 -179.593 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 51.4 ttp -60.16 -48.45 81.68 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.296 -179.722 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 139' ' ' SER . . . . . 0.507 ' CB ' ' H ' ' A' ' 128' ' ' GLU . 57.1 m -60.72 -35.47 76.41 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.7 179.92 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -68.82 -49.28 59.8 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.888 0.375 . . . . 0.0 110.825 179.727 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -60.07 -25.61 65.52 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.645 -179.559 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 30.7 mmtm -68.04 -43.33 78.98 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.87 179.311 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 143' ' ' VAL . . . . . 0.519 HG21 ' O ' ' A' ' 126' ' ' SER . 3.3 t -62.39 -45.42 98.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.576 -179.116 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -63.12 -49.14 75.58 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-O 120.875 0.369 . . . . 0.0 111.012 -179.755 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 145' ' ' PHE . . . . . . . . . . . . . 49.7 t80 -61.53 -44.52 96.9 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.84 -179.367 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 146' ' ' MET . . . . . . . . . . . . . 72.6 mmm -64.36 -40.26 95.5 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.794 0.33 . . . . 0.0 110.883 -179.537 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 16.3 m -69.78 -41.85 74.58 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.935 179.934 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 148' ' ' ILE . . . . . . . . . . . . . 48.1 mt -56.49 -32.58 36.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.369 -179.78 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 55.4 mtpt . . . . . 0 C--N 1.327 -0.409 0 C-N-CA 120.618 -0.433 . . . . 0.0 110.486 -179.989 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . 0.482 ' C ' ' N ' ' A' ' 84' ' ' LYS . . . . . . . . 0 N--CA 1.449 -0.504 0 CA-C-O 121.167 0.508 . . . . 0.0 110.155 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 2.2 m-85 -46.61 -16.04 0.03 OUTLIER 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.033 179.605 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.482 ' N ' ' C ' ' A' ' 82' ' ' ALA . 68.6 mttm -65.06 -42.37 94.27 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.004 179.604 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 89.9 m-20 -63.72 -45.77 88.46 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.478 -179.66 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 6.4 tt -61.98 -41.55 98.15 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.793 -179.741 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.57 HD23 HD11 ' A' ' 90' ' ' ILE . 37.6 mt -56.76 -37.04 70.52 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.115 -179.618 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 88.1 mt-30 -71.97 -32.68 67.51 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.415 179.737 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 78.5 mm-40 -65.01 -46.6 80.72 Favored 'General case' 0 CA--C 1.522 -0.102 0 C-N-CA 120.761 -0.375 . . . . 0.0 111.087 -179.048 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.57 HD11 HD23 ' A' ' 87' ' ' LEU . 18.1 pt -65.2 -44.45 95.25 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.703 -179.804 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . 0.504 ' O ' ' N ' ' A' ' 95' ' ' SER . . . -68.14 -47.77 67.18 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.538 -179.446 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 58.3 tt0 -64.78 -46.25 82.87 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.689 -179.809 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 66.3 tttm -61.67 -47.17 86.55 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.675 -179.923 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 80.9 mm-40 -92.94 8.47 39.65 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.408 -179.953 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' SER . . . . . 0.504 ' N ' ' O ' ' A' ' 91' ' ' ALA . 5.9 p 41.14 42.67 1.71 Allowed 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 120.848 0.356 . . . . 0.0 110.497 -179.882 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 18.7 p -92.74 39.43 1.04 Allowed 'General case' 0 CA--C 1.513 -0.466 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.788 -179.518 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 43.3 mt 69.4 100.4 0.06 Allowed 'General case' 0 CA--C 1.52 -0.21 0 O-C-N 123.451 0.469 . . . . 0.0 110.907 179.888 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 10.0 mp -44.85 155.06 0.41 Allowed Pre-proline 0 N--CA 1.452 -0.34 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.676 179.852 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_endo -64.8 170.17 10.49 Favored 'Trans proline' 0 C--N 1.305 -1.713 0 C-N-CA 122.791 2.328 . . . . 0.0 111.901 179.529 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 36.9 t80 -144.97 116.79 8.22 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.446 178.966 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 98.5 m-85 -98.77 131.95 44.51 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.918 0.39 . . . . 0.0 110.287 179.976 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -141.63 143.17 33.5 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.357 179.842 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 95.9 m -123.1 128.77 50.56 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.316 179.954 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -105.2 134.41 48.35 Favored 'General case' 0 CA--C 1.522 -0.108 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.271 179.714 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 19.4 p -115.21 123.95 50.16 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-O 120.897 0.379 . . . . 0.0 110.463 179.828 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 35.1 t -167.41 151.96 6.89 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.352 179.945 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 132.69 168.43 11.99 Favored Glycine 0 CA--C 1.522 0.491 0 N-CA-C 110.934 -0.867 . . . . 0.0 110.934 179.714 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 22.0 Cg_endo -61.46 151.38 80.12 Favored 'Trans proline' 0 C--N 1.303 -1.825 0 C-N-CA 122.814 2.342 . . . . 0.0 112.122 179.421 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 5.9 m -65.04 -17.42 64.44 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.031 -0.532 . . . . 0.0 110.254 179.395 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 93.4 m-70 -90.83 -41.91 10.94 Favored 'General case' 0 CA--C 1.52 -0.203 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.441 179.817 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -124.36 77.85 61.47 Favored Pre-proline 0 CA--C 1.531 0.248 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.356 179.508 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 112' ' ' PRO . . . . . 0.48 ' O ' HG23 ' A' ' 113' ' ' THR . 61.3 Cg_endo -76.46 160.72 35.13 Favored 'Trans proline' 0 C--N 1.304 -1.801 0 C-N-CA 122.681 2.254 . . . . 0.0 112.492 179.884 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 113' ' ' THR . . . . . 0.48 HG23 ' O ' ' A' ' 112' ' ' PRO . 24.5 p -155.8 150.3 25.95 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.56 179.423 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -132.59 146.05 51.59 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.352 179.98 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 91.6 m -126.12 121.33 32.56 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 116.175 -0.466 . . . . 0.0 109.878 179.197 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 10.4 p -95.76 121.75 37.81 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.601 179.927 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 52.6 m -115.77 130.67 56.94 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.044 179.944 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 9.8 p -112.59 143.79 21.62 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.267 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.208 179.994 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 84.0 tt0 -129.59 138.07 51.06 Favored 'General case' 0 CA--C 1.52 -0.189 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.632 -179.98 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . 0.627 ' CZ ' ' CE1' ' A' ' 125' ' ' PHE . 49.9 p90 -170.19 160.32 7.86 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.527 179.5 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 52.35 19.11 1.04 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.883 0.373 . . . . 0.0 110.559 179.419 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 79.55 20.37 69.04 Favored Glycine 0 CA--C 1.522 0.487 0 N-CA-C 111.353 -0.699 . . . . 0.0 111.353 179.697 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -131.9 150.8 52.05 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.661 0.267 . . . . 0.0 110.384 -179.96 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . 0.47 ' O ' HG13 ' A' ' 124' ' ' VAL . 7.8 p -119.59 126.41 75.3 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.312 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.972 -179.848 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 125' ' ' PHE . . . . . 0.627 ' CE1' ' CZ ' ' A' ' 120' ' ' PHE . 33.6 m-85 -110.83 118.2 35.49 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.112 179.805 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 11.3 p -76.64 125.25 28.92 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.479 -179.863 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -78.31 -172.67 40.67 Favored Glycine 0 CA--C 1.525 0.666 0 N-CA-C 110.904 -0.878 . . . . 0.0 110.904 179.914 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 18.9 mm-40 -79.62 169.81 17.46 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.649 0.262 . . . . 0.0 110.813 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 129' ' ' GLU . . . . . 0.547 ' CD ' ' H ' ' A' ' 129' ' ' GLU . 1.3 pm0 -109.33 139.17 44.62 Favored 'General case' 0 N--CA 1.464 0.262 0 N-CA-C 109.721 -0.474 . . . . 0.0 109.721 179.516 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -173.2 169.54 4.52 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.729 -179.994 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 22.6 pttp -86.86 36.34 0.72 Allowed 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.282 178.598 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 1.7 t -154.39 147.75 24.98 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.972 0.415 . . . . 0.0 110.665 -179.854 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -84.08 -25.61 29.66 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.027 179.594 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -66.22 -49.33 67.61 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.32 -178.496 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 4.2 tp -65.18 -42.59 93.49 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.573 -179.296 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -62.81 -54.92 31.52 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.391 -179.125 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -57.31 -46.24 83.41 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.739 0.304 . . . . 0.0 110.572 -179.965 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 36.8 ttm -62.98 -39.34 94.41 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.259 -179.969 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 37.5 m -63.01 -38.85 92.86 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.831 179.8 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -62.4 -40.62 97.1 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.622 -179.909 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -68.38 -27.15 65.98 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.911 -179.807 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 92.6 mttt -72.12 -51.1 23.03 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.802 179.233 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 143' ' ' VAL . . . . . 0.449 HG13 ' N ' ' A' ' 144' ' ' ALA . 7.2 p -66.6 -41.28 88.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.742 -179.625 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 144' ' ' ALA . . . . . 0.449 ' N ' HG13 ' A' ' 143' ' ' VAL . . . -64.07 -46.54 83.88 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.59 -179.798 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 145' ' ' PHE . . . . . . . . . . . . . 71.2 t80 -60.52 -42.66 96.89 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.41 -179.74 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 146' ' ' MET . . . . . 0.451 ' C ' ' SD ' ' A' ' 146' ' ' MET . 14.9 tmm? -61.63 -38.66 88.49 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.8 -179.742 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 6.8 t -69.22 -44.58 71.74 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.916 0.389 . . . . 0.0 110.976 179.874 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 148' ' ' ILE . . . . . . . . . . . . . 86.4 mt -56.17 -31.1 31.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.737 -179.466 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 55.0 mtpt . . . . . 0 C--N 1.326 -0.433 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.69 -179.939 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . 0.48 ' C ' ' N ' ' A' ' 84' ' ' LYS . . . . . . . . 0 N--CA 1.449 -0.504 0 CA-C-O 121.26 0.552 . . . . 0.0 110.026 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -46.68 -16.3 0.03 OUTLIER 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.71 -0.677 . . . . 0.0 109.831 179.674 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.48 ' N ' ' C ' ' A' ' 82' ' ' ALA . 68.6 mttm -63.89 -41.98 97.57 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.953 179.709 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 65.7 t30 -66.38 -46.44 76.69 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.599 179.91 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 2.6 tp -60.59 -42.69 97.25 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.374 -179.482 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.442 HD23 HD11 ' A' ' 90' ' ' ILE . 34.1 mt -56.54 -34.81 67.42 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.152 -179.497 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 99.2 mt-30 -71.74 -35.58 70.17 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.42 179.38 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 94.9 mt-10 -61.7 -48.95 78.44 Favored 'General case' 0 C--O 1.231 0.09 0 CA-C-O 120.913 0.387 . . . . 0.0 111.107 -178.887 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.442 HD11 HD23 ' A' ' 87' ' ' LEU . 21.8 pt -62.3 -36.76 76.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.506 -179.929 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -58.18 -47.6 82.91 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.572 -179.518 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 76.1 mm-40 -64.55 -49.09 72.59 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.707 179.973 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 19.3 tptm -62.18 -48.07 81.68 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.724 -179.457 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -71.88 -15.37 62.11 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.429 -179.984 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 1.9 p 74.54 15.52 3.36 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.473 -179.723 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 11.2 p -84.26 161.91 20.32 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.676 -179.984 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 60.2 mt -61.62 124.68 21.37 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.493 -179.948 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.617 ' N ' HD12 ' A' ' 98' ' ' LEU . 9.4 mp -49.09 147.93 4.55 Favored Pre-proline 0 C--N 1.326 -0.436 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.706 -179.513 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_endo -68.45 140.11 47.08 Favored 'Trans proline' 0 C--N 1.311 -1.405 0 C-N-CA 122.508 2.138 . . . . 0.0 112.009 179.452 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 85.9 t80 -132.36 133.84 44.46 Favored 'General case' 0 CA--C 1.517 -0.322 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 179.819 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 45.0 m-85 -103.35 149.32 24.87 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.35 -179.303 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -152.27 93.5 1.82 Allowed 'General case' 0 C--O 1.234 0.265 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.175 179.883 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . 0.433 ' H ' HG22 ' A' ' 103' ' ' THR . 0.0 OUTLIER -70.93 138.95 50.5 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.178 179.848 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -126.59 152.77 46.18 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.209 179.945 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 43.4 p -105.93 134.6 48.79 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-O 120.819 0.342 . . . . 0.0 110.414 179.798 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 51.0 p -161.7 161.0 29.24 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.229 179.902 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 116.83 -176.9 16.49 Favored Glycine 0 CA--C 1.523 0.584 0 N-CA-C 110.889 -0.884 . . . . 0.0 110.889 179.789 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -62.43 152.59 76.19 Favored 'Trans proline' 0 C--N 1.307 -1.644 0 C-N-CA 122.627 2.218 . . . . 0.0 112.298 -179.717 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 78.7 p -67.66 -15.35 63.6 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 109.46 -0.57 . . . . 0.0 109.46 178.833 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 77.2 m80 -90.13 -43.76 10.24 Favored 'General case' 0 CA--C 1.519 -0.242 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.546 179.981 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -124.89 78.67 65.2 Favored Pre-proline 0 N--CA 1.462 0.17 0 CA-C-N 116.018 -0.537 . . . . 0.0 109.636 179.011 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -82.0 126.91 5.22 Favored 'Trans proline' 0 C--N 1.306 -1.686 0 C-N-CA 122.467 2.112 . . . . 0.0 112.168 -179.716 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 3.9 p -108.16 172.9 6.57 Favored 'General case' 0 CA--C 1.516 -0.339 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.078 179.756 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 1.2 m-85 -131.1 145.46 52.0 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.448 -179.743 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 89.7 m -128.98 123.8 33.37 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.035 179.368 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . 0.414 ' OG ' ' O ' ' A' ' 136' ' ' ALA . 93.6 p -92.06 119.37 31.69 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.731 -179.865 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 91.2 m -106.22 123.54 48.2 Favored 'General case' 0 N--CA 1.465 0.301 0 N-CA-C 109.991 -0.374 . . . . 0.0 109.991 179.921 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 7.5 p -109.7 137.81 40.15 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.301 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.144 -179.946 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 82.8 tt0 -123.47 131.29 53.6 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.707 -179.907 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . 0.626 ' CZ ' ' CE1' ' A' ' 125' ' ' PHE . 47.2 p90 -166.53 157.34 12.49 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.428 179.504 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 53.93 21.72 2.98 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.915 0.388 . . . . 0.0 110.494 179.667 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 75.45 21.51 77.28 Favored Glycine 0 CA--C 1.522 0.499 0 N-CA-C 111.024 -0.83 . . . . 0.0 111.024 -179.991 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -132.51 152.95 51.39 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.536 0.208 . . . . 0.0 110.509 179.944 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . 0.471 ' O ' HG13 ' A' ' 124' ' ' VAL . 12.0 p -122.49 128.27 75.33 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.232 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.776 -179.914 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 125' ' ' PHE . . . . . 0.626 ' CE1' ' CZ ' ' A' ' 120' ' ' PHE . 25.5 m-85 -114.02 123.46 49.75 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.257 179.673 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 96.0 p -83.29 137.36 34.02 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.531 -179.912 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -85.12 -171.48 48.28 Favored Glycine 0 CA--C 1.521 0.424 0 N-CA-C 110.711 -0.955 . . . . 0.0 110.711 179.93 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . 0.42 ' O ' ' CG ' ' A' ' 128' ' ' GLU . 9.7 pt-20 -92.74 127.57 38.29 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-O 121.003 0.43 . . . . 0.0 110.858 -179.823 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 129' ' ' GLU . . . . . 0.602 ' CD ' ' H ' ' A' ' 129' ' ' GLU . 1.2 pm0 -54.64 145.34 19.3 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 121.066 0.46 . . . . 0.0 110.695 179.305 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -171.66 163.15 6.53 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.645 179.884 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 51.8 tttm -89.2 33.91 0.8 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.986 0.422 . . . . 0.0 110.301 179.447 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -154.43 143.05 20.77 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.667 -179.644 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -78.91 -45.65 20.11 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.247 179.938 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 43.9 pttt -53.32 -46.71 69.56 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.539 -179.433 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 4.1 tp -66.69 -42.11 87.01 Favored 'General case' 0 N--CA 1.443 -0.78 0 CA-C-O 120.741 0.305 . . . . 0.0 110.942 -179.756 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 136' ' ' ALA . . . . . 0.414 ' O ' ' OG ' ' A' ' 116' ' ' SER . . . -59.55 -51.96 67.62 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.48 -179.381 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 95.6 mt-10 -55.77 -44.0 77.26 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.384 -179.667 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 47.9 ttp -61.54 -42.54 98.97 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.266 -179.739 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 23.3 m -63.16 -39.01 93.43 Favored 'General case' 0 CA--C 1.519 -0.221 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.954 -179.841 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -64.27 -44.89 90.32 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.009 0.433 . . . . 0.0 110.589 -179.788 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -72.16 -24.17 61.39 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.389 179.934 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 63.4 tttp -71.11 -48.89 49.68 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.293 179.867 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 7.5 p -68.34 -37.75 78.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.698 -179.734 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -62.9 -44.59 95.67 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.781 -179.544 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 145' ' ' PHE . . . . . . . . . . . . . 60.6 t80 -59.9 -43.12 95.02 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.739 -179.39 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 146' ' ' MET . . . . . . . . . . . . . 47.1 ttp -61.26 -39.43 90.34 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.732 0.301 . . . . 0.0 110.848 -179.242 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 12.2 t -67.44 -44.62 78.25 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.966 -179.999 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 148' ' ' ILE . . . . . . . . . . . . . 91.4 mt -56.22 -33.47 37.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.695 -179.665 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 56.0 mtpt . . . . . 0 C--N 1.324 -0.505 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.797 -179.929 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . 0.481 ' C ' ' N ' ' A' ' 84' ' ' LYS . . . . . . . . 0 N--CA 1.449 -0.483 0 CA-C-O 121.075 0.464 . . . . 0.0 110.086 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 -46.7 -16.06 0.03 OUTLIER 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.027 179.533 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.481 ' N ' ' C ' ' A' ' 82' ' ' ALA . 99.4 mttt -64.72 -41.07 96.25 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.844 -0.617 . . . . 0.0 110.125 179.69 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 14.3 m120 -66.71 -47.2 73.1 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.692 -179.823 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 5.8 tt -60.82 -42.96 98.72 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.723 -179.406 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.432 HD23 HD11 ' A' ' 90' ' ' ILE . 33.8 mt -55.86 -35.23 66.22 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.259 -179.56 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 88.8 mt-30 -70.71 -34.0 71.45 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.303 179.459 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 80.9 mm-40 -63.95 -49.98 70.42 Favored 'General case' 0 C--O 1.231 0.098 0 C-N-CA 120.608 -0.437 . . . . 0.0 111.188 -178.807 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.432 HD11 HD23 ' A' ' 87' ' ' LEU . 30.8 pt -63.37 -35.39 72.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.515 179.982 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -58.53 -48.88 79.38 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.666 -179.187 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 87.6 mt-30 -66.09 -43.94 85.83 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.776 179.932 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 88.9 tttt -63.47 -48.32 78.14 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.478 -179.84 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 98.4 mt-10 -72.87 -10.11 59.44 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.31 -179.937 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 2.0 p 74.08 8.53 4.7 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.462 -179.881 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 10.0 p -77.66 164.14 25.57 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.322 179.93 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.589 ' N ' HD12 ' A' ' 97' ' ' LEU . 9.6 mp -68.31 128.23 35.81 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.981 0.42 . . . . 0.0 110.422 -179.555 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.549 ' N ' HD12 ' A' ' 98' ' ' LEU . 10.7 mp -46.39 148.54 1.6 Allowed Pre-proline 0 N--CA 1.448 -0.54 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.822 -179.846 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_endo -69.02 140.3 45.08 Favored 'Trans proline' 0 C--N 1.311 -1.42 0 C-N-CA 122.649 2.232 . . . . 0.0 112.072 179.834 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 49.9 t80 -132.27 132.39 42.99 Favored 'General case' 0 C--O 1.235 0.338 0 N-CA-C 109.696 -0.483 . . . . 0.0 109.696 179.823 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 33.7 m-85 -101.94 149.08 24.58 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.755 -179.578 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -142.27 91.38 2.33 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-O 120.991 0.424 . . . . 0.0 111.349 179.918 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 43.6 m -71.52 133.19 45.64 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.085 179.655 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -138.17 161.31 37.16 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 110.136 -0.32 . . . . 0.0 110.136 -179.969 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 37.4 p -100.72 134.96 42.91 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-O 120.906 0.384 . . . . 0.0 110.508 179.743 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 34.1 p -160.75 163.64 32.15 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.473 -179.899 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 119.83 -165.13 13.49 Favored Glycine 0 CA--C 1.526 0.723 0 N-CA-C 111.128 -0.789 . . . . 0.0 111.128 179.583 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 108' ' ' PRO . . . . . 0.443 ' HG2' ' HB3' ' A' ' 111' ' ' ALA . 47.3 Cg_endo -70.2 150.72 65.96 Favored 'Trans proline' 0 C--N 1.306 -1.668 0 C-N-CA 122.61 2.207 . . . . 0.0 112.453 -179.422 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 77.8 p -68.47 -20.02 64.59 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.243 178.729 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 73.0 m80 -85.23 -37.88 19.58 Favored 'General case' 0 CA--C 1.518 -0.251 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.413 179.706 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . 0.511 ' HB1' ' HE2' ' A' ' 131' ' ' LYS . . . -126.91 78.29 73.96 Favored Pre-proline 0 N--CA 1.465 0.291 0 CA-C-O 121.18 0.515 . . . . 0.0 110.396 178.76 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -62.63 122.46 10.82 Favored 'Trans proline' 0 C--N 1.301 -1.966 0 C-N-CA 122.315 2.01 . . . . 0.0 112.367 -179.693 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 40.8 p -111.69 173.96 6.1 Favored 'General case' 0 CA--C 1.515 -0.391 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.198 179.638 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 1.6 m-85 -130.28 144.37 51.33 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.506 -179.579 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 86.1 m -131.26 127.55 38.03 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.479 179.514 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 10.5 t -97.73 122.01 40.31 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.419 -179.934 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 98.5 m -107.78 127.7 53.94 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.183 -179.95 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 7.4 p -111.82 139.24 37.16 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.303 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.239 -179.945 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 84.1 tt0 -124.27 131.21 53.51 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.53 179.736 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . 0.612 ' CZ ' ' CE1' ' A' ' 125' ' ' PHE . 45.2 p90 -167.84 159.1 11.31 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.177 179.249 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 54.57 20.84 3.05 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.145 0.498 . . . . 0.0 109.767 -179.908 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 72.73 23.56 77.68 Favored Glycine 0 CA--C 1.521 0.448 0 N-CA-C 110.937 -0.865 . . . . 0.0 110.937 -179.77 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 62.9 mttp -132.6 152.25 51.69 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.587 0.232 . . . . 0.0 110.382 -179.884 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . 0.491 ' O ' HG13 ' A' ' 124' ' ' VAL . 12.7 p -120.19 127.26 75.89 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.167 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.926 -179.742 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 125' ' ' PHE . . . . . 0.612 ' CE1' ' CZ ' ' A' ' 120' ' ' PHE . 39.2 m-85 -112.74 119.88 39.57 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.079 179.312 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 6.8 m -82.26 138.43 34.6 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.638 -179.998 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -86.65 -168.21 44.56 Favored Glycine 0 CA--C 1.523 0.532 0 N-CA-C 110.646 -0.981 . . . . 0.0 110.646 179.724 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . 0.414 ' H ' ' CB ' ' A' ' 139' ' ' SER . 9.1 pt-20 -98.87 133.26 43.41 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.819 0.342 . . . . 0.0 110.522 -179.87 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -57.33 148.09 23.93 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.072 0.463 . . . . 0.0 110.545 179.068 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -170.78 162.74 7.72 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.811 179.818 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . 0.511 ' HE2' ' HB1' ' A' ' 111' ' ' ALA . 97.2 mttt -88.35 32.79 0.76 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.369 179.22 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 3.1 t -158.43 151.4 22.56 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.741 179.877 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 68.9 mttm -81.56 -36.32 29.22 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.083 0.468 . . . . 0.0 110.442 179.508 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 30.7 mmtp -53.42 -54.28 39.08 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.828 -178.979 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 4.4 tp -64.89 -40.5 95.2 Favored 'General case' 0 N--CA 1.446 -0.639 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.066 -179.906 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -55.64 -54.63 41.81 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.659 -179.172 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 97.3 mt-10 -60.96 -40.01 91.73 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.733 0.302 . . . . 0.0 110.404 -179.458 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 48.2 ttp -62.48 -46.68 87.35 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.735 -179.595 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 139' ' ' SER . . . . . 0.414 ' CB ' ' H ' ' A' ' 128' ' ' GLU . 68.8 m -61.95 -39.07 90.85 Favored 'General case' 0 CA--C 1.518 -0.269 0 CA-C-N 116.554 -0.294 . . . . 0.0 110.965 -179.356 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -63.66 -46.05 87.37 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.981 0.419 . . . . 0.0 110.563 -179.879 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -72.35 -23.5 61.15 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.563 -179.973 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 66.2 tttm -70.35 -48.63 55.53 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.054 0.454 . . . . 0.0 111.428 179.713 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 6.9 p -67.94 -36.41 75.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.614 -179.631 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -64.07 -45.01 90.64 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.614 -179.334 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 145' ' ' PHE . . . . . . . . . . . . . 62.1 t80 -60.46 -41.92 95.13 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.505 -179.615 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 146' ' ' MET . . . . . . . . . . . . . 47.9 ttp -63.74 -40.04 95.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.689 -179.648 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 67.8 m -68.27 -43.64 77.35 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.913 -179.885 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 148' ' ' ILE . . . . . . . . . . . . . 78.5 mt -55.77 -31.85 30.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.704 -179.686 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 54.3 mtpt . . . . . 0 C--N 1.326 -0.429 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.462 179.85 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . 0.483 ' C ' ' N ' ' A' ' 84' ' ' LYS . . . . . . . . 0 N--CA 1.45 -0.461 0 CA-C-O 121.245 0.545 . . . . 0.0 109.968 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -47.48 -15.99 0.06 Allowed 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.616 -0.72 . . . . 0.0 109.777 179.633 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.483 ' N ' ' C ' ' A' ' 82' ' ' ALA . 99.3 mttt -64.59 -41.84 95.98 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.038 179.958 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 57.0 t-20 -65.01 -46.47 81.27 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.615 -179.625 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 5.8 tt -61.21 -41.8 97.48 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.896 -179.665 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.485 HD23 HD11 ' A' ' 90' ' ' ILE . 34.9 mt -57.01 -37.18 71.33 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.223 -0.444 . . . . 0.0 109.939 -179.565 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 87.0 mt-30 -71.29 -34.78 70.96 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.413 179.395 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -63.0 -46.6 86.89 Favored 'General case' 0 N--CA 1.462 0.158 0 C-N-CA 120.727 -0.389 . . . . 0.0 111.412 -179.163 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.485 HD11 HD23 ' A' ' 87' ' ' LEU . 17.5 pt -64.93 -44.15 96.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.891 -179.876 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . 0.474 ' O ' ' N ' ' A' ' 95' ' ' SER . . . -67.21 -47.68 70.15 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.955 -179.643 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 52.0 tt0 -66.85 -45.08 79.31 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.83 -179.921 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 88.9 tttt -62.87 -46.98 85.32 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.577 -179.865 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 70.0 mm-40 -90.85 2.1 56.42 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.328 -179.645 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' SER . . . . . 0.474 ' N ' ' O ' ' A' ' 91' ' ' ALA . 3.2 t 40.99 78.01 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.488 179.911 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . 0.416 ' O ' ' CB ' ' A' ' 97' ' ' LEU . 67.0 p -136.44 38.59 2.68 Favored 'General case' 0 CA--C 1.513 -0.462 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.485 -179.702 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.416 ' CB ' ' O ' ' A' ' 96' ' ' SER . 3.2 tp 78.15 94.47 0.06 Allowed 'General case' 0 N--CA 1.454 -0.254 0 CA-C-O 120.896 0.379 . . . . 0.0 111.026 179.514 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.544 ' N ' HD12 ' A' ' 98' ' ' LEU . 10.8 mp -44.99 148.8 0.93 Allowed Pre-proline 0 C--N 1.326 -0.428 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.484 -179.784 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_endo -68.99 138.3 39.94 Favored 'Trans proline' 0 N--CA 1.495 1.591 0 C-N-CA 122.53 2.154 . . . . 0.0 112.174 -179.879 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 90.8 t80 -125.56 127.32 46.19 Favored 'General case' 0 CA--C 1.513 -0.463 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 179.991 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 92.8 m-85 -93.78 141.26 28.7 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.5 -179.182 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -136.7 138.0 40.57 Favored 'General case' 0 CA--C 1.514 -0.424 0 N-CA-C 110.064 -0.347 . . . . 0.0 110.064 179.619 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 25.2 m -120.31 126.6 50.94 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.455 -179.963 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -127.31 153.57 46.01 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.092 179.654 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 33.7 p -102.69 133.41 47.77 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-O 120.879 0.371 . . . . 0.0 110.196 179.836 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 50.8 p -162.7 166.36 24.51 Favored 'General case' 0 CA--C 1.515 -0.403 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.273 -179.745 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 120.58 -163.2 14.26 Favored Glycine 0 CA--C 1.527 0.79 0 N-CA-C 111.153 -0.779 . . . . 0.0 111.153 179.572 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 40.9 Cg_endo -69.53 147.42 64.28 Favored 'Trans proline' 0 N--CA 1.494 1.533 0 C-N-CA 122.59 2.193 . . . . 0.0 112.335 -179.324 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 78.8 p -68.5 -16.69 63.97 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.848 179.092 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 95.8 m-70 -86.01 -41.32 14.94 Favored 'General case' 0 CA--C 1.516 -0.364 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.181 179.998 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -126.96 78.33 74.11 Favored Pre-proline 0 N--CA 1.467 0.418 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.264 178.562 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_exo -59.92 125.68 18.33 Favored 'Trans proline' 0 C--N 1.304 -1.78 0 C-N-CA 122.465 2.11 . . . . 0.0 112.395 -179.693 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 69.1 p -111.57 173.83 6.16 Favored 'General case' 0 CA--C 1.514 -0.416 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.097 179.825 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 -132.1 146.66 52.19 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.651 -179.714 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 86.4 m -129.55 124.38 33.72 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.023 179.446 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 60.3 m -94.75 121.93 36.85 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.538 -179.953 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . 0.427 ' CG2' ' CG2' ' A' ' 124' ' ' VAL . 81.3 m -112.92 127.29 56.16 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.218 -179.891 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 11.9 p -112.89 144.91 19.62 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.23 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.015 -179.792 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 82.9 tt0 -126.28 133.03 51.54 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.695 -179.867 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . 0.628 ' CZ ' ' CE1' ' A' ' 125' ' ' PHE . 48.7 p90 -166.73 157.96 12.59 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.508 179.478 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 53.38 19.98 1.81 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.871 0.367 . . . . 0.0 110.755 179.599 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 77.51 21.43 72.48 Favored Glycine 0 CA--C 1.524 0.655 0 N-CA-C 111.131 -0.788 . . . . 0.0 111.131 179.872 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -132.67 152.04 51.8 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 110.198 -0.297 . . . . 0.0 110.198 179.917 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . 0.49 ' O ' HG13 ' A' ' 124' ' ' VAL . 13.1 p -120.69 127.69 75.96 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.301 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.861 -179.804 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 125' ' ' PHE . . . . . 0.628 ' CE1' ' CZ ' ' A' ' 120' ' ' PHE . 53.0 m-85 -113.08 120.12 40.2 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.159 179.879 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 72.0 m -83.32 138.78 33.4 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.468 179.955 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -85.0 -169.38 45.92 Favored Glycine 0 CA--C 1.52 0.379 0 N-CA-C 110.591 -1.004 . . . . 0.0 110.591 179.871 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . 0.428 ' H ' ' CB ' ' A' ' 139' ' ' SER . 6.6 pt-20 -97.34 132.99 42.54 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-O 120.839 0.352 . . . . 0.0 110.95 -179.711 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 98.1 mt-10 -55.38 146.0 20.8 Favored 'General case' 0 C--N 1.32 -0.717 0 C-N-CA 120.508 -0.477 . . . . 0.0 110.484 179.522 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -169.53 160.4 9.04 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.524 -179.997 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 29.3 ttpt -91.12 32.48 1.02 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.044 0.449 . . . . 0.0 110.479 179.789 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -151.49 140.9 21.51 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.573 -179.75 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 28.6 ttmt -74.66 -47.08 33.86 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.352 179.885 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . 0.404 ' HG3' ' N ' ' A' ' 135' ' ' LEU . 47.1 pttt -53.7 -46.22 70.66 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.509 -179.252 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . 0.404 ' N ' ' HG3' ' A' ' 134' ' ' LYS . 4.7 tp -65.32 -39.44 92.45 Favored 'General case' 0 N--CA 1.444 -0.768 0 CA-C-O 120.811 0.338 . . . . 0.0 110.977 -179.678 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -57.68 -52.06 66.97 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.745 -179.311 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 69.9 mm-40 -57.85 -41.26 82.02 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.866 0.365 . . . . 0.0 110.608 -179.75 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 94.8 mtp -63.81 -41.39 97.88 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.575 -179.789 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 139' ' ' SER . . . . . 0.428 ' CB ' ' H ' ' A' ' 128' ' ' GLU . 15.2 m -64.05 -39.2 93.54 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-N 116.544 -0.298 . . . . 0.0 110.72 -179.687 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -65.69 -44.38 86.36 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.819 -179.896 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -71.74 -24.79 61.84 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.568 179.983 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 38.1 ttmt -71.24 -48.56 50.39 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.201 179.773 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 143' ' ' VAL . . . . . 0.401 HG13 ' N ' ' A' ' 144' ' ' ALA . 7.1 p -70.11 -37.81 73.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.799 -179.626 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 144' ' ' ALA . . . . . 0.401 ' N ' HG13 ' A' ' 143' ' ' VAL . . . -63.89 -47.08 82.06 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-O 120.838 0.352 . . . . 0.0 110.801 -179.764 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 145' ' ' PHE . . . . . . . . . . . . . 63.7 t80 -60.55 -43.47 97.19 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.795 179.935 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 146' ' ' MET . . . . . . . . . . . . . 63.9 ttp -60.24 -38.64 84.05 Favored 'General case' 0 C--N 1.327 -0.407 0 O-C-N 123.331 0.394 . . . . 0.0 111.077 -179.433 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 48.8 m -72.26 -42.61 65.4 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.165 179.81 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 148' ' ' ILE . . . . . . . . . . . . . 71.9 mt -54.87 -25.33 15.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.63 -179.695 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 36.6 mtmt . . . . . 0 C--N 1.319 -0.728 0 C-N-CA 120.573 -0.451 . . . . 0.0 110.556 -179.617 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . 0.481 ' O ' ' N ' ' A' ' 84' ' ' LYS . . . . . . . . 0 N--CA 1.45 -0.45 0 CA-C-O 120.895 0.379 . . . . 0.0 110.379 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 -46.63 -15.83 0.03 OUTLIER 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.203 179.509 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.481 ' N ' ' O ' ' A' ' 82' ' ' ALA . 63.8 mttp -64.45 -41.64 96.43 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.182 179.311 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 14.6 m120 -65.29 -47.14 77.68 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.522 -179.33 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 7.0 tt -59.74 -43.65 94.16 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.692 -179.126 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.454 HD23 HD11 ' A' ' 90' ' ' ILE . 59.0 mt -55.93 -35.56 66.76 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.523 -179.937 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 88.9 mt-30 -70.84 -34.98 72.24 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.425 179.496 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -63.78 -48.12 78.22 Favored 'General case' 0 C--O 1.23 0.054 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.001 -178.794 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.454 HD11 HD23 ' A' ' 87' ' ' LEU . 29.8 pt -66.48 -35.09 74.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.606 179.919 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -58.05 -49.65 76.17 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.36 -179.398 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 56.8 tt0 -65.19 -44.26 88.96 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.707 -179.656 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 65.2 tttm -63.43 -47.15 83.12 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.557 -179.938 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -76.47 -0.45 23.0 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.351 -179.825 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 3.9 t 65.49 7.4 4.33 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.653 -179.813 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 26.0 m -75.15 158.03 33.69 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.483 -179.93 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.562 ' N ' HD12 ' A' ' 97' ' ' LEU . 10.2 mp -64.39 128.19 34.7 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.398 -179.789 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.574 ' N ' HD12 ' A' ' 98' ' ' LEU . 10.2 mp -50.13 148.02 6.52 Favored Pre-proline 0 N--CA 1.451 -0.396 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.609 179.764 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -71.08 142.96 43.35 Favored 'Trans proline' 0 C--N 1.311 -1.401 0 C-N-CA 122.772 2.314 . . . . 0.0 112.173 179.539 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 74.4 t80 -130.72 132.96 45.66 Favored 'General case' 0 C--O 1.233 0.237 0 N-CA-C 109.809 -0.441 . . . . 0.0 109.809 -179.994 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 39.0 m-85 -103.81 149.53 24.96 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.655 -179.734 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -150.02 92.99 1.95 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.924 0.392 . . . . 0.0 111.025 -179.908 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . 0.479 ' H ' HG22 ' A' ' 103' ' ' THR . 0.0 OUTLIER -70.4 136.99 50.07 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.195 179.911 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -128.25 153.32 47.08 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 120.866 0.365 . . . . 0.0 110.244 179.873 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 35.0 p -103.86 135.71 44.89 Favored 'General case' 0 N--CA 1.455 -0.208 0 CA-C-O 120.912 0.387 . . . . 0.0 110.642 179.9 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 24.8 m -163.1 161.81 25.41 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.447 179.987 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 116.68 -175.07 15.55 Favored Glycine 0 CA--C 1.522 0.52 0 N-CA-C 111.035 -0.826 . . . . 0.0 111.035 179.592 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_endo -64.66 152.22 82.72 Favored 'Trans proline' 0 C--N 1.301 -1.962 0 C-N-CA 122.725 2.283 . . . . 0.0 112.251 -179.904 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 78.1 p -66.39 -19.29 65.76 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.351 178.93 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 57.7 t-80 -86.84 -43.65 12.31 Favored 'General case' 0 CA--C 1.52 -0.188 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.541 179.821 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -124.66 77.75 63.9 Favored Pre-proline 0 N--CA 1.463 0.211 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.261 179.19 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -78.94 128.5 8.44 Favored 'Trans proline' 0 C--N 1.305 -1.716 0 C-N-CA 122.595 2.197 . . . . 0.0 112.375 -179.452 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 2.9 p -109.68 173.7 6.2 Favored 'General case' 0 CA--C 1.517 -0.305 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.321 179.485 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -131.25 143.89 50.9 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.526 -179.657 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 88.3 m -127.13 125.5 41.3 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.642 179.489 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 7.3 t -97.27 120.4 37.56 Favored 'General case' 0 CA--C 1.518 -0.258 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.389 -179.958 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 94.9 m -105.93 127.37 53.09 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.163 179.916 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 8.8 p -110.2 137.14 43.82 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.271 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.272 -179.901 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 9.1 tm-20 -124.16 130.42 52.52 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.613 -179.909 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . 0.626 ' CZ ' ' CE1' ' A' ' 125' ' ' PHE . 45.4 p90 -164.93 158.12 16.8 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.566 179.006 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 53.61 23.42 3.56 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.606 179.819 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 73.85 22.49 78.06 Favored Glycine 0 CA--C 1.521 0.461 0 N-CA-C 110.881 -0.888 . . . . 0.0 110.881 179.874 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -133.25 153.81 51.22 Favored 'General case' 0 CA--C 1.516 -0.337 0 CA-C-O 120.889 0.376 . . . . 0.0 110.606 179.789 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . 0.431 ' O ' HG13 ' A' ' 124' ' ' VAL . 7.2 p -122.2 128.61 75.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.862 -179.75 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 125' ' ' PHE . . . . . 0.626 ' CE1' ' CZ ' ' A' ' 120' ' ' PHE . 26.1 m-85 -113.33 122.33 47.09 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.249 179.408 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 4.8 p -81.97 136.64 35.26 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.512 -179.898 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -88.86 -170.26 45.23 Favored Glycine 0 CA--C 1.522 0.51 0 N-CA-C 110.785 -0.926 . . . . 0.0 110.785 179.902 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . 0.497 ' H ' ' CB ' ' A' ' 139' ' ' SER . 14.9 tt0 -96.55 133.98 40.34 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-O 120.872 0.368 . . . . 0.0 110.71 179.581 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -58.93 149.39 27.27 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.501 179.209 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -171.17 160.78 6.46 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.613 179.982 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -86.59 33.55 0.64 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.624 179.011 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 4.6 t -158.42 150.82 21.92 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.579 179.833 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . 0.417 ' NZ ' ' OG1' ' A' ' 103' ' ' THR . 68.4 mttm -82.41 -21.85 35.59 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.741 179.66 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -68.92 -54.79 13.52 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.774 -179.106 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 4.3 tp -63.61 -41.67 98.3 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 116.51 -0.314 . . . . 0.0 111.046 -179.635 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -55.46 -54.91 38.0 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.497 -179.365 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -61.01 -38.31 85.64 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.46 179.847 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 48.0 ttp -62.85 -42.7 99.85 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.387 -179.512 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 139' ' ' SER . . . . . 0.497 ' CB ' ' H ' ' A' ' 128' ' ' GLU . 63.3 m -65.23 -38.65 91.05 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.893 -179.781 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -63.42 -46.44 86.36 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.962 0.411 . . . . 0.0 110.717 -179.892 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -71.21 -22.98 61.94 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.449 179.95 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 65.7 tttm -71.62 -49.27 41.72 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.327 179.674 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 143' ' ' VAL . . . . . 0.407 HG13 ' N ' ' A' ' 144' ' ' ALA . 6.4 p -67.45 -39.03 81.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.652 -179.4 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 144' ' ' ALA . . . . . 0.407 ' N ' HG13 ' A' ' 143' ' ' VAL . . . -61.96 -44.91 95.77 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.564 -179.3 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 145' ' ' PHE . . . . . . . . . . . . . 60.2 t80 -58.48 -42.74 88.2 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.522 -179.261 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 146' ' ' MET . . . . . . . . . . . . . 56.3 mtt -63.74 -39.62 94.72 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.943 -179.604 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 68.1 m -67.18 -45.69 76.19 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.974 -179.946 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 148' ' ' ILE . . . . . . . . . . . . . 81.5 mt -52.56 -36.24 21.99 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.54 -179.509 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 54.7 mtpt . . . . . 0 C--N 1.326 -0.428 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.782 -179.484 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 30.9 m . . . . . 0 N--CA 1.49 1.554 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.489 ' O ' ' N ' ' A' ' 84' ' ' LYS . . . -153.5 96.2 2.0 Allowed 'General case' 0 N--CA 1.453 -0.296 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.548 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 1.9 m-85 -45.41 -16.37 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.336 179.887 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.489 ' N ' ' O ' ' A' ' 82' ' ' ALA . 67.8 mttm -64.41 -40.13 95.18 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.11 179.677 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 13.6 m120 -66.08 -47.47 74.13 Favored 'General case' 0 N--CA 1.457 -0.098 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.485 -179.658 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 6.5 tt -60.95 -42.06 97.49 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.549 -179.319 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 34.7 mt -55.78 -37.32 68.42 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.062 -179.576 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 86.6 mt-30 -71.32 -36.69 71.68 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.981 0.419 . . . . 0.0 110.511 179.577 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 70.6 mm-40 -59.63 -49.26 78.44 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.994 -179.222 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 30.3 pt -64.29 -32.3 56.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.637 179.576 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -55.85 -49.3 73.69 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.178 -179.404 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 59.4 tt0 -67.14 -49.76 63.71 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.914 -179.683 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 65.4 tttm -58.95 -50.78 72.78 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.534 -179.335 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . 0.467 ' O ' ' CB ' ' A' ' 95' ' ' SER . 97.6 mt-10 -69.95 -15.76 63.1 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.6 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . 0.467 ' CB ' ' O ' ' A' ' 94' ' ' GLU . 0.7 OUTLIER 79.17 9.91 1.64 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.433 -179.731 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 20.7 m -77.61 162.86 26.74 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.531 -179.793 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.574 HD12 ' N ' ' A' ' 97' ' ' LEU . 9.7 mp -70.22 127.49 32.97 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.683 -179.959 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.593 ' N ' HD12 ' A' ' 98' ' ' LEU . 10.1 mp -45.31 120.58 4.7 Favored Pre-proline 0 N--CA 1.452 -0.358 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.488 179.756 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -49.34 149.02 9.81 Favored 'Trans proline' 0 C--N 1.308 -1.563 0 C-N-CA 122.941 2.428 . . . . 0.0 112.866 179.404 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 85.1 t80 -130.73 133.48 46.08 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-O 121.119 0.485 . . . . 0.0 110.598 -179.32 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 88.2 m-85 -96.41 143.74 27.17 Favored 'General case' 0 N--CA 1.463 0.182 0 C-N-CA 120.745 -0.382 . . . . 0.0 111.251 -179.346 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -146.41 147.58 31.42 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.999 0.428 . . . . 0.0 110.93 -179.698 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -133.55 143.31 48.63 Favored 'General case' 0 CA--C 1.516 -0.348 0 CA-C-O 120.82 0.343 . . . . 0.0 110.463 179.594 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -120.68 146.83 46.03 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 120.882 0.373 . . . . 0.0 110.342 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 21.1 p -115.4 126.96 55.03 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.51 179.767 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 47.6 t -165.46 156.2 13.71 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.58 179.879 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 127.83 166.06 11.98 Favored Glycine 0 CA--C 1.524 0.602 0 N-CA-C 111.208 -0.757 . . . . 0.0 111.208 179.678 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . 0.57 ' HG2' ' HB3' ' A' ' 111' ' ' ALA . 29.1 Cg_endo -61.46 152.45 72.95 Favored 'Trans proline' 0 C--N 1.301 -1.957 0 C-N-CA 122.736 2.29 . . . . 0.0 112.467 179.67 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 78.1 p -64.27 -19.65 65.54 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.279 179.509 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 70.0 m80 -90.03 -38.73 13.39 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.298 179.699 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . 0.57 ' HB3' ' HG2' ' A' ' 108' ' ' PRO . . . -125.21 79.0 66.61 Favored Pre-proline 0 C--O 1.234 0.268 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.216 179.581 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' PRO . . . . . 0.502 ' O ' HG23 ' A' ' 113' ' ' THR . 57.3 Cg_endo -76.33 158.11 37.04 Favored 'Trans proline' 0 C--N 1.3 -2.007 0 C-N-CA 122.883 2.388 . . . . 0.0 112.111 179.657 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . 0.502 HG23 ' O ' ' A' ' 112' ' ' PRO . 25.2 p -156.48 150.96 25.57 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.612 179.648 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -133.91 147.34 51.09 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.375 179.941 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 92.3 m -129.79 124.72 34.05 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.368 179.567 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 11.2 t -99.57 125.93 45.46 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.246 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 81.2 m -122.95 136.21 54.78 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.661 -179.527 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 12.3 p -114.83 147.89 17.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 120.962 0.41 . . . . 0.0 110.322 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 85.2 tt0 -127.23 134.32 50.11 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.415 -179.9 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . 0.623 ' CZ ' ' CE1' ' A' ' 125' ' ' PHE . 49.6 p90 -167.84 159.95 12.0 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.336 179.431 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 54.25 20.7 2.74 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.485 179.462 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 75.62 22.37 75.27 Favored Glycine 0 CA--C 1.522 0.526 0 N-CA-C 110.767 -0.933 . . . . 0.0 110.767 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -131.94 152.5 51.04 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-O 120.876 0.369 . . . . 0.0 110.567 179.839 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . 0.521 ' O ' HG13 ' A' ' 124' ' ' VAL . 7.4 p -120.35 126.61 75.45 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.289 0 CA-C-O 120.916 0.388 . . . . 0.0 110.532 -179.907 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' PHE . . . . . 0.623 ' CE1' ' CZ ' ' A' ' 120' ' ' PHE . 35.6 m-85 -111.42 120.01 40.73 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.294 -0.412 . . . . 0.0 109.913 179.623 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 5.2 p -83.35 137.75 33.82 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.498 -179.777 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -84.71 -168.87 45.06 Favored Glycine 0 CA--C 1.521 0.423 0 N-CA-C 110.618 -0.993 . . . . 0.0 110.618 179.908 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . 0.585 ' H ' ' CB ' ' A' ' 139' ' ' SER . 8.4 pt-20 -98.68 132.97 43.65 Favored 'General case' 0 C--N 1.33 -0.266 0 O-C-N 122.701 -0.293 . . . . 0.0 110.699 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -54.13 144.71 18.96 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.224 179.258 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -169.76 159.92 8.36 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.319 -179.729 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 25.7 pttm -90.9 33.65 0.93 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.527 179.702 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 3.4 t -158.05 149.35 21.24 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.586 -179.612 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -79.65 -32.76 41.63 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.213 179.579 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -59.17 -52.97 63.43 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.005 -178.893 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 4.0 tp -65.32 -40.2 93.43 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.292 -179.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -56.35 -54.91 39.97 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.357 -179.597 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -57.92 -39.93 79.18 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.515 -179.83 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 50.7 ttp -63.47 -41.52 98.6 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.767 -179.753 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . 0.585 ' CB ' ' H ' ' A' ' 128' ' ' GLU . 78.0 p -63.95 -35.73 81.66 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.777 -179.53 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -67.64 -47.03 70.73 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.785 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -71.24 -25.47 62.5 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.93 179.934 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -70.94 -49.36 46.44 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.184 179.832 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 143' ' ' VAL . . . . . 0.452 HG13 ' N ' ' A' ' 144' ' ' ALA . 8.3 p -68.39 -40.05 81.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.885 -179.8 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 144' ' ' ALA . . . . . 0.452 ' N ' HG13 ' A' ' 143' ' ' VAL . . . -62.21 -46.3 89.48 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.941 -179.471 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 145' ' ' PHE . . . . . . . . . . . . . 74.9 t80 -60.26 -42.08 94.58 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.925 0.393 . . . . 0.0 110.621 179.993 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 146' ' ' MET . . . . . . . . . . . . . 33.5 ttm -62.37 -39.58 93.65 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.044 -179.829 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 35.9 t -68.66 -43.45 76.16 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.99 -179.783 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 148' ' ' ILE . . . . . . . . . . . . . 85.4 mt -56.98 -29.94 32.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.796 -179.598 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 25.0 mtpp -62.67 -41.1 98.9 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.766 -179.944 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 150' ' ' ASN . . . . . . . . . . . . . 63.5 t30 -86.07 107.73 17.95 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.589 -179.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.221 -0.679 0 CA-C-O 117.964 -1.464 . . . . 0.0 110.969 179.971 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 55.8 t . . . . . 0 N--CA 1.49 1.539 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.493 ' C ' ' N ' ' A' ' 84' ' ' LYS . . . -153.67 96.0 1.96 Allowed 'General case' 0 N--CA 1.451 -0.422 0 CA-C-O 121.166 0.508 . . . . 0.0 110.332 -179.8 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 3.0 m-85 -47.43 -15.5 0.05 OUTLIER 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.788 -0.642 . . . . 0.0 109.766 179.452 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.493 ' N ' ' C ' ' A' ' 82' ' ' ALA . 99.4 mttt -63.74 -39.95 95.52 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.05 179.795 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . 0.416 ' OD1' ' OE2' ' A' ' 89' ' ' GLU . 24.6 t-20 -66.19 -46.5 77.1 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.675 -0.693 . . . . 0.0 111.049 -179.689 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 6.0 tt -60.54 -42.64 96.94 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.677 -179.547 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 56.9 mt -56.22 -35.06 66.91 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.117 179.794 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 88.6 mt-30 -74.68 -37.46 62.67 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.08 179.26 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.416 ' OE2' ' OD1' ' A' ' 85' ' ' ASN . 97.6 mt-10 -63.32 -50.34 70.43 Favored 'General case' 0 C--O 1.232 0.142 0 C-N-CA 120.776 -0.369 . . . . 0.0 111.415 -179.173 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.462 HD12 ' N ' ' A' ' 91' ' ' ALA . 2.2 pp -66.21 -41.73 89.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.304 179.78 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . 0.462 ' N ' HD12 ' A' ' 90' ' ' ILE . . . -57.18 -48.7 78.07 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.527 -179.871 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 88.6 mt-30 -71.8 -41.33 68.4 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.802 179.779 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 88.9 tttt -60.88 -49.27 78.13 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.551 -179.576 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . 0.429 ' C ' ' H ' ' A' ' 96' ' ' SER . 98.0 mt-10 -75.95 9.21 2.55 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.379 179.947 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . 0.436 ' O ' ' O ' ' A' ' 96' ' ' SER . 13.9 t 55.06 9.03 0.28 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.571 179.955 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . 0.436 ' O ' ' O ' ' A' ' 95' ' ' SER . 5.4 t -59.89 -130.82 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.226 179.724 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 92.3 mt -134.85 124.73 25.51 Favored 'General case' 0 CA--C 1.515 -0.388 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.588 179.895 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.544 ' N ' HD12 ' A' ' 98' ' ' LEU . 10.7 mp -44.94 151.29 0.65 Allowed Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.439 -179.385 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_endo -66.88 170.88 11.96 Favored 'Trans proline' 0 C--N 1.308 -1.559 0 C-N-CA 122.836 2.357 . . . . 0.0 111.931 -179.896 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 32.8 t80 -143.82 114.76 7.79 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.178 179.246 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 97.7 m-85 -96.2 129.93 43.39 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.933 0.397 . . . . 0.0 110.253 -179.948 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -147.44 147.86 30.66 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.427 -179.81 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 1.5 t -136.3 146.16 46.31 Favored 'General case' 0 CA--C 1.518 -0.252 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.563 179.866 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -121.35 146.17 47.13 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.156 179.935 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 12.1 p -114.64 126.2 54.62 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-O 120.978 0.418 . . . . 0.0 110.39 179.839 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 52.8 p -160.72 164.17 31.83 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.275 179.817 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 119.64 163.8 12.41 Favored Glycine 0 CA--C 1.525 0.698 0 N-CA-C 111.005 -0.838 . . . . 0.0 111.005 179.681 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 22.4 Cg_endo -61.15 151.75 76.6 Favored 'Trans proline' 0 C--N 1.304 -1.811 0 C-N-CA 122.938 2.425 . . . . 0.0 112.127 179.537 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 38.8 t -62.94 -19.35 64.17 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.209 179.193 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 58.3 m170 -89.39 -44.09 10.43 Favored 'General case' 0 CA--C 1.517 -0.301 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.499 179.91 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -124.56 77.56 63.21 Favored Pre-proline 0 N--CA 1.467 0.387 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.156 179.244 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' PRO . . . . . 0.457 ' O ' HG23 ' A' ' 113' ' ' THR . 72.9 Cg_endo -77.33 165.09 28.15 Favored 'Trans proline' 0 C--N 1.306 -1.672 0 C-N-CA 122.661 2.24 . . . . 0.0 112.367 -179.694 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . 0.457 HG23 ' O ' ' A' ' 112' ' ' PRO . 38.8 p -156.17 151.4 26.6 Favored 'General case' 0 CA--C 1.516 -0.352 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.314 179.929 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -132.49 145.79 51.44 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.442 -179.853 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 88.7 m -133.45 128.15 34.84 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.184 -0.462 . . . . 0.0 109.991 179.63 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 27.6 t -102.19 129.76 48.66 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.471 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 65.4 m -119.09 132.63 56.03 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.032 -179.908 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 12.8 p -113.64 146.15 18.6 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.214 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.104 -179.597 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 81.2 tt0 -131.07 139.2 49.86 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.724 179.929 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . 0.626 ' CZ ' ' CE1' ' A' ' 125' ' ' PHE . 52.4 p90 -168.89 160.26 10.09 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.576 179.739 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 51.87 22.42 1.74 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.992 0.425 . . . . 0.0 110.683 179.697 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 75.88 22.74 73.82 Favored Glycine 0 CA--C 1.524 0.65 0 N-CA-C 111.132 -0.787 . . . . 0.0 111.132 179.825 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -132.19 151.02 52.02 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 110.089 -0.337 . . . . 0.0 110.089 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . 0.446 ' O ' HG13 ' A' ' 124' ' ' VAL . 6.5 p -118.23 125.06 73.99 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.225 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.93 -179.644 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 125' ' ' PHE . . . . . 0.626 ' CE1' ' CZ ' ' A' ' 120' ' ' PHE . 63.0 m-85 -110.14 117.53 33.96 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 116.185 -0.461 . . . . 0.0 109.888 179.903 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 6.0 p -80.6 132.12 35.59 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.503 -179.909 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -84.69 -167.64 43.24 Favored Glycine 0 CA--C 1.52 0.391 0 N-CA-C 110.614 -0.995 . . . . 0.0 110.614 179.689 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . 0.441 ' H ' ' CB ' ' A' ' 139' ' ' SER . 4.6 pt-20 -90.77 -178.6 5.3 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.835 0.35 . . . . 0.0 110.182 -179.905 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . 0.539 ' N ' ' OE1' ' A' ' 129' ' ' GLU . 55.1 mp0 -110.8 145.7 37.69 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.235 178.995 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -170.24 163.35 8.91 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.689 -179.936 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 62.1 mttp -85.83 35.31 0.62 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.37 179.354 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 7.5 t -157.54 150.54 23.32 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.676 179.887 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 63.2 mttp -82.06 -34.73 29.3 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.824 179.398 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . 0.405 ' N ' ' CD ' ' A' ' 134' ' ' LYS . 13.6 mptt -56.66 -54.34 47.18 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.84 -178.789 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 11.6 tp -63.34 -38.43 91.12 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.559 -179.696 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -58.13 -54.48 46.51 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.808 -179.574 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 81.1 mm-40 -58.75 -42.74 89.59 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.797 0.332 . . . . 0.0 110.403 -179.674 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 26.1 ttm -61.48 -41.41 97.21 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.664 179.882 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . 0.441 ' CB ' ' H ' ' A' ' 128' ' ' GLU . 15.7 m -58.81 -39.93 82.6 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.786 -179.699 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -64.88 -42.23 95.0 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.93 0.395 . . . . 0.0 111.046 -179.897 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -69.66 -28.81 66.2 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.95 179.97 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 85.5 mttt -71.73 -49.79 36.09 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.79 179.694 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 143' ' ' VAL . . . . . 0.484 HG13 ' N ' ' A' ' 144' ' ' ALA . 7.3 p -67.34 -42.52 87.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.737 -179.581 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 144' ' ' ALA . . . . . 0.484 ' N ' HG13 ' A' ' 143' ' ' VAL . . . -63.16 -46.47 87.04 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.901 -179.81 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 145' ' ' PHE . . . . . . . . . . . . . 69.6 t80 -60.21 -42.69 95.68 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.534 -179.757 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 146' ' ' MET . . . . . . . . . . . . . 54.6 ttp -61.43 -37.57 84.01 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.631 -179.487 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 37.6 t -71.29 -44.28 65.48 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.962 0.41 . . . . 0.0 111.133 179.858 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 148' ' ' ILE . . . . . . . . . . . . . 90.6 mt -55.95 -30.44 28.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.525 -179.752 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 53.3 mtpt -62.31 -42.75 99.63 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.789 179.888 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 150' ' ' ASN . . . . . . . . . . . . . 58.3 t30 -86.97 109.99 19.74 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.388 -179.945 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.727 0 CA-C-O 117.984 -1.454 . . . . 0.0 110.854 179.96 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 4.6 m . . . . . 0 N--CA 1.49 1.528 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.493 ' C ' ' N ' ' A' ' 84' ' ' LYS . . . -153.6 96.71 2.04 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-O 121.253 0.549 . . . . 0.0 110.187 -179.756 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 2.2 m-85 -46.46 -16.09 0.03 OUTLIER 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 115.845 -0.616 . . . . 0.0 109.929 179.633 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.493 ' N ' ' C ' ' A' ' 82' ' ' ALA . 68.4 mttm -63.9 -39.74 94.89 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.089 179.67 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 45.2 t30 -66.58 -47.07 73.92 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.679 -179.838 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 7.0 tt -61.76 -41.34 97.56 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.812 -179.905 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 32.3 mt -55.79 -36.24 67.18 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.139 -0.482 . . . . 0.0 109.856 -179.527 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 90.5 mt-30 -72.29 -36.05 68.85 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.294 179.29 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 70.3 mm-40 -60.34 -47.3 86.64 Favored 'General case' 0 C--O 1.233 0.216 0 C-N-CA 120.779 -0.368 . . . . 0.0 111.043 -179.131 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 28.0 pt -65.08 -32.89 60.23 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.499 179.869 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -55.49 -49.28 72.95 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.541 -179.604 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . 0.606 HE21 HD11 ' A' ' 98' ' ' LEU . 90.4 mm-40 -67.92 -49.46 61.74 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.301 -0.408 . . . . 0.0 111.116 179.798 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -58.88 -51.25 70.85 Favored 'General case' 0 C--N 1.331 -0.203 0 C-N-CA 120.702 -0.399 . . . . 0.0 110.786 -179.379 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . 0.406 ' O ' ' CB ' ' A' ' 95' ' ' SER . 80.4 mm-40 -68.97 -13.75 62.64 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.666 179.748 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . 0.406 ' CB ' ' O ' ' A' ' 94' ' ' GLU . 1.0 OUTLIER 75.45 10.37 3.52 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.287 -179.861 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 8.6 p -79.71 166.2 22.04 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.659 -179.518 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 70.3 mt -72.7 133.8 44.76 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.932 0.396 . . . . 0.0 110.739 -179.706 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.606 HD11 HE21 ' A' ' 92' ' ' GLN . 11.0 mp -44.81 152.92 0.51 Allowed Pre-proline 0 C--N 1.327 -0.405 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.71 -179.651 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_endo -61.17 170.0 5.55 Favored 'Trans proline' 0 N--CA 1.496 1.654 0 C-N-CA 122.847 2.365 . . . . 0.0 111.889 179.964 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 42.6 t80 -145.9 117.92 8.28 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.454 179.172 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' TYR . . . . . 0.471 ' CE2' ' NZ ' ' A' ' 84' ' ' LYS . 96.9 m-85 -102.79 136.62 42.28 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.898 0.38 . . . . 0.0 110.349 179.949 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -145.98 146.68 31.1 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.455 -179.803 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 92.2 m -124.31 130.86 53.25 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.314 179.926 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -111.35 139.8 46.45 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.529 -0.305 . . . . 0.0 110.224 179.825 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 22.7 p -117.22 122.71 44.76 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-O 121.019 0.438 . . . . 0.0 110.803 179.499 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 51.8 p -162.52 162.6 27.45 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.325 179.893 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 126.4 165.45 11.99 Favored Glycine 0 CA--C 1.523 0.54 0 N-CA-C 111.118 -0.793 . . . . 0.0 111.118 179.511 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -60.54 150.9 79.1 Favored 'Trans proline' 0 C--N 1.304 -1.796 0 C-N-CA 122.787 2.325 . . . . 0.0 112.036 179.378 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 99.0 p -63.2 -16.74 61.1 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.416 179.379 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 84.6 t60 -92.66 -43.4 9.11 Favored 'General case' 0 CA--C 1.519 -0.23 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.627 179.759 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -124.24 78.16 60.45 Favored Pre-proline 0 CA--C 1.531 0.219 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.527 179.807 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' PRO . . . . . 0.473 ' O ' HG23 ' A' ' 113' ' ' THR . 70.2 Cg_endo -76.43 163.22 32.49 Favored 'Trans proline' 0 C--N 1.305 -1.718 0 C-N-CA 122.669 2.246 . . . . 0.0 112.192 -179.949 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . 0.473 HG23 ' O ' ' A' ' 112' ' ' PRO . 31.0 p -156.61 151.32 25.81 Favored 'General case' 0 CA--C 1.514 -0.431 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.132 179.375 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -131.27 144.52 51.35 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.022 -0.535 . . . . 0.0 109.734 -179.801 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . 0.424 ' OG1' ' OE1' ' A' ' 129' ' ' GLU . 72.4 m -130.33 125.5 34.84 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.932 0.396 . . . . 0.0 110.16 179.822 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 11.7 t -96.94 122.4 39.88 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.018 179.779 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 52.2 m -114.24 130.62 56.64 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.131 179.911 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 10.8 p -113.33 143.51 22.88 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.234 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.908 -179.953 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 80.9 tt0 -128.05 135.32 49.7 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.64 179.957 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . 0.622 ' CZ ' ' CE1' ' A' ' 125' ' ' PHE . 52.6 p90 -167.26 158.5 11.93 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.5 179.709 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 54.64 21.56 3.51 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.857 0.361 . . . . 0.0 110.594 179.587 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 76.0 22.59 73.81 Favored Glycine 0 CA--C 1.521 0.468 0 N-CA-C 110.869 -0.893 . . . . 0.0 110.869 179.927 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -132.34 151.99 51.61 Favored 'General case' 0 C--N 1.328 -0.338 0 O-C-N 122.768 -0.254 . . . . 0.0 110.413 -179.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . 0.428 ' O ' HG13 ' A' ' 124' ' ' VAL . 7.1 p -121.34 127.77 75.8 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.555 -179.782 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 125' ' ' PHE . . . . . 0.622 ' CE1' ' CZ ' ' A' ' 120' ' ' PHE . 24.1 m-85 -113.11 120.3 40.81 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.163 179.782 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 84.4 p -81.21 136.07 35.81 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.544 179.895 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -83.82 -169.89 45.79 Favored Glycine 0 CA--C 1.524 0.629 0 N-CA-C 110.689 -0.964 . . . . 0.0 110.689 179.806 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . 0.491 ' H ' ' CB ' ' A' ' 139' ' ' SER . 12.2 tt0 -99.1 134.18 42.31 Favored 'General case' 0 N--CA 1.448 -0.525 0 CA-C-O 121.014 0.435 . . . . 0.0 110.715 179.596 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . 0.424 ' OE1' ' OG1' ' A' ' 115' ' ' THR . 70.4 mm-40 -56.06 146.05 23.9 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.385 179.109 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -169.5 159.95 8.82 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.517 -179.936 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 52.4 mtpt -88.97 33.07 0.79 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.63 179.462 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 3.6 t -158.49 150.17 21.18 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.688 179.835 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 55.8 mtmt -82.58 -21.44 35.24 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.785 179.364 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 59.5 mttp -69.59 -53.95 16.39 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.788 -179.447 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 4.1 tp -64.3 -40.24 95.54 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-O 120.789 0.328 . . . . 0.0 111.002 -179.796 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -57.29 -54.29 48.41 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.355 -179.111 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 75.8 mm-40 -56.51 -40.87 75.73 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.854 0.359 . . . . 0.0 110.512 -179.869 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 51.8 mtt -62.99 -41.39 99.55 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.967 -179.616 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . 0.491 ' CB ' ' H ' ' A' ' 128' ' ' GLU . 68.7 m -62.92 -40.74 98.51 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 121.04 -0.264 . . . . 0.0 111.19 -179.95 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -62.37 -45.82 91.44 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.102 0.477 . . . . 0.0 110.59 -179.583 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -69.83 -25.49 63.77 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.936 179.991 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . 0.513 ' O ' ' SD ' ' A' ' 146' ' ' MET . 37.5 ttpt -71.43 -49.72 38.88 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.042 0.449 . . . . 0.0 111.597 -179.992 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 143' ' ' VAL . . . . . 0.424 HG13 ' N ' ' A' ' 144' ' ' ALA . 7.6 p -67.33 -39.62 83.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.067 -179.693 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 144' ' ' ALA . . . . . 0.424 ' N ' HG13 ' A' ' 143' ' ' VAL . . . -63.28 -46.48 86.62 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-N 116.339 -0.392 . . . . 0.0 111.079 -179.098 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 145' ' ' PHE . . . . . . . . . . . . . 65.6 t80 -59.84 -42.28 93.24 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.484 -0.325 . . . . 0.0 110.573 -179.71 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 146' ' ' MET . . . . . 0.581 ' N ' ' SD ' ' A' ' 146' ' ' MET . 0.0 OUTLIER -63.07 -39.34 94.44 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.764 -179.601 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 72.8 p -67.76 -42.1 82.29 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.989 -179.858 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 148' ' ' ILE . . . . . . . . . . . . . 93.3 mt -59.05 -30.85 44.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.78 -179.675 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 54.9 mtpt -62.92 -40.66 98.3 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.802 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 150' ' ' ASN . . . . . . . . . . . . . 78.5 m-20 -62.98 -40.72 98.58 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.419 -179.848 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.776 0 CA-C-O 118.018 -1.434 . . . . 0.0 110.953 179.935 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 14.4 t . . . . . 0 N--CA 1.491 1.608 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.486 ' C ' ' N ' ' A' ' 84' ' ' LYS . . . -153.2 96.56 2.07 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-O 121.118 0.485 . . . . 0.0 109.723 -179.877 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -47.58 -16.35 0.06 Allowed 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.526 -0.761 . . . . 0.0 109.761 179.792 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.486 ' N ' ' C ' ' A' ' 82' ' ' ALA . 51.9 mtmt -63.73 -41.08 98.11 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.027 179.843 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 34.1 t30 -64.68 -47.91 76.65 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.934 -179.517 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 6.3 tt -61.92 -39.69 92.93 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.885 -179.684 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.513 HD23 HD11 ' A' ' 90' ' ' ILE . 29.9 mt -56.75 -38.71 72.8 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 -179.628 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 84.5 mt-30 -68.96 -36.2 77.64 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.682 179.214 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 80.7 mm-40 -61.74 -48.14 82.04 Favored 'General case' 0 C--O 1.232 0.154 0 C-N-CA 120.67 -0.412 . . . . 0.0 111.355 -179.066 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.513 HD11 HD23 ' A' ' 87' ' ' LEU . 27.2 pt -65.0 -35.15 74.79 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.501 179.804 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -58.83 -49.88 76.07 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.687 -179.516 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 68.4 tp60 -66.77 -47.33 72.51 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.992 -179.738 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -61.48 -47.83 83.85 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.607 -179.31 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . 0.432 ' O ' ' CB ' ' A' ' 95' ' ' SER . 80.3 mm-40 -71.68 -14.42 62.03 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.575 179.806 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . 0.432 ' CB ' ' O ' ' A' ' 94' ' ' GLU . 0.7 OUTLIER 78.94 9.11 1.85 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.383 -179.996 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 17.5 m -77.81 164.39 25.25 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.504 179.918 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 69.2 mt -69.68 129.24 39.07 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.495 -179.654 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.569 ' N ' HD12 ' A' ' 98' ' ' LEU . 10.3 mp -45.63 147.93 1.4 Allowed Pre-proline 0 CA--C 1.533 0.321 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.54 -179.491 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -69.77 140.76 43.45 Favored 'Trans proline' 0 N--CA 1.494 1.513 0 C-N-CA 122.74 2.293 . . . . 0.0 111.767 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 88.9 t80 -125.95 128.77 48.03 Favored 'General case' 0 CA--C 1.511 -0.529 0 N-CA-C 108.542 -0.91 . . . . 0.0 108.542 -179.966 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 88.5 m-85 -97.51 145.32 26.34 Favored 'General case' 0 C--N 1.324 -0.53 0 C-N-CA 120.706 -0.398 . . . . 0.0 110.321 -179.07 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -144.19 145.67 32.23 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 110.174 -0.306 . . . . 0.0 110.174 179.651 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 96.8 m -125.97 132.11 52.12 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.499 179.927 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -125.45 151.85 45.69 Favored 'General case' 0 N--CA 1.467 0.391 0 N-CA-C 109.999 -0.371 . . . . 0.0 109.999 179.798 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 22.1 p -110.4 135.38 51.19 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-O 120.834 0.349 . . . . 0.0 110.258 179.85 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 30.3 p -161.33 163.06 31.02 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.26 179.903 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 120.07 -176.09 16.08 Favored Glycine 0 CA--C 1.527 0.836 0 N-CA-C 111.328 -0.709 . . . . 0.0 111.328 179.556 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -61.75 153.44 67.63 Favored 'Trans proline' 0 N--CA 1.495 1.59 0 C-N-CA 122.655 2.236 . . . . 0.0 112.276 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 6.5 m -68.3 -16.26 63.88 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.735 -0.666 . . . . 0.0 109.97 179.156 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 55.4 t-80 -90.81 -43.63 9.94 Favored 'General case' 0 CA--C 1.518 -0.253 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.442 179.774 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -124.4 78.52 61.52 Favored Pre-proline 0 CA--C 1.533 0.303 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.413 179.271 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -81.08 129.74 7.02 Favored 'Trans proline' 0 C--N 1.313 -1.31 0 C-N-CA 122.464 2.109 . . . . 0.0 112.466 179.835 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 72.2 p -111.2 173.44 6.34 Favored 'General case' 0 CA--C 1.515 -0.388 0 CA-C-N 115.885 -0.598 . . . . 0.0 109.895 179.926 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -130.81 145.19 51.91 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.444 -179.768 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 88.4 m -125.25 120.36 31.02 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.198 -0.455 . . . . 0.0 109.821 179.493 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . 0.422 ' O ' ' HB2' ' A' ' 140' ' ' ALA . 35.9 t -95.66 122.77 38.78 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.36 -179.837 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . 0.517 HG22 ' N ' ' A' ' 118' ' ' VAL . 54.0 m -107.17 159.89 15.99 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.029 179.937 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' VAL . . . . . 0.517 ' N ' HG22 ' A' ' 117' ' ' THR . 14.7 p -141.25 137.94 33.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.187 -0.46 . . . . 0.0 109.965 179.664 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 81.2 tt0 -121.82 127.15 50.23 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.634 179.848 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . 0.403 ' CZ ' ' CE1' ' A' ' 125' ' ' PHE . 42.1 p90 -159.6 154.57 24.82 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.519 179.225 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 52.18 25.66 3.44 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.888 0.375 . . . . 0.0 110.902 179.557 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 72.75 23.68 77.46 Favored Glycine 0 CA--C 1.522 0.501 0 N-CA-C 111.002 -0.839 . . . . 0.0 111.002 179.849 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 45.7 mmtt -130.93 150.57 52.03 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 110.224 -0.288 . . . . 0.0 110.224 -179.78 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . 0.431 ' O ' HG13 ' A' ' 124' ' ' VAL . 6.2 p -120.59 125.74 74.45 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.627 -179.987 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 125' ' ' PHE . . . . . 0.403 ' CE1' ' CZ ' ' A' ' 120' ' ' PHE . 41.9 m-85 -112.05 120.6 42.4 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.262 179.774 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 43.1 t -82.29 137.11 34.91 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.515 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -84.76 -169.63 46.07 Favored Glycine 0 CA--C 1.521 0.466 0 N-CA-C 110.559 -1.017 . . . . 0.0 110.559 179.802 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -99.28 136.06 39.78 Favored 'General case' 0 CA--C 1.532 0.264 0 O-C-N 122.769 -0.254 . . . . 0.0 111.068 -179.577 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 18.4 pt-20 -54.29 142.59 25.9 Favored 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 120.403 -0.519 . . . . 0.0 110.138 179.589 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -162.94 155.74 19.1 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.602 179.835 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 51.2 tttm -90.49 31.09 1.05 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.302 179.918 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 7.4 t -159.06 149.53 19.57 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.765 179.798 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -73.7 -40.61 63.48 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.188 179.388 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -53.36 -55.17 27.07 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.949 -178.75 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 12.1 tp -64.32 -39.44 93.92 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.785 0.326 . . . . 0.0 110.845 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -57.08 -55.18 38.1 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.678 -179.305 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -59.86 -42.12 92.96 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.841 0.353 . . . . 0.0 110.46 -179.54 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 41.5 tpp -60.19 -46.32 90.13 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.371 -179.606 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 37.1 m -61.3 -37.04 81.78 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.009 -179.812 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . 0.422 ' HB2' ' O ' ' A' ' 116' ' ' SER . . . -63.97 -47.57 79.86 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.936 0.398 . . . . 0.0 110.725 179.781 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -73.2 -23.48 60.4 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.742 179.901 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -70.81 -49.58 44.82 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.227 179.968 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 143' ' ' VAL . . . . . 0.468 HG13 ' N ' ' A' ' 144' ' ' ALA . 7.1 p -68.87 -41.49 82.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.786 -179.767 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 144' ' ' ALA . . . . . 0.468 ' N ' HG13 ' A' ' 143' ' ' VAL . . . -63.72 -46.09 86.99 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.698 -179.857 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 145' ' ' PHE . . . . . . . . . . . . . 84.7 t80 -60.56 -43.41 97.3 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.809 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 146' ' ' MET . . . . . . . . . . . . . 79.8 mmm -63.02 -37.56 87.69 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.476 -179.773 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 147' ' ' SER . . . . . 0.438 ' O ' ' OD1' ' A' ' 150' ' ' ASN . 37.8 m -72.29 -43.14 64.67 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 120.784 -0.366 . . . . 0.0 111.044 179.569 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 148' ' ' ILE . . . . . . . . . . . . . 71.5 mt -55.87 -27.3 22.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 C-N-CA 120.956 -0.298 . . . . 0.0 110.78 -179.559 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 41.6 mttt -62.12 -42.23 99.03 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 120.653 -0.419 . . . . 0.0 111.242 179.662 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 150' ' ' ASN . . . . . 0.474 ' OD1' ' N ' ' A' ' 151' ' ' GLY . 47.1 p30 -65.77 -14.77 61.99 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 120.802 -0.359 . . . . 0.0 110.634 -179.383 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 151' ' ' GLY . . . . . 0.474 ' N ' ' OD1' ' A' ' 150' ' ' ASN . . . . . . . . 0 C--O 1.221 -0.711 0 CA-C-O 117.921 -1.489 . . . . 0.0 111.097 -179.63 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 6.8 t . . . . . 0 N--CA 1.489 1.519 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.49 ' C ' ' N ' ' A' ' 84' ' ' LYS . . . -153.37 96.04 2.0 Allowed 'General case' 0 N--CA 1.452 -0.35 0 CA-C-O 121.143 0.497 . . . . 0.0 110.019 -179.806 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -47.07 -15.75 0.04 OUTLIER 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.689 -0.687 . . . . 0.0 109.885 179.551 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.49 ' N ' ' C ' ' A' ' 82' ' ' ALA . 99.4 mttt -64.44 -40.51 95.87 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.08 179.759 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . 0.414 ' O ' ' OE2' ' A' ' 89' ' ' GLU . 94.5 m-20 -65.12 -47.82 75.81 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.843 -179.769 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 6.3 tt -60.68 -40.54 92.53 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.908 -179.631 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.608 HD23 HD11 ' A' ' 90' ' ' ILE . 38.2 mt -56.6 -37.68 70.98 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.269 -0.423 . . . . 0.0 109.995 -179.779 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 87.4 mt-30 -69.83 -36.97 76.03 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.429 179.526 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.521 ' OE1' ' N ' ' A' ' 89' ' ' GLU . 0.3 OUTLIER -61.63 -48.85 79.01 Favored 'General case' 0 C--O 1.233 0.22 0 C-N-CA 120.774 -0.37 . . . . 0.0 111.037 -178.932 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.608 HD11 HD23 ' A' ' 87' ' ' LEU . 19.2 pt -63.74 -40.47 89.17 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.663 -179.693 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . 0.401 ' N ' HG13 ' A' ' 90' ' ' ILE . . . -59.57 -48.88 79.93 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.657 -179.78 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 58.6 tt0 -68.71 -41.98 78.35 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.722 179.717 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 65.1 tttm -61.7 -49.5 76.2 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.693 -179.73 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . 0.419 ' O ' ' CB ' ' A' ' 95' ' ' SER . 98.1 mt-10 -66.6 -19.58 65.8 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.456 179.627 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . 0.419 ' CB ' ' O ' ' A' ' 94' ' ' GLU . 1.1 t 76.02 21.21 1.58 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.013 -179.654 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 12.8 p -79.56 -114.73 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.283 -179.874 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 54.4 tp -141.03 126.55 18.83 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.398 179.747 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.561 ' N ' HD12 ' A' ' 98' ' ' LEU . 10.4 mp -44.91 143.94 2.1 Favored Pre-proline 0 C--N 1.327 -0.375 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.704 -179.503 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -70.26 139.35 38.31 Favored 'Trans proline' 0 N--CA 1.495 1.601 0 C-N-CA 122.508 2.139 . . . . 0.0 111.899 -179.897 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 86.8 t80 -128.05 129.08 46.09 Favored 'General case' 0 CA--C 1.514 -0.422 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 -179.527 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 81.6 m-85 -96.53 146.14 25.07 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.588 -179.126 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -147.35 148.14 31.04 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.242 179.967 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 1.2 t -130.67 138.22 49.94 Favored 'General case' 0 CA--C 1.519 -0.217 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.666 179.75 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -123.02 150.77 42.62 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.289 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 30.1 p -108.79 136.5 48.26 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-O 120.863 0.363 . . . . 0.0 110.152 179.757 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 38.6 t -164.01 160.97 22.4 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.22 -179.812 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 119.43 -179.13 16.67 Favored Glycine 0 CA--C 1.522 0.521 0 N-CA-C 111.21 -0.756 . . . . 0.0 111.21 179.908 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_endo -61.07 148.57 92.44 Favored 'Trans proline' 0 C--N 1.308 -1.57 0 C-N-CA 122.828 2.352 . . . . 0.0 112.139 -179.881 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 32.7 t -63.5 -16.63 61.26 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.819 -0.628 . . . . 0.0 109.872 179.124 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 61.3 t-80 -89.22 -44.0 10.59 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.396 179.872 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -125.58 77.81 68.97 Favored Pre-proline 0 N--CA 1.465 0.286 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.38 179.124 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -81.42 128.97 6.41 Favored 'Trans proline' 0 C--N 1.306 -1.677 0 C-N-CA 122.467 2.111 . . . . 0.0 112.253 179.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 4.4 p -108.77 173.07 6.48 Favored 'General case' 0 CA--C 1.515 -0.38 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.049 179.712 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -133.62 147.42 51.48 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.493 -179.455 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 85.6 m -129.11 123.1 31.32 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.137 179.602 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 35.0 t -96.74 125.17 41.01 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.25 -179.861 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 98.2 m -121.86 133.8 54.88 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.289 -179.74 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 13.8 p -118.51 152.3 20.66 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.208 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.255 -179.622 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -131.01 139.15 49.94 Favored 'General case' 0 CA--C 1.52 -0.185 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.592 -179.803 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . 0.626 ' CZ ' ' CE1' ' A' ' 125' ' ' PHE . 54.1 p90 -166.71 159.04 13.57 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.718 179.964 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 51.72 24.28 2.35 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.873 0.368 . . . . 0.0 110.519 179.701 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 73.21 23.02 78.37 Favored Glycine 0 CA--C 1.524 0.613 0 N-CA-C 111.009 -0.836 . . . . 0.0 111.009 179.829 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -131.22 150.41 52.16 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.885 0.374 . . . . 0.0 110.322 -179.893 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . 0.541 HG22 ' N ' ' A' ' 125' ' ' PHE . 14.9 p -104.73 160.38 5.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.792 -179.461 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 125' ' ' PHE . . . . . 0.626 ' CE1' ' CZ ' ' A' ' 120' ' ' PHE . 85.8 m-85 -153.4 108.92 3.24 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.413 179.908 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 69.1 m -84.29 142.24 30.37 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.799 -179.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -85.85 -167.3 43.29 Favored Glycine 0 CA--C 1.519 0.317 0 N-CA-C 110.536 -1.026 . . . . 0.0 110.536 179.783 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . 0.416 ' H ' ' CB ' ' A' ' 139' ' ' SER . 5.3 pt-20 -99.38 134.52 42.14 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-O 120.803 0.335 . . . . 0.0 110.902 -179.676 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 97.3 mt-10 -51.2 138.63 20.12 Favored 'General case' 0 C--N 1.322 -0.599 0 C-N-CA 120.489 -0.485 . . . . 0.0 110.296 179.642 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -160.53 155.03 23.61 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.661 -179.964 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 40.9 tttp -88.19 32.33 0.77 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.987 0.422 . . . . 0.0 110.334 179.867 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 4.9 t -160.57 153.95 22.0 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.531 179.875 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -79.68 -37.35 36.01 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.019 179.854 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -56.63 -54.41 46.35 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.991 -178.948 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 4.9 tp -63.99 -39.17 93.52 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-O 120.654 0.264 . . . . 0.0 110.76 -179.807 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -59.25 -54.44 46.82 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.712 -179.502 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 99.1 mt-10 -57.15 -44.98 83.94 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.714 0.293 . . . . 0.0 110.677 -179.535 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 72.3 mtm -62.78 -41.04 99.07 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.528 -179.75 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . 0.416 ' CB ' ' H ' ' A' ' 128' ' ' GLU . 20.4 m -60.0 -39.26 85.15 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 120.999 -0.281 . . . . 0.0 110.585 -179.938 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -64.43 -42.29 96.1 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.962 0.41 . . . . 0.0 110.672 -179.842 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -69.49 -27.52 65.28 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.684 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 65.7 mttm -71.63 -49.85 36.17 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.379 179.83 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 143' ' ' VAL . . . . . 0.441 HG13 ' N ' ' A' ' 144' ' ' ALA . 7.5 p -67.56 -41.11 85.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.622 -179.763 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 144' ' ' ALA . . . . . 0.441 ' N ' HG13 ' A' ' 143' ' ' VAL . . . -64.01 -45.97 86.61 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.804 0.335 . . . . 0.0 110.473 -179.986 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 145' ' ' PHE . . . . . . . . . . . . . 70.9 t80 -60.89 -43.98 97.76 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.606 -179.737 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 146' ' ' MET . . . . . . . . . . . . . 48.8 ttp -60.96 -38.78 87.11 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.688 -179.653 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 147' ' ' SER . . . . . 0.424 ' O ' ' OD1' ' A' ' 150' ' ' ASN . 37.7 t -67.61 -42.27 82.65 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.927 0.394 . . . . 0.0 111.193 -179.996 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 148' ' ' ILE . . . . . . . . . . . . . 93.7 mt -60.85 -29.16 44.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.076 -179.386 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 53.6 mtpt -62.86 -43.2 99.45 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.139 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 150' ' ' ASN . . . . . 0.424 ' OD1' ' O ' ' A' ' 147' ' ' SER . 99.6 m-20 54.57 34.92 22.35 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.84 -0.344 . . . . 0.0 110.519 -179.932 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.734 0 CA-C-O 118.008 -1.44 . . . . 0.0 111.002 -179.921 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 13.6 p . . . . . 0 N--CA 1.489 1.494 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.491 ' C ' ' N ' ' A' ' 84' ' ' LYS . . . -153.19 95.48 1.95 Allowed 'General case' 0 N--CA 1.45 -0.44 0 CA-C-O 121.135 0.493 . . . . 0.0 110.344 -179.947 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 -46.55 -15.29 0.03 OUTLIER 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.109 179.302 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.491 ' N ' ' C ' ' A' ' 82' ' ' ALA . 99.4 mttt -64.87 -40.63 95.44 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.118 179.342 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 66.3 t30 -66.11 -48.24 71.52 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.549 -0.751 . . . . 0.0 110.803 -179.632 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 6.5 tt -60.21 -42.37 94.98 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.809 -179.33 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.475 HD23 HD11 ' A' ' 90' ' ' ILE . 38.1 mt -55.7 -35.96 66.64 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.118 -179.561 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 88.7 mt-30 -71.59 -36.12 70.75 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.401 179.328 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 81.1 mm-40 -61.11 -48.96 79.25 Favored 'General case' 0 N--CA 1.462 0.146 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.793 -179.041 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.475 HD11 HD23 ' A' ' 87' ' ' LEU . 26.8 pt -66.11 -35.87 76.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.584 179.802 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -59.43 -50.34 74.31 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.518 -179.511 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 87.8 mt-30 -70.65 -43.76 68.52 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.804 179.845 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -60.32 -50.91 71.73 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.67 -179.595 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 -69.35 -2.61 11.33 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.29 179.848 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 1.5 m 62.3 16.67 8.68 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.367 -179.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . 0.468 ' OG ' ' N ' ' A' ' 97' ' ' LEU . 66.7 p -73.08 -124.82 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.25 -179.72 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.468 ' N ' ' OG ' ' A' ' 96' ' ' SER . 89.6 mt -137.62 128.35 26.98 Favored 'General case' 0 CA--C 1.52 -0.197 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.701 -179.831 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.485 ' N ' HD12 ' A' ' 98' ' ' LEU . 11.1 mp -44.77 152.25 0.56 Allowed Pre-proline 0 N--CA 1.452 -0.332 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.714 -179.734 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -64.69 169.7 11.07 Favored 'Trans proline' 0 C--N 1.308 -1.579 0 C-N-CA 122.879 2.386 . . . . 0.0 112.194 -179.917 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 55.5 t80 -145.05 114.53 7.16 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.417 179.236 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 93.2 m-85 -99.33 133.64 43.33 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.306 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -145.5 146.51 31.49 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.405 -179.694 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 88.9 m -126.36 132.19 51.62 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.235 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -117.13 145.23 43.93 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.247 -0.433 . . . . 0.0 109.888 179.651 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 17.6 p -114.42 125.48 53.89 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-O 120.813 0.34 . . . . 0.0 110.605 179.761 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . 0.464 ' O ' ' O ' ' A' ' 113' ' ' THR . 34.6 p -164.04 160.77 22.09 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.553 179.974 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 130.4 170.57 12.73 Favored Glycine 0 CA--C 1.52 0.372 0 N-CA-C 110.814 -0.915 . . . . 0.0 110.814 179.533 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 27.2 Cg_endo -63.31 149.1 92.16 Favored 'Trans proline' 0 C--N 1.302 -1.877 0 C-N-CA 122.772 2.314 . . . . 0.0 111.905 179.471 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 50.2 m -65.16 -16.32 63.38 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.059 -0.518 . . . . 0.0 110.07 178.965 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 52.6 t-80 -88.96 -41.94 12.08 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.354 179.366 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -126.93 78.82 73.52 Favored Pre-proline 0 N--CA 1.464 0.251 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.557 178.711 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' PRO . . . . . 0.482 ' O ' HG23 ' A' ' 113' ' ' THR . 24.4 Cg_exo -62.43 158.24 41.82 Favored 'Trans proline' 0 C--N 1.301 -1.958 0 C-N-CA 122.723 2.282 . . . . 0.0 112.363 -180.0 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . 0.482 HG23 ' O ' ' A' ' 112' ' ' PRO . 23.7 p -155.83 150.97 26.6 Favored 'General case' 0 CA--C 1.517 -0.29 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.864 179.719 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -131.59 145.51 51.74 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.304 -179.955 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 99.3 m -126.11 119.72 28.3 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.561 179.338 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 59.8 p -94.23 122.0 36.32 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.351 -179.894 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . 0.479 HG22 ' N ' ' A' ' 118' ' ' VAL . 91.5 m -105.88 157.03 17.77 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.195 179.808 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' VAL . . . . . 0.479 ' N ' HG22 ' A' ' 117' ' ' THR . 9.9 p -140.45 138.13 36.36 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.459 179.566 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . 0.428 ' OE2' ' N ' ' A' ' 123' ' ' LYS . 5.2 tm-20 -124.58 130.84 53.2 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.735 179.73 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . 0.622 ' CZ ' ' CE1' ' A' ' 125' ' ' PHE . 49.8 p90 -164.84 156.76 15.62 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.52 179.225 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 53.45 21.23 2.34 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.767 0.318 . . . . 0.0 110.609 179.565 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 76.56 22.32 72.92 Favored Glycine 0 CA--C 1.523 0.534 0 N-CA-C 110.983 -0.847 . . . . 0.0 110.983 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . 0.428 ' N ' ' OE2' ' A' ' 119' ' ' GLU . 51.8 mtpt -132.67 151.81 51.86 Favored 'General case' 0 CA--C 1.517 -0.293 0 O-C-N 122.75 -0.265 . . . . 0.0 110.487 179.832 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . 0.492 ' O ' HG13 ' A' ' 124' ' ' VAL . 12.7 p -122.13 128.7 75.63 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.159 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.872 -179.669 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 125' ' ' PHE . . . . . 0.622 ' CE1' ' CZ ' ' A' ' 120' ' ' PHE . 22.2 m-85 -116.05 123.27 47.51 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.3 179.707 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 66.1 m -81.99 136.11 35.3 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.486 179.893 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -80.46 -171.37 43.51 Favored Glycine 0 CA--C 1.522 0.485 0 N-CA-C 110.665 -0.974 . . . . 0.0 110.665 179.834 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . 0.667 ' H ' ' CB ' ' A' ' 139' ' ' SER . 13.6 tt0 -94.89 130.16 41.6 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-O 120.931 0.396 . . . . 0.0 110.668 179.643 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . 0.403 ' H ' ' CD ' ' A' ' 129' ' ' GLU . 56.4 mp0 -56.22 144.18 30.83 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 116.04 -0.527 . . . . 0.0 109.978 179.087 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -172.96 166.78 5.09 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.78 -179.661 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 22.6 pttp -93.3 33.38 1.22 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.567 179.022 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . 0.436 ' HG1' ' HG2' ' A' ' 134' ' ' LYS . 0.3 OUTLIER -153.66 142.82 21.39 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.512 -179.826 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 58.1 mttp -79.27 -45.03 20.54 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.195 0.522 . . . . 0.0 110.729 179.779 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . 0.436 ' HG2' ' HG1' ' A' ' 132' ' ' THR . 16.3 pttp -53.63 -46.5 70.52 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.932 -179.4 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 4.4 tp -66.33 -41.84 89.02 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.677 179.871 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -60.21 -53.07 62.04 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 -179.451 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 96.1 mt-10 -54.19 -40.67 67.78 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 -179.727 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 50.1 mtt -61.34 -42.47 98.74 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.217 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . 0.667 ' CB ' ' H ' ' A' ' 128' ' ' GLU . 90.9 p -60.09 -38.75 83.86 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.658 -179.316 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -65.54 -44.24 87.47 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.999 0.428 . . . . 0.0 110.818 -179.619 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -69.31 -30.16 68.16 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.719 -179.462 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 57.5 mttp -71.94 -51.15 23.47 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.905 0.383 . . . . 0.0 111.56 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 143' ' ' VAL . . . . . 0.54 HG13 ' N ' ' A' ' 144' ' ' ALA . 11.3 p -66.15 -43.32 92.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.555 -179.207 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 144' ' ' ALA . . . . . 0.54 ' N ' HG13 ' A' ' 143' ' ' VAL . . . -61.67 -46.15 90.96 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.625 -179.584 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 145' ' ' PHE . . . . . . . . . . . . . 64.6 t80 -60.67 -42.27 96.72 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.528 -179.598 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 146' ' ' MET . . . . . . . . . . . . . 59.6 mtt -62.8 -39.16 93.4 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.816 -179.638 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 78.1 p -69.21 -42.1 76.2 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.847 0.356 . . . . 0.0 110.904 -179.709 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 148' ' ' ILE . . . . . . . . . . . . . 87.2 mt -59.05 -29.23 40.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.769 -179.646 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 55.2 mtpt -63.73 -42.15 97.95 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.669 179.688 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 150' ' ' ASN . . . . . . . . . . . . . 7.4 m120 -63.95 -40.45 96.46 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.508 -179.901 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.776 0 CA-C-O 118.034 -1.426 . . . . 0.0 110.939 -179.988 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 17.0 m . . . . . 0 N--CA 1.492 1.629 0 N-CA-C 109.341 -0.614 . . . . 0.0 109.341 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.479 ' C ' ' N ' ' A' ' 84' ' ' LYS . . . -153.96 96.59 1.98 Allowed 'General case' 0 N--CA 1.448 -0.543 0 CA-C-O 121.209 0.528 . . . . 0.0 109.679 -179.965 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 2.8 m-85 -48.02 -16.58 0.09 Allowed 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.542 -0.754 . . . . 0.0 109.716 179.857 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.479 ' N ' ' C ' ' A' ' 82' ' ' ALA . 60.5 mttp -64.3 -42.73 96.23 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.479 -0.782 . . . . 0.0 109.932 179.916 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 13.5 m120 -63.57 -45.66 89.43 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.9 -179.376 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 6.0 tt -61.21 -41.57 97.08 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.777 -179.388 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.478 HD23 HD11 ' A' ' 90' ' ' ILE . 56.3 mt -57.92 -38.11 75.28 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.111 -0.495 . . . . 0.0 109.77 179.962 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 87.4 mt-30 -70.22 -35.3 73.79 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.355 179.102 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 96.2 mt-10 -63.41 -48.58 77.22 Favored 'General case' 0 N--CA 1.462 0.161 0 C-N-CA 120.668 -0.413 . . . . 0.0 111.426 -179.022 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.478 HD11 HD23 ' A' ' 87' ' ' LEU . 15.3 pt -62.82 -44.31 99.44 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 116.449 -0.342 . . . . 0.0 110.765 -179.542 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . 0.482 ' O ' ' N ' ' A' ' 95' ' ' SER . . . -68.81 -45.48 71.12 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.015 -179.622 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -63.27 -47.7 81.25 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.62 -179.417 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -63.34 -42.52 98.95 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.766 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -92.81 7.56 43.23 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.449 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . 0.482 ' N ' ' O ' ' A' ' 91' ' ' ALA . 14.2 m 39.49 47.15 1.54 Allowed 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 120.91 0.386 . . . . 0.0 110.641 -179.936 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 60.2 p -100.48 44.7 1.0 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.435 -179.273 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.563 HD12 ' N ' ' A' ' 97' ' ' LEU . 9.9 mp 64.66 93.17 0.06 Allowed 'General case' 0 N--CA 1.461 0.092 0 CA-C-O 121.042 0.449 . . . . 0.0 110.705 -179.445 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.569 ' N ' HD12 ' A' ' 98' ' ' LEU . 10.3 mp -45.59 146.69 1.7 Allowed Pre-proline 0 CA--C 1.532 0.278 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.324 -179.712 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -70.28 145.42 54.09 Favored 'Trans proline' 0 N--CA 1.493 1.452 0 C-N-CA 122.496 2.131 . . . . 0.0 111.863 -179.8 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 84.4 t80 -127.76 131.59 49.63 Favored 'General case' 0 CA--C 1.514 -0.436 0 N-CA-C 108.771 -0.825 . . . . 0.0 108.771 179.972 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 95.7 m-85 -97.52 143.18 28.48 Favored 'General case' 0 C--N 1.324 -0.521 0 C-N-CA 120.741 -0.384 . . . . 0.0 110.474 -179.191 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -143.85 145.28 32.21 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.075 179.681 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 98.6 m -122.57 127.21 49.15 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.514 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -123.24 150.91 42.86 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 110.007 -0.368 . . . . 0.0 110.007 179.785 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 35.1 p -106.85 137.42 44.92 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-O 120.761 0.315 . . . . 0.0 110.23 179.97 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 31.2 m -161.75 163.35 29.65 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.253 179.965 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 118.04 -178.34 16.84 Favored Glycine 0 CA--C 1.527 0.82 0 N-CA-C 111.281 -0.728 . . . . 0.0 111.281 179.535 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . 0.637 ' HG2' ' HB3' ' A' ' 111' ' ' ALA . 19.7 Cg_endo -61.4 154.42 59.01 Favored 'Trans proline' 0 N--CA 1.497 1.715 0 C-N-CA 122.702 2.268 . . . . 0.0 112.337 179.964 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 28.3 m -67.68 -18.16 64.83 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.627 -0.715 . . . . 0.0 109.978 179.29 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 94.9 m-70 -91.95 -36.54 13.38 Favored 'General case' 0 CA--C 1.52 -0.179 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.164 179.735 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . 0.637 ' HB3' ' HG2' ' A' ' 108' ' ' PRO . . . -124.21 79.77 59.31 Favored Pre-proline 0 CA--C 1.538 0.519 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.077 179.232 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -81.45 121.39 3.81 Favored 'Trans proline' 0 N--CA 1.489 1.24 0 C-N-CA 122.481 2.121 . . . . 0.0 112.194 -179.917 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 4.9 p -109.26 172.8 6.64 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.004 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 -132.2 146.76 52.24 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.167 -179.765 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 88.5 m -131.52 126.95 36.22 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.152 -0.476 . . . . 0.0 109.86 179.138 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 68.2 m -94.4 121.23 35.71 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.367 -179.834 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . 0.421 ' CG2' ' CG2' ' A' ' 124' ' ' VAL . 98.6 m -108.95 125.33 51.92 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.385 -179.869 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 11.0 p -110.55 139.66 33.12 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.3 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.004 -179.945 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 84.1 tt0 -123.25 130.35 52.63 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.619 179.925 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . 0.584 ' CZ ' ' CE1' ' A' ' 125' ' ' PHE . 47.7 p90 -163.72 157.45 19.13 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.533 179.214 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 52.59 21.85 1.98 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.788 0.328 . . . . 0.0 110.86 179.503 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 75.7 21.89 76.0 Favored Glycine 0 CA--C 1.523 0.568 0 N-CA-C 111.185 -0.766 . . . . 0.0 111.185 179.836 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 61.0 mttp -131.66 151.2 51.81 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 120.723 0.297 . . . . 0.0 110.303 179.898 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . 0.457 ' O ' HG13 ' A' ' 124' ' ' VAL . 13.6 p -123.03 129.77 74.86 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.27 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.763 -179.572 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 125' ' ' PHE . . . . . 0.584 ' CE1' ' CZ ' ' A' ' 120' ' ' PHE . 18.5 m-85 -117.56 123.34 46.01 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.167 179.979 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 12.3 p -83.66 141.55 31.42 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.594 -179.976 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -86.18 -169.62 46.12 Favored Glycine 0 CA--C 1.523 0.584 0 N-CA-C 110.704 -0.959 . . . . 0.0 110.704 179.847 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . 0.626 ' H ' ' CB ' ' A' ' 139' ' ' SER . 5.8 pt-20 -93.86 128.89 40.38 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-O 120.765 0.317 . . . . 0.0 111.056 -179.564 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -55.15 144.14 25.11 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 120.45 -0.5 . . . . 0.0 110.172 179.703 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -170.63 163.67 8.18 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.931 179.837 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 31.0 mtmm -89.71 32.84 0.86 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.366 179.226 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 4.0 t -156.43 149.5 24.16 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.601 179.493 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 58.8 mttp -80.57 -31.8 36.76 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.921 179.708 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . 0.496 ' O ' ' SD ' ' A' ' 138' ' ' MET . 25.9 mtpp -59.19 -51.18 71.09 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.038 -178.901 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 11.6 tp -64.76 -39.3 93.4 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-O 120.838 0.351 . . . . 0.0 110.936 -179.654 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -59.36 -54.81 42.48 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.8 -179.351 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 80.6 mm-40 -58.15 -43.61 87.46 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 120.847 -0.341 . . . . 0.0 110.436 -179.382 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 138' ' ' MET . . . . . 0.571 ' N ' ' SD ' ' A' ' 138' ' ' MET . 0.0 OUTLIER -62.02 -41.98 98.67 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.458 -179.979 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . 0.626 ' CB ' ' H ' ' A' ' 128' ' ' GLU . 77.4 p -65.06 -36.16 83.48 Favored 'General case' 0 C--N 1.329 -0.317 0 C-N-CA 120.922 -0.311 . . . . 0.0 111.022 -179.934 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -65.83 -47.32 75.38 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.047 0.451 . . . . 0.0 110.645 179.94 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -71.7 -24.41 61.81 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.738 -179.907 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -70.62 -49.35 48.53 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.246 179.812 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 143' ' ' VAL . . . . . 0.405 HG13 ' N ' ' A' ' 144' ' ' ALA . 7.1 p -68.37 -38.9 80.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.88 -179.545 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 144' ' ' ALA . . . . . 0.405 ' N ' HG13 ' A' ' 143' ' ' VAL . . . -64.08 -44.95 90.8 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.82 0.343 . . . . 0.0 110.95 -179.612 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 145' ' ' PHE . . . . . . . . . . . . . 64.7 t80 -57.11 -44.21 83.03 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.472 -179.713 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 146' ' ' MET . . . . . . . . . . . . . 63.3 mtt -63.79 -38.98 93.13 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.88 179.907 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 78.0 p -67.91 -44.98 75.68 Favored 'General case' 0 C--N 1.332 -0.189 0 C-N-CA 120.702 -0.399 . . . . 0.0 110.936 -179.752 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 148' ' ' ILE . . . . . . . . . . . . . 82.2 mt -52.1 -39.14 25.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.085 -179.521 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 32.6 mttm -62.59 -42.17 99.4 Favored 'General case' 0 C--N 1.326 -0.444 0 C-N-CA 120.593 -0.443 . . . . 0.0 110.932 179.424 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 150' ' ' ASN . . . . . . . . . . . . . 41.8 t30 -62.96 -40.64 98.31 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.383 -0.372 . . . . 0.0 110.555 -179.881 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.768 0 CA-C-O 118.003 -1.443 . . . . 0.0 111.0 179.929 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 34.0 m . . . . . 0 N--CA 1.489 1.523 0 N-CA-C 109.241 -0.651 . . . . 0.0 109.241 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.477 ' C ' ' N ' ' A' ' 84' ' ' LYS . . . -153.8 96.63 2.01 Favored 'General case' 0 N--CA 1.447 -0.576 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 179.925 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 3.9 m-85 -48.56 -15.77 0.09 Allowed 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.515 -0.766 . . . . 0.0 109.575 179.709 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.477 ' N ' ' C ' ' A' ' 82' ' ' ALA . 99.6 mttt -63.02 -39.47 94.84 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.758 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 93.0 m-20 -63.1 -44.84 94.54 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.739 -179.912 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 7.2 tt -71.92 -33.72 68.49 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.667 -179.515 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 17.7 mt -59.63 -41.71 91.07 Favored 'General case' 0 CA--C 1.52 -0.206 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.424 -178.839 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 17.0 pt20 -73.04 -29.43 62.98 Favored 'General case' 0 C--N 1.316 -0.866 0 C-N-CA 120.424 -0.51 . . . . 0.0 110.509 179.191 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 92.2 mt-10 -65.71 -42.87 90.63 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 120.693 -0.403 . . . . 0.0 111.251 -179.809 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 29.2 pt -72.13 -35.26 52.67 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.882 179.698 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -55.68 -49.53 72.7 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.937 -179.215 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 13.5 pt20 -67.96 -38.05 82.29 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.526 179.557 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 64.1 tttp -62.66 -47.72 82.46 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.384 -179.894 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 72.2 mm-40 -76.39 -2.83 33.77 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.494 -179.755 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 74.64 4.62 4.41 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.08 -0.509 . . . . 0.0 109.916 -179.724 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 18.9 m -74.17 162.71 28.68 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.287 179.89 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.559 ' N ' HD12 ' A' ' 97' ' ' LEU . 10.5 mp -73.16 132.57 43.4 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.952 0.406 . . . . 0.0 110.052 -179.73 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.546 ' N ' HD12 ' A' ' 98' ' ' LEU . 10.6 mp -45.63 149.21 1.12 Allowed Pre-proline 0 CA--C 1.534 0.336 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.68 -179.618 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -72.55 143.52 38.44 Favored 'Trans proline' 0 N--CA 1.49 1.315 0 C-N-CA 122.681 2.254 . . . . 0.0 111.59 179.881 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 87.7 t80 -127.57 130.47 49.13 Favored 'General case' 0 CA--C 1.511 -0.545 0 N-CA-C 108.542 -0.911 . . . . 0.0 108.542 179.956 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 76.3 m-85 -100.15 147.32 25.82 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 110.012 -0.366 . . . . 0.0 110.012 -179.092 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -146.17 146.89 31.0 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.379 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 99.8 m -121.57 128.14 51.68 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.368 179.732 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -116.27 144.13 44.62 Favored 'General case' 0 N--CA 1.467 0.389 0 N-CA-C 109.93 -0.396 . . . . 0.0 109.93 179.737 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 30.2 p -106.75 134.85 49.27 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 109.97 -0.382 . . . . 0.0 109.97 179.775 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 41.0 t -164.42 162.12 21.88 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.148 179.926 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 122.7 -177.87 16.45 Favored Glycine 0 CA--C 1.528 0.876 0 N-CA-C 111.268 -0.733 . . . . 0.0 111.268 179.459 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . 0.598 ' HG2' ' HB3' ' A' ' 111' ' ' ALA . 23.4 Cg_endo -61.3 150.33 85.29 Favored 'Trans proline' 0 N--CA 1.497 1.718 0 C-N-CA 122.789 2.326 . . . . 0.0 112.317 179.902 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 36.9 t -63.99 -18.24 64.1 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.702 -0.681 . . . . 0.0 109.794 179.076 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 73.9 m80 -91.27 -38.19 12.82 Favored 'General case' 0 CA--C 1.518 -0.263 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.285 179.804 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . 0.598 ' HB3' ' HG2' ' A' ' 108' ' ' PRO . . . -123.96 79.61 57.73 Favored Pre-proline 0 CA--C 1.538 0.508 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.185 179.463 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -80.8 122.07 4.28 Favored 'Trans proline' 0 N--CA 1.491 1.338 0 C-N-CA 122.619 2.213 . . . . 0.0 112.15 179.68 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 3.5 p -109.12 171.26 7.54 Favored 'General case' 0 CA--C 1.517 -0.307 0 CA-C-N 115.646 -0.706 . . . . 0.0 109.978 -179.961 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -133.89 148.56 51.25 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.182 -179.702 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 94.8 m -129.73 126.61 38.64 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.104 179.398 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 11.2 t -96.39 121.47 38.23 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.276 179.829 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . 0.439 ' CG2' ' CG2' ' A' ' 124' ' ' VAL . 70.8 m -112.86 130.35 56.13 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.017 -179.913 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 7.7 p -113.73 141.8 28.48 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.357 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.03 -179.748 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 79.0 tt0 -125.14 131.86 53.18 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.49 -179.764 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . 0.625 ' CZ ' ' CE1' ' A' ' 125' ' ' PHE . 48.4 p90 -166.63 159.51 14.18 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.435 179.372 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 53.32 19.05 1.44 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.8 0.333 . . . . 0.0 110.904 179.711 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 78.24 20.0 73.32 Favored Glycine 0 CA--C 1.525 0.687 0 N-CA-C 111.323 -0.711 . . . . 0.0 111.323 179.617 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -132.13 152.91 50.99 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.806 0.336 . . . . 0.0 110.408 179.872 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . 0.482 ' O ' HG13 ' A' ' 124' ' ' VAL . 14.9 p -121.38 127.88 75.8 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.288 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.713 -179.904 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 125' ' ' PHE . . . . . 0.625 ' CE1' ' CZ ' ' A' ' 120' ' ' PHE . 36.8 m-85 -111.38 120.55 42.58 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.346 179.911 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 5.7 m -78.8 129.24 34.39 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.283 179.707 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -84.05 -173.25 49.66 Favored Glycine 0 CA--C 1.521 0.444 0 N-CA-C 111.139 -0.785 . . . . 0.0 111.139 -179.938 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . 0.446 ' CG ' ' N ' ' A' ' 129' ' ' GLU . 69.1 tt0 -77.75 165.89 23.64 Favored 'General case' 0 N--CA 1.442 -0.842 0 CA-C-O 120.671 0.272 . . . . 0.0 110.443 179.894 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . 0.446 ' N ' ' CG ' ' A' ' 128' ' ' GLU . 18.7 pt-20 -105.94 140.7 38.55 Favored 'General case' 0 C--N 1.332 -0.168 0 N-CA-C 109.879 -0.415 . . . . 0.0 109.879 179.106 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -171.57 166.48 6.75 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.86 179.596 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -86.12 35.36 0.64 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.041 179.065 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 4.3 t -152.47 144.77 23.97 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.844 179.772 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -82.54 -21.95 35.17 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.965 179.44 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 56.3 mtpt -68.79 -54.49 15.56 Favored 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 120.632 -0.427 . . . . 0.0 111.208 -179.278 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 3.6 tp -64.02 -38.9 92.77 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.959 -179.504 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -58.91 -54.64 44.83 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.67 -179.527 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 81.0 mm-40 -60.07 -43.03 95.75 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.866 0.365 . . . . 0.0 110.766 -179.777 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 60.3 mtt -61.77 -41.88 98.27 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.319 -179.509 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 37.8 m -65.07 -36.61 84.87 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.014 179.775 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -63.32 -46.37 86.95 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 121.046 0.45 . . . . 0.0 110.524 -179.962 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -70.21 -24.25 63.08 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.686 179.849 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 38.7 ttmt -70.76 -49.94 41.36 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.29 -0.413 . . . . 0.0 111.276 179.711 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 143' ' ' VAL . . . . . 0.407 HG13 ' N ' ' A' ' 144' ' ' ALA . 7.1 p -67.98 -40.9 84.07 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.151 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.019 -179.501 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 144' ' ' ALA . . . . . 0.407 ' N ' HG13 ' A' ' 143' ' ' VAL . . . -62.29 -45.79 91.67 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.935 0.398 . . . . 0.0 110.526 -179.997 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 145' ' ' PHE . . . . . . . . . . . . . 69.8 t80 -59.19 -44.33 92.21 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.564 -179.656 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 146' ' ' MET . . . . . . . . . . . . . 64.1 ttp -61.68 -39.1 90.22 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.965 -179.711 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 11.7 t -67.34 -44.33 79.34 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 120.743 -0.383 . . . . 0.0 110.873 179.844 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 148' ' ' ILE . . . . . . . . . . . . . 94.2 mt -57.72 -29.57 35.23 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.204 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.994 -179.642 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 25.8 mtpp -64.54 -8.57 14.45 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.51 179.87 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 150' ' ' ASN . . . . . 0.477 ' OD1' ' N ' ' A' ' 151' ' ' GLY . 35.9 p-10 -63.36 -39.67 95.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.499 -179.962 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 151' ' ' GLY . . . . . 0.477 ' N ' ' OD1' ' A' ' 150' ' ' ASN . . . . . . . . 0 C--O 1.22 -0.723 0 CA-C-O 117.972 -1.46 . . . . 0.0 110.935 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 6.5 t . . . . . 0 N--CA 1.49 1.574 0 N-CA-C 109.406 -0.591 . . . . 0.0 109.406 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.485 ' O ' ' N ' ' A' ' 84' ' ' LYS . . . -152.71 95.73 2.03 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.528 179.96 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 2.1 m-85 -46.05 -15.89 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.27 179.709 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.485 ' N ' ' O ' ' A' ' 82' ' ' ALA . 99.4 mttt -64.79 -40.75 95.76 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.447 179.266 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 38.8 t30 -64.92 -44.69 88.71 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.63 -179.91 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 5.3 tt -60.03 -43.36 95.34 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.588 -179.304 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.432 HD23 HD11 ' A' ' 90' ' ' ILE . 74.0 mt -56.25 -37.74 70.19 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.402 179.976 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 88.4 mt-30 -70.8 -35.26 72.46 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.578 179.651 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 79.9 mm-40 -62.27 -48.43 79.93 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.807 -179.169 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.435 HG13 ' N ' ' A' ' 91' ' ' ALA . 19.9 pt -65.13 -41.34 91.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.655 -179.52 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . 0.519 ' O ' ' N ' ' A' ' 95' ' ' SER . . . -68.85 -49.9 54.45 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.852 -179.464 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 84.4 mt-30 -65.01 -45.68 84.5 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.865 -179.604 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 88.9 tttt -60.02 -47.35 86.19 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.562 -179.77 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . 0.408 ' O ' ' C ' ' A' ' 95' ' ' SER . 96.4 mt-10 -96.03 10.15 38.43 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.544 -179.928 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . 0.519 ' N ' ' O ' ' A' ' 91' ' ' ALA . 13.9 t 39.24 40.84 0.56 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.47 -179.754 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . 0.44 ' O ' ' CB ' ' A' ' 97' ' ' LEU . 44.7 m -87.47 33.26 0.69 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.653 -179.436 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.44 ' CB ' ' O ' ' A' ' 96' ' ' SER . 2.6 tp 76.93 100.58 0.07 Allowed 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.866 179.907 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.509 ' N ' HD12 ' A' ' 98' ' ' LEU . 11.0 mp -44.21 152.02 0.51 Allowed Pre-proline 0 C--N 1.325 -0.474 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.431 179.817 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_endo -65.86 171.16 10.28 Favored 'Trans proline' 0 C--N 1.304 -1.77 0 C-N-CA 122.951 2.434 . . . . 0.0 111.998 179.611 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 31.8 t80 -144.62 117.2 8.62 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.7 179.6 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 93.4 m-85 -96.95 129.03 44.47 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.505 -179.929 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -147.68 148.16 30.74 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.478 -179.781 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 1.5 t -135.26 145.21 47.36 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.63 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -129.39 153.93 47.42 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.521 -179.925 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 16.2 p -110.28 138.43 46.67 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.576 179.631 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 40.3 t -163.5 153.62 15.48 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.664 179.804 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 125.65 -175.94 17.41 Favored Glycine 0 CA--C 1.524 0.612 0 N-CA-C 111.039 -0.824 . . . . 0.0 111.039 179.643 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 25.9 Cg_endo -62.45 150.46 87.32 Favored 'Trans proline' 0 C--N 1.303 -1.824 0 C-N-CA 122.785 2.323 . . . . 0.0 112.278 -179.883 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 37.1 t -65.05 -16.09 63.07 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.36 179.038 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 49.6 t-80 -90.51 -43.43 10.24 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.472 179.646 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -126.21 77.2 72.12 Favored Pre-proline 0 CA--C 1.53 0.178 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.21 179.213 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -80.62 126.52 6.02 Favored 'Trans proline' 0 C--N 1.303 -1.847 0 C-N-CA 122.611 2.208 . . . . 0.0 112.261 -179.588 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 5.6 p -103.97 170.89 7.65 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.362 179.609 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -133.46 146.71 51.4 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.589 -179.665 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 86.9 m -127.82 122.42 32.63 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.434 179.733 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 25.4 m -96.06 122.55 39.0 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.013 0.435 . . . . 0.0 110.556 -179.758 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 57.5 m -112.29 128.13 56.18 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.514 -179.894 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 8.6 p -110.42 140.82 27.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.506 179.928 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -127.27 136.78 52.45 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.566 179.99 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . 0.619 ' CZ ' ' CE1' ' A' ' 125' ' ' PHE . 50.7 p90 -170.15 160.2 7.86 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.385 179.85 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 51.56 21.38 1.27 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.511 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 77.08 21.22 74.25 Favored Glycine 0 CA--C 1.522 0.503 0 N-CA-C 111.098 -0.801 . . . . 0.0 111.098 179.732 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -131.99 151.59 51.64 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.786 0.327 . . . . 0.0 110.614 179.909 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . 0.447 ' O ' HG13 ' A' ' 124' ' ' VAL . 8.5 p -121.38 127.84 75.79 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-O 120.965 0.412 . . . . 0.0 110.842 -179.65 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 125' ' ' PHE . . . . . 0.619 ' CE1' ' CZ ' ' A' ' 120' ' ' PHE . 26.4 m-85 -112.63 120.48 41.69 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.367 179.56 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 43.5 t -80.09 132.16 35.9 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.707 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -80.26 -172.42 44.68 Favored Glycine 0 CA--C 1.525 0.688 0 N-CA-C 110.77 -0.932 . . . . 0.0 110.77 179.808 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . 0.42 ' O ' ' CG ' ' A' ' 128' ' ' GLU . 8.9 pt-20 -96.46 131.69 42.78 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.612 0.244 . . . . 0.0 110.475 -179.833 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -54.06 142.09 26.38 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.373 179.541 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -165.43 157.9 15.46 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.559 179.993 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 51.0 tttm -86.65 33.56 0.64 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.597 179.704 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 4.8 t -159.64 152.19 21.3 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.509 -179.712 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -81.84 -33.56 30.6 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.001 0.429 . . . . 0.0 110.978 179.896 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -58.28 -54.25 49.16 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.892 -178.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 4.0 tp -65.08 -38.75 91.78 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.66 179.938 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -57.7 -55.03 40.2 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.833 -179.358 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -60.84 -41.59 96.09 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.434 -179.752 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 78.9 mmm -62.61 -41.39 98.95 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.552 -179.472 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 20.2 m -64.4 -38.46 91.1 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.632 -179.946 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -64.73 -43.77 92.33 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.595 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -72.21 -24.99 61.48 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.456 179.671 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 63.0 tttp -70.31 -47.16 62.41 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.046 -179.935 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 7.7 p -70.55 -37.34 69.58 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.83 -179.542 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -64.06 -46.3 84.96 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.662 -179.857 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 145' ' ' PHE . . . . . . . . . . . . . 66.0 t80 -58.33 -43.44 88.25 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.553 -179.734 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 146' ' ' MET . . . . . . . . . . . . . 59.2 ttp -61.06 -37.41 82.54 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.577 -179.536 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 35.8 t -70.55 -45.59 65.17 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.955 -179.86 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 148' ' ' ILE . . . . . . . . . . . . . 93.9 mt -55.01 -31.52 25.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.617 -179.459 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 10.2 mtpm? -61.62 -41.6 97.7 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.671 179.752 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 150' ' ' ASN . . . . . . . . . . . . . 33.8 t30 41.12 -103.75 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.722 -179.98 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.219 -0.795 0 CA-C-O 118.0 -1.445 . . . . 0.0 110.923 -179.957 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 15.0 t . . . . . 0 N--CA 1.49 1.535 0 N-CA-C 109.365 -0.606 . . . . 0.0 109.365 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.486 ' O ' ' N ' ' A' ' 84' ' ' LYS . . . -153.37 95.79 1.97 Allowed 'General case' 0 N--CA 1.451 -0.404 0 CA-C-O 121.06 0.457 . . . . 0.0 110.318 -179.975 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 2.1 m-85 -46.13 -15.87 0.03 OUTLIER 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.172 179.728 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.486 ' N ' ' O ' ' A' ' 82' ' ' ALA . 65.0 mttp -63.67 -40.26 96.39 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.169 179.509 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 63.6 t30 -65.95 -48.78 70.19 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.777 -179.467 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 6.4 tt -60.8 -40.98 94.68 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.791 -179.5 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.496 HD23 HD11 ' A' ' 90' ' ' ILE . 34.3 mt -56.11 -36.8 68.6 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.295 -179.591 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 89.4 mt-30 -69.81 -35.69 75.04 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.57 179.432 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 14.6 mm-40 -61.71 -49.7 75.41 Favored 'General case' 0 C--N 1.333 -0.11 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.107 -178.836 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.496 HD11 HD23 ' A' ' 87' ' ' LEU . 28.6 pt -65.02 -34.46 70.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.633 179.916 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -54.61 -50.44 68.05 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.529 -179.335 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 78.7 mt-30 -65.32 -42.32 93.09 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.851 -179.944 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 69.2 mmtt -61.35 -47.42 85.97 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.549 -179.512 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 80.9 mm-40 -68.15 -20.16 64.86 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.419 179.943 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 1.2 t 72.76 19.67 3.88 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.596 -179.825 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 75.3 m -80.43 -117.4 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.242 -179.898 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 40.9 tp -143.27 125.27 15.26 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.652 179.691 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.607 ' N ' HD12 ' A' ' 98' ' ' LEU . 9.9 mp -44.36 142.65 2.24 Favored Pre-proline 0 N--CA 1.452 -0.359 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.871 -179.812 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_endo -69.63 145.42 57.84 Favored 'Trans proline' 0 C--N 1.311 -1.442 0 C-N-CA 122.524 2.149 . . . . 0.0 112.008 -179.781 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 92.6 t80 -127.2 128.73 46.57 Favored 'General case' 0 C--O 1.235 0.321 0 N-CA-C 109.544 -0.539 . . . . 0.0 109.544 179.643 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 85.6 m-85 -96.23 144.48 26.39 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.939 -179.596 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -143.74 145.4 32.37 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.439 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 98.0 m -122.83 127.67 49.37 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.466 -179.913 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -105.5 135.22 47.28 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.174 179.78 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 18.8 p -114.42 119.29 36.38 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-O 120.876 0.369 . . . . 0.0 110.414 179.592 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 11.4 p -160.66 163.96 32.11 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.403 179.934 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 122.24 168.78 13.34 Favored Glycine 0 CA--C 1.523 0.536 0 N-CA-C 110.888 -0.885 . . . . 0.0 110.888 179.659 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 24.9 Cg_endo -62.43 151.02 85.26 Favored 'Trans proline' 0 C--N 1.301 -1.928 0 C-N-CA 122.78 2.32 . . . . 0.0 112.143 179.63 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 77.7 p -63.99 -17.58 63.44 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.327 179.002 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 66.0 m80 -90.42 -43.14 10.49 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.501 179.628 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -125.04 78.02 66.58 Favored Pre-proline 0 N--CA 1.464 0.243 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.357 179.637 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' PRO . . . . . 0.493 ' O ' HG23 ' A' ' 113' ' ' THR . 56.8 Cg_endo -76.28 164.44 31.01 Favored 'Trans proline' 0 C--N 1.303 -1.866 0 C-N-CA 122.711 2.274 . . . . 0.0 112.279 -179.995 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . 0.493 HG23 ' O ' ' A' ' 112' ' ' PRO . 33.8 p -156.83 152.01 26.33 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.641 179.555 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -131.68 144.14 50.79 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.335 -179.628 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 93.0 m -130.33 125.73 35.42 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.46 179.438 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 46.1 t -97.19 122.91 40.74 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.612 -179.827 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . 0.408 ' CG2' ' CG2' ' A' ' 124' ' ' VAL . 54.3 m -114.81 131.45 56.81 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.357 -179.834 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 9.9 p -111.75 141.83 26.01 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.285 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.267 -179.949 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 79.3 tt0 -125.79 133.77 51.92 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.623 -179.672 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . 0.627 ' CZ ' ' CE1' ' A' ' 125' ' ' PHE . 45.9 p90 -166.53 157.56 12.68 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.368 179.466 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 52.61 24.86 3.33 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.518 179.719 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 72.64 22.82 78.78 Favored Glycine 0 CA--C 1.521 0.466 0 N-CA-C 111.083 -0.807 . . . . 0.0 111.083 179.913 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 62.9 mttp -131.66 151.66 51.45 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.807 0.337 . . . . 0.0 110.331 179.826 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . 0.464 ' O ' HG13 ' A' ' 124' ' ' VAL . 12.2 p -122.21 128.47 75.53 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.227 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.768 -179.7 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 125' ' ' PHE . . . . . 0.627 ' CE1' ' CZ ' ' A' ' 120' ' ' PHE . 27.0 m-85 -112.93 123.35 50.12 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.434 179.919 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 4.2 p -79.37 126.76 31.23 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.195 179.843 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -82.65 -172.53 48.32 Favored Glycine 0 CA--C 1.525 0.676 0 N-CA-C 110.97 -0.852 . . . . 0.0 110.97 -179.664 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . 0.459 ' CG ' ' N ' ' A' ' 129' ' ' GLU . 67.5 tt0 -78.7 167.09 21.73 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-O 120.759 0.314 . . . . 0.0 110.491 179.972 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . 0.459 ' N ' ' CG ' ' A' ' 128' ' ' GLU . 3.0 pp20? -109.61 145.31 36.64 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.979 0.419 . . . . 0.0 110.343 178.952 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -174.19 170.41 3.72 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.617 179.663 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -86.28 36.13 0.68 Allowed 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.238 178.849 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 5.1 t -156.41 148.66 23.33 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.893 0.378 . . . . 0.0 110.538 -179.637 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -82.54 -33.14 28.28 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.103 179.591 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 69.5 mmtt -58.82 -52.66 64.76 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.01 -178.213 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 10.3 tp -63.78 -39.76 95.03 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.466 -0.333 . . . . 0.0 110.973 -179.531 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -60.31 -54.78 41.57 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.53 -179.142 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -59.19 -44.43 92.19 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.708 -179.456 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 38.3 ttm -60.63 -41.8 95.64 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.478 -179.775 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . 0.413 ' CB ' ' H ' ' A' ' 128' ' ' GLU . 38.1 m -65.04 -35.17 80.3 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.754 179.763 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -62.7 -45.57 92.14 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.759 -179.733 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -72.41 -23.12 61.04 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.667 -179.771 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -71.6 -50.15 33.64 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.327 179.876 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 143' ' ' VAL . . . . . 0.443 HG13 ' N ' ' A' ' 144' ' ' ALA . 6.9 p -66.67 -41.01 87.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.696 -179.508 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 144' ' ' ALA . . . . . 0.443 ' N ' HG13 ' A' ' 143' ' ' VAL . . . -61.43 -43.56 98.65 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.479 -179.936 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 145' ' ' PHE . . . . . . . . . . . . . 65.4 t80 -60.2 -41.87 93.91 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.4 -179.832 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 146' ' ' MET . . . . . . . . . . . . . 89.9 mmm -63.85 -39.92 95.36 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.018 -179.349 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 9.1 t -67.48 -44.94 77.32 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.077 179.916 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 148' ' ' ILE . . . . . . . . . . . . . 78.7 mt -54.08 -33.5 24.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.582 -179.26 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 55.5 mtpt -60.97 -42.05 97.58 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.532 -179.908 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 150' ' ' ASN . . . . . . . . . . . . . 58.7 t-20 -86.61 108.95 18.84 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.443 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.777 0 CA-C-O 117.979 -1.456 . . . . 0.0 110.985 179.967 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 4.4 m . . . . . 0 N--CA 1.491 1.596 0 N-CA-C 109.319 -0.623 . . . . 0.0 109.319 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.481 ' O ' ' N ' ' A' ' 84' ' ' LYS . . . -153.14 95.85 2.0 Allowed 'General case' 0 N--CA 1.451 -0.403 0 CA-C-O 121.079 0.466 . . . . 0.0 110.059 179.994 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -46.49 -16.36 0.03 OUTLIER 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.08 179.609 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.481 ' N ' ' O ' ' A' ' 82' ' ' ALA . 99.4 mttt -63.97 -41.96 97.4 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.314 179.328 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 35.9 t30 -64.79 -43.67 92.44 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.357 -179.523 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 2.6 tp -60.95 -43.36 98.81 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.6 -179.241 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 74.4 mt -55.83 -35.85 66.85 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.309 -179.767 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 88.6 mt-30 -71.01 -34.58 71.48 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.546 179.64 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -62.36 -48.08 81.34 Favored 'General case' 0 C--N 1.334 -0.08 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.044 -179.013 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 22.1 pt -65.2 -35.71 76.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.691 -179.996 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -59.17 -50.66 73.2 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.559 -179.648 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 56.0 tt0 -65.3 -44.93 86.34 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.859 -179.668 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -63.34 -47.58 81.59 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.702 -179.808 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . 0.445 ' O ' ' CB ' ' A' ' 95' ' ' SER . 16.0 mm-40 -72.64 -16.38 61.71 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.292 -179.832 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . 0.445 ' CB ' ' O ' ' A' ' 94' ' ' GLU . 0.7 OUTLIER 79.69 11.36 1.27 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.516 -179.91 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 9.7 p -80.89 165.28 21.96 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.458 -179.911 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 57.5 tp -67.39 126.11 28.26 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.647 -179.974 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.574 ' N ' HD12 ' A' ' 98' ' ' LEU . 10.5 mp -46.4 148.37 1.66 Allowed Pre-proline 0 N--CA 1.45 -0.43 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.75 179.887 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -70.63 143.96 48.09 Favored 'Trans proline' 0 C--N 1.31 -1.474 0 C-N-CA 122.764 2.31 . . . . 0.0 111.996 179.63 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 91.5 t80 -129.97 131.37 45.9 Favored 'General case' 0 C--O 1.234 0.261 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 179.57 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 79.5 m-85 -98.72 146.17 26.16 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.823 -179.444 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -144.18 145.7 32.26 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.503 -179.883 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 94.4 m -123.97 129.76 51.47 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.423 -179.939 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -113.23 141.05 47.43 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.147 179.933 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 13.4 p -115.15 120.79 40.95 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-O 120.874 0.368 . . . . 0.0 110.627 179.452 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 35.6 p -159.02 164.67 35.3 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.425 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 122.8 164.97 12.27 Favored Glycine 0 CA--C 1.522 0.473 0 N-CA-C 110.834 -0.906 . . . . 0.0 110.834 179.721 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 20.4 Cg_endo -60.9 151.46 77.53 Favored 'Trans proline' 0 C--N 1.3 -1.98 0 C-N-CA 122.854 2.369 . . . . 0.0 112.16 179.344 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 91.2 p -63.68 -18.41 63.96 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.186 179.326 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 99.2 m-70 -89.9 -43.25 10.73 Favored 'General case' 0 CA--C 1.519 -0.234 0 CA-C-O 120.889 0.376 . . . . 0.0 110.538 179.409 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -124.2 77.75 60.31 Favored Pre-proline 0 CA--C 1.532 0.267 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.378 179.445 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' PRO . . . . . 0.513 ' O ' HG23 ' A' ' 113' ' ' THR . 59.7 Cg_endo -75.41 162.73 35.63 Favored 'Trans proline' 0 C--N 1.305 -1.743 0 C-N-CA 122.572 2.181 . . . . 0.0 112.295 179.836 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . 0.513 HG23 ' O ' ' A' ' 112' ' ' PRO . 25.4 p -157.51 153.63 27.33 Favored 'General case' 0 CA--C 1.515 -0.378 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.629 179.488 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -130.75 143.14 50.53 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.287 -179.877 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 97.5 m -130.5 126.17 36.19 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.575 179.454 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 29.1 t -97.5 123.19 41.28 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.408 -179.922 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . 0.427 ' CG2' ' CG2' ' A' ' 124' ' ' VAL . 51.7 m -112.97 129.14 56.59 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.196 -179.805 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 9.4 p -111.87 142.02 25.55 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.305 179.993 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 81.6 tt0 -124.64 132.71 53.4 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.767 179.908 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . 0.635 ' CZ ' ' CE1' ' A' ' 125' ' ' PHE . 48.3 p90 -167.3 158.57 11.92 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.51 179.168 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 54.12 21.47 3.02 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.605 179.685 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 75.52 21.88 76.43 Favored Glycine 0 CA--C 1.522 0.481 0 N-CA-C 111.075 -0.81 . . . . 0.0 111.075 -179.947 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -132.73 153.0 51.61 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.652 0.263 . . . . 0.0 110.575 179.872 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . 0.499 ' O ' HG13 ' A' ' 124' ' ' VAL . 14.2 p -121.4 126.81 75.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-O 120.91 0.386 . . . . 0.0 110.558 -179.826 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 125' ' ' PHE . . . . . 0.635 ' CE1' ' CZ ' ' A' ' 120' ' ' PHE . 41.9 m-85 -111.44 121.3 44.84 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.314 179.646 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 5.9 p -83.26 137.78 33.86 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.416 180.0 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -86.15 -169.07 45.54 Favored Glycine 0 CA--C 1.521 0.454 0 N-CA-C 110.654 -0.978 . . . . 0.0 110.654 179.826 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -97.88 132.88 43.07 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-O 120.653 0.263 . . . . 0.0 110.788 -179.91 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 98.4 mt-10 -56.55 146.98 23.32 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 120.924 0.392 . . . . 0.0 110.416 179.221 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -169.77 161.75 9.29 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.652 -179.962 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 77.5 tttt -88.84 33.03 0.78 Allowed 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.173 0.511 . . . . 0.0 110.311 179.532 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 2.5 t -159.28 150.6 20.12 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.789 -179.683 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -81.06 -32.83 33.83 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.933 179.758 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . 0.423 ' N ' ' CD ' ' A' ' 134' ' ' LYS . 4.5 mptp? -58.5 -51.87 68.03 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.644 -178.628 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 3.5 tp -65.8 -39.72 91.19 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-O 120.845 0.355 . . . . 0.0 110.824 179.916 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -57.79 -55.17 38.3 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.572 -179.157 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -59.24 -43.35 92.4 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.398 -179.433 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 47.8 ttp -61.4 -44.66 96.77 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.443 -179.573 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 18.1 m -62.08 -39.97 94.23 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.748 -179.854 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -62.88 -46.44 87.84 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.702 -179.946 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -71.88 -23.72 61.55 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.547 179.895 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 64.4 tttp -70.54 -48.73 54.02 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.261 179.78 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 143' ' ' VAL . . . . . 0.402 HG13 ' N ' ' A' ' 144' ' ' ALA . 7.6 p -69.16 -37.97 77.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.69 -179.542 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 144' ' ' ALA . . . . . 0.402 ' N ' HG13 ' A' ' 143' ' ' VAL . . . -63.19 -45.86 89.76 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.642 -179.622 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 145' ' ' PHE . . . . . . . . . . . . . 60.7 t80 -60.24 -43.01 96.45 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.566 -179.326 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 146' ' ' MET . . . . . . . . . . . . . 62.7 ttp -61.63 -39.63 91.97 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.95 -179.73 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 33.1 t -67.04 -43.6 82.36 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.901 -179.999 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 148' ' ' ILE . . . . . . . . . . . . . 89.6 mt -57.28 -31.82 39.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.695 -179.411 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 53.9 mtpt -63.05 -41.85 99.57 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.819 179.864 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 150' ' ' ASN . . . . . . . . . . . . . 45.1 t30 -64.03 -40.13 95.63 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.506 -179.98 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.775 0 CA-C-O 117.957 -1.468 . . . . 0.0 110.921 -179.901 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 13.0 t . . . . . 0 N--CA 1.489 1.494 0 N-CA-C 109.455 -0.572 . . . . 0.0 109.455 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.476 ' C ' ' N ' ' A' ' 84' ' ' LYS . . . -153.36 95.97 1.99 Allowed 'General case' 0 N--CA 1.449 -0.51 0 CA-C-O 121.082 0.468 . . . . 0.0 110.274 -179.877 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -47.01 -16.38 0.04 OUTLIER 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.914 -0.585 . . . . 0.0 109.804 179.603 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.476 ' N ' ' C ' ' A' ' 82' ' ' ALA . 69.1 mttm -63.73 -42.51 97.89 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.686 -0.688 . . . . 0.0 109.993 179.86 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 89.5 m-20 -63.12 -44.49 95.49 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.525 -179.748 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 6.2 tt -63.71 -40.95 98.04 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.832 -179.879 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.44 HD23 HD11 ' A' ' 90' ' ' ILE . 39.4 mt -56.79 -36.19 69.57 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.092 -179.703 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 88.3 mt-30 -71.63 -31.36 66.78 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.59 179.672 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -66.07 -47.26 74.89 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.301 -179.386 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.44 HD11 HD23 ' A' ' 87' ' ' LEU . 30.4 pt -66.88 -34.96 73.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-O 120.929 0.395 . . . . 0.0 110.463 179.957 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -58.32 -49.89 75.58 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.706 -179.416 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 89.0 mt-30 -65.67 -44.24 86.87 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.754 179.809 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 64.4 tttp -62.28 -47.94 82.12 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.621 -179.745 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 98.1 mt-10 -74.92 -2.91 29.09 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.508 179.995 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 2.7 t 67.79 6.31 5.0 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.603 -179.996 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 7.6 p -75.03 160.72 30.18 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.261 -179.873 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 51.7 tp -67.15 129.8 41.05 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.879 -179.521 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 10.3 mp -45.47 155.01 0.48 Allowed Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.2 179.258 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -65.1 171.65 8.61 Favored 'Trans proline' 0 C--N 1.307 -1.637 0 C-N-CA 122.826 2.351 . . . . 0.0 111.737 179.621 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 29.0 t80 -144.27 122.57 12.29 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.124 179.191 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 -103.59 132.96 49.39 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.416 -179.682 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -144.07 145.1 31.95 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.328 179.883 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 97.7 m -126.2 133.53 51.5 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.656 -179.672 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -124.28 149.08 46.91 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.339 179.925 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 20.3 p -108.06 135.4 49.48 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-O 120.864 0.364 . . . . 0.0 110.706 179.814 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 26.5 m -162.73 161.71 26.46 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.499 179.905 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 119.3 179.19 16.68 Favored Glycine 0 CA--C 1.522 0.479 0 N-CA-C 110.668 -0.973 . . . . 0.0 110.668 179.884 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . 0.667 ' HG2' ' HB3' ' A' ' 111' ' ' ALA . 28.6 Cg_endo -60.91 151.51 77.2 Favored 'Trans proline' 0 C--N 1.302 -1.91 0 C-N-CA 122.87 2.38 . . . . 0.0 112.392 -179.664 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 37.5 t -63.56 -18.86 64.31 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.172 179.433 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 52.3 t-80 -90.31 -37.0 14.35 Favored 'General case' 0 CA--C 1.519 -0.243 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.118 179.55 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . 0.667 ' HB3' ' HG2' ' A' ' 108' ' ' PRO . . . -124.35 81.14 59.06 Favored Pre-proline 0 N--CA 1.465 0.32 0 CA-C-O 121.124 0.488 . . . . 0.0 110.11 179.427 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -84.33 117.32 2.12 Favored 'Trans proline' 0 C--N 1.303 -1.855 0 C-N-CA 122.55 2.167 . . . . 0.0 112.487 -179.215 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 48.2 p -105.37 170.06 8.1 Favored 'General case' 0 CA--C 1.517 -0.326 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.197 179.741 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -130.57 142.27 50.46 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.396 -179.842 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 86.3 m -121.0 119.1 31.56 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.285 179.68 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 21.5 m -97.9 122.12 40.64 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.122 -179.988 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 62.2 m -112.9 132.16 55.43 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.347 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 10.9 p -112.67 138.9 40.22 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.261 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.197 -179.87 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 84.0 tt0 -125.28 134.01 52.43 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.81 -179.714 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . 0.605 ' CZ ' ' CE1' ' A' ' 125' ' ' PHE . 48.7 p90 -166.61 158.73 13.52 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.615 179.442 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 52.73 23.01 2.5 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.828 0.347 . . . . 0.0 110.467 179.843 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 74.98 22.27 77.06 Favored Glycine 0 CA--C 1.521 0.44 0 N-CA-C 111.118 -0.793 . . . . 0.0 111.118 179.786 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 63.5 mttp -132.3 152.6 51.31 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 110.355 -0.239 . . . . 0.0 110.355 -179.892 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . 0.482 ' O ' HG13 ' A' ' 124' ' ' VAL . 7.2 p -118.99 124.61 73.47 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.23 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.69 -179.994 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 125' ' ' PHE . . . . . 0.605 ' CE1' ' CZ ' ' A' ' 120' ' ' PHE . 50.5 m-85 -108.5 119.8 40.58 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.07 179.79 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 73.4 m -82.49 134.26 35.21 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.383 -179.91 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -91.2 -167.15 40.94 Favored Glycine 0 CA--C 1.524 0.63 0 N-CA-C 110.673 -0.971 . . . . 0.0 110.673 179.846 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . 0.54 ' H ' ' CB ' ' A' ' 139' ' ' SER . 35.7 tt0 -98.0 133.89 41.85 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-O 120.968 0.413 . . . . 0.0 110.658 179.716 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 -63.35 151.75 39.96 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.324 179.71 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -171.78 164.36 6.51 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.733 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 61.7 pttt -88.39 32.64 0.77 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.665 179.184 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 3.9 t -156.14 148.13 23.19 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.929 0.395 . . . . 0.0 110.361 179.976 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 99.9 mttt -81.81 -17.14 48.57 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.642 -0.708 . . . . 0.0 109.896 179.738 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -73.29 -56.86 4.51 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.815 -179.702 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 4.3 tp -65.46 -41.34 93.48 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.344 -179.491 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -56.53 -55.12 37.81 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.832 -178.959 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -60.71 -40.29 91.71 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.789 0.328 . . . . 0.0 110.586 -179.729 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 56.7 mtt -61.63 -42.75 99.32 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.46 -179.817 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . 0.54 ' CB ' ' H ' ' A' ' 128' ' ' GLU . 74.1 m -61.38 -41.03 96.45 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.44 -0.345 . . . . 0.0 110.873 -179.885 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -63.02 -45.76 90.8 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.935 0.398 . . . . 0.0 110.937 -179.927 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -71.07 -24.22 62.28 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.711 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 52.7 tttp -71.95 -49.98 32.85 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.931 0.396 . . . . 0.0 111.254 179.828 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 143' ' ' VAL . . . . . 0.424 HG13 ' N ' ' A' ' 144' ' ' ALA . 7.4 p -68.29 -38.96 80.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.712 -179.67 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 144' ' ' ALA . . . . . 0.424 ' N ' HG13 ' A' ' 143' ' ' VAL . . . -64.44 -48.3 75.84 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.878 -179.647 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 145' ' ' PHE . . . . . 0.422 ' CD1' ' C ' ' A' ' 145' ' ' PHE . 30.7 t80 -58.76 -44.45 90.59 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.922 -179.594 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 146' ' ' MET . . . . . . . . . . . . . 61.6 ttp -60.82 -38.34 85.08 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.881 -179.286 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 6.6 t -67.95 -41.23 82.81 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.879 179.538 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 148' ' ' ILE . . . . . . . . . . . . . 80.8 mt -57.51 -42.85 81.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 115.681 -0.691 . . . . 0.0 111.147 -178.953 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 17.1 ptmt -81.59 -26.6 34.79 Favored 'General case' 0 C--N 1.324 -0.506 0 C-N-CA 120.821 -0.352 . . . . 0.0 110.76 -179.783 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 150' ' ' ASN . . . . . . . . . . . . . 59.3 t-20 -62.89 -41.27 99.35 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.381 -179.602 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.781 0 CA-C-O 118.06 -1.411 . . . . 0.0 110.941 179.827 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 7.9 m . . . . . 0 N--CA 1.49 1.546 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.478 ' C ' ' N ' ' A' ' 84' ' ' LYS . . . -154.06 95.9 1.9 Allowed 'General case' 0 N--CA 1.452 -0.347 0 CA-C-O 121.062 0.458 . . . . 0.0 110.051 179.992 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -47.01 -15.79 0.04 OUTLIER 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.93 179.748 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.478 ' N ' ' C ' ' A' ' 82' ' ' ALA . 99.6 mttt -64.13 -42.0 97.0 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.733 -0.667 . . . . 0.0 109.901 179.679 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 92.5 m-20 -64.23 -46.27 84.53 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.786 -179.79 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 6.3 tt -62.35 -40.79 97.56 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.828 -179.848 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.485 HD23 HD11 ' A' ' 90' ' ' ILE . 33.4 mt -57.21 -36.72 71.22 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.05 -179.642 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -70.78 -33.42 70.74 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.932 -0.577 . . . . 0.0 110.537 179.592 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 97.6 mt-10 -63.99 -48.51 76.13 Favored 'General case' 0 N--CA 1.462 0.152 0 C-N-CA 120.694 -0.402 . . . . 0.0 111.1 -179.29 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.485 HD11 HD23 ' A' ' 87' ' ' LEU . 29.4 pt -68.55 -34.77 67.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.75 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -57.72 -51.01 71.3 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.853 -179.535 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 69.3 tp60 -67.46 -41.5 84.58 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.539 179.937 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 65.8 tttm -60.97 -47.35 86.83 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.45 -179.505 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 96.1 mt-10 -72.85 -3.25 24.4 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.466 179.919 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 4.7 t 64.99 5.78 3.1 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.615 179.984 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . 0.544 ' OG ' ' N ' ' A' ' 97' ' ' LEU . 29.3 t -61.86 -127.85 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.243 179.774 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.544 ' N ' ' OG ' ' A' ' 96' ' ' SER . 94.1 mt -139.35 126.43 21.14 Favored 'General case' 0 CA--C 1.517 -0.3 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.548 179.977 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.588 ' N ' HD12 ' A' ' 98' ' ' LEU . 10.2 mp -45.87 142.35 3.8 Favored Pre-proline 0 C--N 1.326 -0.435 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.658 -179.001 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -71.48 144.06 44.28 Favored 'Trans proline' 0 N--CA 1.494 1.546 0 C-N-CA 122.623 2.215 . . . . 0.0 112.241 179.757 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 87.4 t80 -123.28 126.62 47.23 Favored 'General case' 0 CA--C 1.513 -0.461 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 179.937 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 94.6 m-85 -95.18 142.05 28.06 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.393 -178.969 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -143.84 144.87 31.95 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 110.104 -0.332 . . . . 0.0 110.104 179.691 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 93.0 m -122.45 128.0 50.33 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.394 -179.936 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -114.58 142.77 46.0 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.223 179.848 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 29.4 p -103.68 132.4 49.98 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-O 120.787 0.327 . . . . 0.0 110.244 179.802 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 29.8 p -160.49 165.74 30.38 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.132 -179.837 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 115.4 -176.41 16.59 Favored Glycine 0 CA--C 1.524 0.615 0 N-CA-C 111.141 -0.784 . . . . 0.0 111.141 179.786 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . 0.42 ' HG2' ' HB3' ' A' ' 111' ' ' ALA . 29.4 Cg_endo -64.35 156.83 57.74 Favored 'Trans proline' 0 C--N 1.308 -1.565 0 C-N-CA 122.862 2.375 . . . . 0.0 112.272 -179.909 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 26.6 m -69.98 -19.54 63.34 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.14 179.313 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 74.6 m80 -88.84 -39.35 13.91 Favored 'General case' 0 CA--C 1.518 -0.269 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.405 179.894 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . 0.453 ' HB1' ' CE ' ' A' ' 131' ' ' LYS . . . -125.17 78.23 66.98 Favored Pre-proline 0 CA--C 1.534 0.344 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.257 179.221 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -80.81 126.38 5.83 Favored 'Trans proline' 0 C--N 1.305 -1.755 0 C-N-CA 122.344 2.029 . . . . 0.0 112.362 -179.725 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 4.3 p -110.36 173.64 6.23 Favored 'General case' 0 CA--C 1.513 -0.463 0 CA-C-O 120.951 0.405 . . . . 0.0 109.952 179.667 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 1.1 m-85 -134.14 148.28 50.93 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.491 -179.599 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 96.6 m -128.32 124.59 36.86 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.144 179.365 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 32.6 p -95.19 120.03 34.73 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.314 -179.649 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . 0.42 ' CG2' ' CG2' ' A' ' 124' ' ' VAL . 99.8 m -107.92 126.57 52.84 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.17 179.856 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 11.6 p -109.33 137.35 41.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.203 -179.719 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 77.5 tt0 -123.82 131.8 53.66 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.822 -179.808 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . 0.615 ' CZ ' ' CE1' ' A' ' 125' ' ' PHE . 44.6 p90 -164.98 156.7 15.24 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.48 179.696 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 52.24 24.55 2.88 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.86 0.362 . . . . 0.0 110.617 179.832 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 73.54 22.22 78.71 Favored Glycine 0 CA--C 1.524 0.649 0 N-CA-C 111.139 -0.785 . . . . 0.0 111.139 179.787 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -131.99 152.25 51.24 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 110.319 -0.252 . . . . 0.0 110.319 -179.969 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . 0.477 ' O ' HG13 ' A' ' 124' ' ' VAL . 14.9 p -122.01 128.35 75.59 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.194 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.76 -179.649 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 125' ' ' PHE . . . . . 0.615 ' CE1' ' CZ ' ' A' ' 120' ' ' PHE . 24.5 m-85 -112.35 122.87 48.93 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.285 179.873 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 8.8 m -79.61 127.39 32.11 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.123 179.996 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -85.2 -171.84 48.57 Favored Glycine 0 CA--C 1.528 0.853 0 N-CA-C 110.891 -0.884 . . . . 0.0 110.891 -179.938 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . 0.467 ' CG ' ' N ' ' A' ' 129' ' ' GLU . 70.5 tt0 -80.25 167.8 19.85 Favored 'General case' 0 N--CA 1.445 -0.7 0 CA-C-O 120.664 0.269 . . . . 0.0 110.362 -179.915 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . 0.547 ' CD ' ' H ' ' A' ' 129' ' ' GLU . 1.3 pm0 -107.66 142.61 37.36 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.129 0.49 . . . . 0.0 110.138 179.242 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -172.11 166.64 6.1 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.856 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . 0.453 ' CE ' ' HB1' ' A' ' 111' ' ' ALA . 63.2 mttp -86.12 35.2 0.63 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.35 178.932 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 3.1 t -153.13 146.41 24.79 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.865 179.951 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 99.7 mttt -83.65 -21.65 32.41 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.802 179.692 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -69.26 -54.92 12.23 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.99 -179.187 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 4.0 tp -65.41 -40.19 93.09 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.888 -179.596 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -57.55 -54.99 40.56 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.621 -179.174 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -60.83 -41.39 95.66 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.804 0.335 . . . . 0.0 110.627 -179.741 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 33.3 tpp -60.23 -42.73 95.83 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.359 -179.727 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . 0.423 ' CB ' ' H ' ' A' ' 128' ' ' GLU . 38.5 m -64.45 -36.81 85.37 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.847 -179.937 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -62.33 -46.46 88.6 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.971 0.415 . . . . 0.0 110.573 -179.822 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -70.38 -23.92 62.86 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.504 179.826 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -71.99 -50.61 27.25 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.291 -179.896 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 143' ' ' VAL . . . . . 0.45 HG13 ' N ' ' A' ' 144' ' ' ALA . 7.4 p -68.11 -40.97 83.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.763 -179.531 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 144' ' ' ALA . . . . . 0.45 ' N ' HG13 ' A' ' 143' ' ' VAL . . . -64.76 -46.88 80.29 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.667 -179.834 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 145' ' ' PHE . . . . . 0.45 ' C ' ' CD1' ' A' ' 145' ' ' PHE . 27.3 t80 -58.31 -45.93 87.1 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.931 -179.487 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 146' ' ' MET . . . . . . . . . . . . . 47.4 tpp -61.24 -38.02 85.14 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.863 -179.323 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 19.1 m -67.4 -41.03 85.58 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.106 -179.874 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 148' ' ' ILE . . . . . . . . . . . . . 81.1 mt -56.78 -42.53 77.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.608 -179.363 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 17.9 ptmt -86.22 -28.27 23.96 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.846 0.355 . . . . 0.0 110.787 179.9 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 150' ' ' ASN . . . . . . . . . . . . . 59.6 t30 -91.44 106.97 18.88 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.42 -179.724 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.754 0 CA-C-O 117.942 -1.477 . . . . 0.0 110.973 -179.852 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 12.4 p . . . . . 0 N--CA 1.49 1.575 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.479 ' C ' ' N ' ' A' ' 84' ' ' LYS . . . -153.66 96.71 2.04 Favored 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 179.969 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 2.8 m-85 -48.26 -16.46 0.1 Allowed 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.432 -0.804 . . . . 0.0 109.533 179.62 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.479 ' N ' ' C ' ' A' ' 82' ' ' ALA . 63.9 mttp -63.8 -43.34 96.58 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.465 -0.789 . . . . 0.0 109.891 -179.978 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 41.8 t30 -63.33 -44.1 95.89 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.711 -179.135 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 6.1 tt -61.51 -41.69 97.67 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.982 -179.416 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.485 HD23 HD11 ' A' ' 90' ' ' ILE . 65.1 mt -57.44 -36.52 71.5 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.197 0.522 . . . . 0.0 109.626 -179.638 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 88.9 mt-30 -70.39 -35.59 73.57 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.541 178.996 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 80.9 mm-40 -63.3 -48.44 78.07 Favored 'General case' 0 N--CA 1.462 0.138 0 C-N-CA 120.664 -0.414 . . . . 0.0 111.494 -179.054 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.485 HD11 HD23 ' A' ' 87' ' ' LEU . 14.6 pt -63.7 -43.69 98.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 C-N-CA 120.858 -0.337 . . . . 0.0 110.491 -179.791 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . 0.515 ' O ' ' N ' ' A' ' 95' ' ' SER . . . -64.31 -47.69 78.47 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.814 -179.651 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 3.5 tm0? -65.76 -46.51 78.51 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.81 -179.55 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 55.7 mtpt -62.43 -44.78 95.62 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.869 -179.743 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 96.1 mt-10 -91.73 -0.44 57.55 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.225 -179.663 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . 0.515 ' N ' ' O ' ' A' ' 91' ' ' ALA . 13.8 m 41.33 81.36 0.03 OUTLIER 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.535 -179.658 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . 0.434 ' O ' ' CB ' ' A' ' 97' ' ' LEU . 75.5 p -139.64 36.19 2.01 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.776 -179.578 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.434 ' CB ' ' O ' ' A' ' 96' ' ' SER . 0.2 OUTLIER 79.59 93.98 0.05 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.939 0.399 . . . . 0.0 110.779 179.749 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.556 ' N ' HD12 ' A' ' 98' ' ' LEU . 10.5 mp -45.74 147.65 1.53 Allowed Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.284 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -68.53 140.95 49.1 Favored 'Trans proline' 0 N--CA 1.495 1.612 0 C-N-CA 122.707 2.271 . . . . 0.0 111.844 -179.859 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 87.0 t80 -126.88 130.04 49.38 Favored 'General case' 0 CA--C 1.511 -0.521 0 N-CA-C 108.417 -0.957 . . . . 0.0 108.417 179.795 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 94.8 m-85 -97.53 143.61 28.06 Favored 'General case' 0 C--N 1.322 -0.597 0 C-N-CA 120.723 -0.391 . . . . 0.0 110.35 -178.972 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -142.61 144.4 32.81 Favored 'General case' 0 N--CA 1.464 0.243 0 N-CA-C 109.986 -0.376 . . . . 0.0 109.986 179.611 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 90.1 m -124.53 130.24 52.1 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.456 -179.971 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -119.54 146.95 45.01 Favored 'General case' 0 N--CA 1.467 0.409 0 N-CA-C 109.851 -0.426 . . . . 0.0 109.851 179.492 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 32.2 p -110.36 138.34 46.87 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 110.175 -0.306 . . . . 0.0 110.175 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 44.3 t -167.4 154.2 8.34 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 110.032 -0.358 . . . . 0.0 110.032 179.85 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 126.08 -175.75 17.6 Favored Glycine 0 CA--C 1.529 0.915 0 N-CA-C 111.307 -0.717 . . . . 0.0 111.307 179.554 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . 0.401 ' HG2' ' HB3' ' A' ' 111' ' ' ALA . 19.2 Cg_endo -61.37 153.06 68.42 Favored 'Trans proline' 0 N--CA 1.495 1.599 0 C-N-CA 122.59 2.193 . . . . 0.0 112.366 179.881 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 92.9 p -67.3 -16.53 64.32 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.661 -0.7 . . . . 0.0 109.927 179.202 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 52.7 t-80 -91.79 -41.97 10.37 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-O 120.894 0.378 . . . . 0.0 110.301 -179.942 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . 0.401 ' HB3' ' HG2' ' A' ' 108' ' ' PRO . . . -123.95 79.64 57.61 Favored Pre-proline 0 CA--C 1.535 0.373 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.225 179.383 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_endo -83.17 122.68 3.34 Favored 'Trans proline' 0 N--CA 1.491 1.348 0 C-N-CA 122.699 2.266 . . . . 0.0 112.232 179.949 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 63.6 p -102.82 167.31 9.95 Favored 'General case' 0 CA--C 1.515 -0.399 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.003 179.896 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 1.2 m-85 -130.9 144.42 51.45 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.121 -179.897 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . 0.437 ' OG1' ' OE1' ' A' ' 129' ' ' GLU . 46.5 m -123.82 120.26 32.08 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.659 -0.497 . . . . 0.0 109.659 179.395 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 41.2 t -95.21 121.41 36.83 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.229 -179.821 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 70.6 m -115.83 129.82 56.59 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.29 -0.413 . . . . 0.0 109.932 -179.91 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 12.9 p -113.77 145.74 19.25 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.259 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.164 -179.75 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -127.29 133.41 50.16 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.584 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . 0.619 ' CZ ' ' CE1' ' A' ' 125' ' ' PHE . 49.3 p90 -166.3 159.79 15.23 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.525 179.179 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 52.89 19.37 1.3 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.694 0.283 . . . . 0.0 110.761 179.423 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 77.5 21.3 72.84 Favored Glycine 0 CA--C 1.526 0.742 0 N-CA-C 111.249 -0.74 . . . . 0.0 111.249 179.76 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -131.69 151.54 51.56 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 110.192 -0.299 . . . . 0.0 110.192 179.765 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . 0.411 ' O ' HG13 ' A' ' 124' ' ' VAL . 6.7 p -121.02 127.71 75.97 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.171 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.643 -179.478 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 125' ' ' PHE . . . . . 0.619 ' CE1' ' CZ ' ' A' ' 120' ' ' PHE . 27.5 m-85 -109.44 154.48 22.57 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.664 179.915 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 37.2 p -117.79 132.99 56.38 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.624 -179.998 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -83.81 -169.79 45.66 Favored Glycine 0 CA--C 1.52 0.394 0 N-CA-C 110.624 -0.99 . . . . 0.0 110.624 179.668 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . 0.491 ' H ' ' CB ' ' A' ' 139' ' ' SER . 7.1 pt-20 -94.51 127.75 40.65 Favored 'General case' 0 CA--C 1.529 0.152 0 CA-C-O 120.553 0.216 . . . . 0.0 111.025 -179.373 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . 0.437 ' OE1' ' OG1' ' A' ' 115' ' ' THR . 79.8 mm-40 -53.81 143.73 20.25 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 120.457 -0.497 . . . . 0.0 110.209 179.832 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -169.63 161.62 9.5 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.772 179.984 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 22.4 pttp -88.61 33.99 0.76 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.416 179.652 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 4.8 t -154.74 147.86 24.78 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.621 179.493 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 99.7 mttt -79.98 -33.41 39.46 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.877 179.639 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 62.9 mttp -59.9 -54.68 43.29 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.037 -178.826 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . 0.4 HD21 ' OE2' ' A' ' 128' ' ' GLU . 3.7 tp -64.81 -38.86 92.39 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.914 0.387 . . . . 0.0 110.388 179.924 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -57.16 -54.94 41.07 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.568 -179.406 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -64.14 -41.01 97.35 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.714 -179.218 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 93.0 mtp -62.41 -41.44 98.69 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.208 -179.826 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . 0.491 ' CB ' ' H ' ' A' ' 128' ' ' GLU . 68.8 m -66.7 -36.55 82.77 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.724 179.39 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -65.17 -45.84 83.26 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.953 0.406 . . . . 0.0 110.65 179.553 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -72.36 -24.27 61.25 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.419 179.856 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -70.01 -48.68 57.12 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.048 179.757 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 7.2 p -67.98 -37.37 78.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.705 -179.94 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 144' ' ' ALA . . . . . 0.438 ' O ' ' OG ' ' A' ' 147' ' ' SER . . . -65.52 -46.41 79.72 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.903 0.382 . . . . 0.0 110.722 -179.952 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 145' ' ' PHE . . . . . . . . . . . . . 85.6 t80 -60.72 -41.52 95.45 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.797 -179.986 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 146' ' ' MET . . . . . . . . . . . . . 75.4 mmm -60.69 -38.47 85.09 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.627 -179.461 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 147' ' ' SER . . . . . 0.438 ' OG ' ' O ' ' A' ' 144' ' ' ALA . 58.5 p -70.76 -39.81 73.02 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 120.75 -0.38 . . . . 0.0 111.089 179.429 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 148' ' ' ILE . . . . . . . . . . . . . 84.3 mt -58.5 -26.78 31.82 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.242 0 CA-C-O 120.715 0.293 . . . . 0.0 110.622 -179.608 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 36.5 mtmt -58.99 -41.91 88.76 Favored 'General case' 0 C--N 1.323 -0.577 0 C-N-CA 120.326 -0.55 . . . . 0.0 110.576 -179.413 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 150' ' ' ASN . . . . . . . . . . . . . 19.4 t-20 -63.49 -41.39 98.56 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.591 179.854 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.75 0 CA-C-O 118.083 -1.398 . . . . 0.0 110.984 -179.915 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 4.7 t . . . . . 0 N--CA 1.491 1.607 0 N-CA-C 109.232 -0.655 . . . . 0.0 109.232 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.472 ' C ' ' N ' ' A' ' 84' ' ' LYS . . . -154.08 97.08 2.02 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-O 121.13 0.49 . . . . 0.0 109.759 -179.869 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -47.63 -16.09 0.06 Allowed 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.72 179.971 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.472 ' N ' ' C ' ' A' ' 82' ' ' ALA . 64.7 mttp -63.88 -42.11 97.58 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.617 -0.719 . . . . 0.0 109.804 179.716 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 13.7 m120 -63.73 -46.19 86.48 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.884 -179.403 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 7.1 tt -62.64 -39.67 94.59 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.556 -179.724 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.518 HD23 HD11 ' A' ' 90' ' ' ILE . 33.7 mt -57.74 -38.97 76.25 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 -179.689 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 78.7 mt-30 -69.26 -35.11 75.75 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.645 179.122 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 95.7 mt-10 -62.99 -48.73 77.58 Favored 'General case' 0 N--CA 1.466 0.327 0 C-N-CA 120.761 -0.376 . . . . 0.0 111.166 -179.121 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.518 HD11 HD23 ' A' ' 87' ' ' LEU . 29.8 pt -66.42 -34.77 72.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.683 -179.968 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -55.71 -49.09 73.93 Favored 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 120.737 -0.385 . . . . 0.0 110.667 -179.37 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 52.9 tt0 -67.97 -43.49 78.86 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.846 -179.857 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 66.0 tttm -61.82 -48.52 80.2 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.899 0.381 . . . . 0.0 110.555 -179.487 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 80.2 mm-40 -76.84 2.62 14.04 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.576 -179.764 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 4.3 t 64.42 8.04 4.01 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.78 179.766 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 18.7 m -75.21 158.46 32.92 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.437 179.732 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.594 ' N ' HD12 ' A' ' 97' ' ' LEU . 9.4 mp -69.29 131.68 45.24 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.998 0.428 . . . . 0.0 110.393 -179.459 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.56 ' N ' HD12 ' A' ' 98' ' ' LEU . 10.3 mp -46.16 148.23 1.59 Allowed Pre-proline 0 C--N 1.326 -0.426 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.601 -179.727 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -73.07 142.69 34.84 Favored 'Trans proline' 0 N--CA 1.496 1.65 0 C-N-CA 122.828 2.352 . . . . 0.0 111.992 179.541 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 94.6 t80 -124.93 127.4 47.0 Favored 'General case' 0 CA--C 1.51 -0.564 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 179.798 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 84.1 m-85 -96.93 145.98 25.39 Favored 'General case' 0 C--N 1.324 -0.512 0 C-N-CA 120.726 -0.39 . . . . 0.0 110.303 -178.885 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -142.37 143.53 32.75 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.51 -0.314 . . . . 0.0 110.266 179.712 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 97.3 m -125.83 133.03 52.11 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.305 179.809 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -127.17 152.28 47.56 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.176 179.765 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 33.3 p -108.22 135.01 50.26 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-O 120.823 0.344 . . . . 0.0 110.133 -179.891 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 99.5 p -160.08 164.41 33.11 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.461 -179.805 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 117.47 -175.5 15.73 Favored Glycine 0 CA--C 1.527 0.835 0 N-CA-C 111.171 -0.772 . . . . 0.0 111.171 179.618 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 25.0 Cg_endo -62.15 152.3 76.73 Favored 'Trans proline' 0 N--CA 1.497 1.713 0 C-N-CA 122.863 2.376 . . . . 0.0 112.461 179.895 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 89.7 p -67.46 -17.31 64.65 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.016 179.284 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 55.1 t-80 -89.6 -42.73 11.23 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.209 179.956 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -123.93 78.07 58.1 Favored Pre-proline 0 CA--C 1.535 0.391 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.112 179.331 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -79.07 127.95 7.98 Favored 'Trans proline' 0 N--CA 1.49 1.27 0 C-N-CA 122.347 2.031 . . . . 0.0 112.435 179.768 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 52.0 p -110.19 172.87 6.61 Favored 'General case' 0 CA--C 1.519 -0.249 0 CA-C-N 115.793 -0.639 . . . . 0.0 109.86 179.629 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 1.7 m-85 -130.47 143.9 51.06 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.503 -179.377 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 97.9 m -124.59 120.91 33.27 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.265 -0.425 . . . . 0.0 109.965 179.307 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 12.9 t -102.14 128.82 48.46 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.239 179.917 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 97.5 m -129.6 141.44 50.95 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.322 -179.87 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 14.2 p -117.77 152.09 19.75 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.227 0 CA-C-N 116.044 -0.525 . . . . 0.0 109.76 179.86 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -129.03 136.98 51.03 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.004 0.43 . . . . 0.0 110.308 -179.895 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . 0.62 ' CZ ' ' CE1' ' A' ' 125' ' ' PHE . 55.0 p90 -169.31 161.42 10.01 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.791 -0.641 . . . . 0.0 110.744 179.14 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 52.87 19.21 1.24 Allowed 'General case' 0 N--CA 1.462 0.166 0 CA-C-O 120.771 0.32 . . . . 0.0 110.712 179.39 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 75.86 20.44 77.92 Favored Glycine 0 CA--C 1.526 0.723 0 N-CA-C 111.05 -0.82 . . . . 0.0 111.05 179.774 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 97.2 mttt -131.82 151.5 51.63 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.955 0.407 . . . . 0.0 110.145 -179.703 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . 0.524 HG22 ' N ' ' A' ' 125' ' ' PHE . 7.7 p -103.54 160.29 4.62 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.229 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.606 -179.325 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 125' ' ' PHE . . . . . 0.62 ' CE1' ' CZ ' ' A' ' 120' ' ' PHE . 85.8 m-85 -151.63 105.69 3.17 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.154 179.817 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . 0.519 ' O ' HG21 ' A' ' 143' ' ' VAL . 34.2 t -88.48 151.92 22.22 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.499 179.7 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -99.93 -159.36 28.5 Favored Glycine 0 N--CA 1.464 0.54 0 N-CA-C 110.652 -0.979 . . . . 0.0 110.652 179.454 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . 0.507 ' H ' ' CB ' ' A' ' 139' ' ' SER . 5.7 pt-20 -101.89 135.87 42.7 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-O 120.434 0.159 . . . . 0.0 110.801 -179.381 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -55.05 145.62 20.18 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 120.599 -0.441 . . . . 0.0 110.258 179.384 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -167.13 159.31 12.87 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.881 -179.999 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 48.0 tttp -88.58 32.18 0.8 Allowed 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.209 179.682 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 5.8 t -157.8 150.46 22.75 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.613 179.677 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -79.67 -35.98 38.36 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.054 179.619 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -56.45 -55.12 37.61 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.005 -178.926 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 4.3 tp -65.18 -40.4 94.22 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.269 -179.724 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -55.84 -54.44 44.56 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.501 -179.221 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -60.69 -40.25 91.51 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.897 0.38 . . . . 0.0 110.335 -179.593 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 51.4 ttp -60.16 -48.45 81.68 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.296 -179.722 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . 0.507 ' CB ' ' H ' ' A' ' 128' ' ' GLU . 57.1 m -60.72 -35.47 76.41 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.7 179.92 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -68.82 -49.28 59.8 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.888 0.375 . . . . 0.0 110.825 179.727 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -60.07 -25.61 65.52 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.645 -179.559 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 30.7 mmtm -68.04 -43.33 78.98 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.87 179.311 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 143' ' ' VAL . . . . . 0.519 HG21 ' O ' ' A' ' 126' ' ' SER . 3.3 t -62.39 -45.42 98.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.576 -179.116 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -63.12 -49.14 75.58 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-O 120.875 0.369 . . . . 0.0 111.012 -179.755 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 145' ' ' PHE . . . . . . . . . . . . . 49.7 t80 -61.53 -44.52 96.9 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.84 -179.367 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 146' ' ' MET . . . . . . . . . . . . . 72.6 mmm -64.36 -40.26 95.5 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.794 0.33 . . . . 0.0 110.883 -179.537 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 16.3 m -69.78 -41.85 74.58 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.935 179.934 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 148' ' ' ILE . . . . . . . . . . . . . 48.1 mt -56.49 -32.58 36.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.369 -179.78 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 55.4 mtpt -61.74 -41.98 98.37 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 120.618 -0.433 . . . . 0.0 110.486 -179.989 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 150' ' ' ASN . . . . . . . . . . . . . 99.0 m-20 -63.44 -40.61 97.6 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.475 179.857 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.701 0 CA-C-O 117.919 -1.489 . . . . 0.0 110.868 179.856 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 4.2 m . . . . . 0 N--CA 1.492 1.663 0 N-CA-C 109.315 -0.624 . . . . 0.0 109.315 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.482 ' C ' ' N ' ' A' ' 84' ' ' LYS . . . -154.13 96.57 1.96 Allowed 'General case' 0 N--CA 1.449 -0.504 0 CA-C-O 121.167 0.508 . . . . 0.0 110.155 -179.882 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 2.2 m-85 -46.61 -16.04 0.03 OUTLIER 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.033 179.605 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.482 ' N ' ' C ' ' A' ' 82' ' ' ALA . 68.6 mttm -65.06 -42.37 94.27 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.004 179.604 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 89.9 m-20 -63.72 -45.77 88.46 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.478 -179.66 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 6.4 tt -61.98 -41.55 98.15 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.793 -179.741 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.57 HD23 HD11 ' A' ' 90' ' ' ILE . 37.6 mt -56.76 -37.04 70.52 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.115 -179.618 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 88.1 mt-30 -71.97 -32.68 67.51 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.415 179.737 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 78.5 mm-40 -65.01 -46.6 80.72 Favored 'General case' 0 CA--C 1.522 -0.102 0 C-N-CA 120.761 -0.375 . . . . 0.0 111.087 -179.048 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.57 HD11 HD23 ' A' ' 87' ' ' LEU . 18.1 pt -65.2 -44.45 95.25 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.703 -179.804 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . 0.504 ' O ' ' N ' ' A' ' 95' ' ' SER . . . -68.14 -47.77 67.18 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.538 -179.446 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 58.3 tt0 -64.78 -46.25 82.87 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.689 -179.809 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 66.3 tttm -61.67 -47.17 86.55 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.675 -179.923 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 80.9 mm-40 -92.94 8.47 39.65 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.408 -179.953 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . 0.504 ' N ' ' O ' ' A' ' 91' ' ' ALA . 5.9 p 41.14 42.67 1.71 Allowed 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 120.848 0.356 . . . . 0.0 110.497 -179.882 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 18.7 p -92.74 39.43 1.04 Allowed 'General case' 0 CA--C 1.513 -0.466 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.788 -179.518 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 43.3 mt 69.4 100.4 0.06 Allowed 'General case' 0 CA--C 1.52 -0.21 0 O-C-N 123.451 0.469 . . . . 0.0 110.907 179.888 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 10.0 mp -44.85 155.06 0.41 Allowed Pre-proline 0 N--CA 1.452 -0.34 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.676 179.852 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_endo -64.8 170.17 10.49 Favored 'Trans proline' 0 C--N 1.305 -1.713 0 C-N-CA 122.791 2.328 . . . . 0.0 111.901 179.529 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 36.9 t80 -144.97 116.79 8.22 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.446 178.966 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 98.5 m-85 -98.77 131.95 44.51 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.918 0.39 . . . . 0.0 110.287 179.976 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -141.63 143.17 33.5 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.357 179.842 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 95.9 m -123.1 128.77 50.56 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.316 179.954 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -105.2 134.41 48.35 Favored 'General case' 0 CA--C 1.522 -0.108 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.271 179.714 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 19.4 p -115.21 123.95 50.16 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-O 120.897 0.379 . . . . 0.0 110.463 179.828 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 35.1 t -167.41 151.96 6.89 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.352 179.945 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 132.69 168.43 11.99 Favored Glycine 0 CA--C 1.522 0.491 0 N-CA-C 110.934 -0.867 . . . . 0.0 110.934 179.714 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 22.0 Cg_endo -61.46 151.38 80.12 Favored 'Trans proline' 0 C--N 1.303 -1.825 0 C-N-CA 122.814 2.342 . . . . 0.0 112.122 179.421 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 5.9 m -65.04 -17.42 64.44 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.031 -0.532 . . . . 0.0 110.254 179.395 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 93.4 m-70 -90.83 -41.91 10.94 Favored 'General case' 0 CA--C 1.52 -0.203 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.441 179.817 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -124.36 77.85 61.47 Favored Pre-proline 0 CA--C 1.531 0.248 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.356 179.508 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 112' ' ' PRO . . . . . 0.48 ' O ' HG23 ' A' ' 113' ' ' THR . 61.3 Cg_endo -76.46 160.72 35.13 Favored 'Trans proline' 0 C--N 1.304 -1.801 0 C-N-CA 122.681 2.254 . . . . 0.0 112.492 179.884 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . 0.48 HG23 ' O ' ' A' ' 112' ' ' PRO . 24.5 p -155.8 150.3 25.95 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.56 179.423 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -132.59 146.05 51.59 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.352 179.98 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 91.6 m -126.12 121.33 32.56 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 116.175 -0.466 . . . . 0.0 109.878 179.197 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 10.4 p -95.76 121.75 37.81 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.601 179.927 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 52.6 m -115.77 130.67 56.94 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.044 179.944 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 9.8 p -112.59 143.79 21.62 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.267 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.208 179.994 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 84.0 tt0 -129.59 138.07 51.06 Favored 'General case' 0 CA--C 1.52 -0.189 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.632 -179.98 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . 0.627 ' CZ ' ' CE1' ' A' ' 125' ' ' PHE . 49.9 p90 -170.19 160.32 7.86 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.527 179.5 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 52.35 19.11 1.04 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.883 0.373 . . . . 0.0 110.559 179.419 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 79.55 20.37 69.04 Favored Glycine 0 CA--C 1.522 0.487 0 N-CA-C 111.353 -0.699 . . . . 0.0 111.353 179.697 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -131.9 150.8 52.05 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.661 0.267 . . . . 0.0 110.384 -179.96 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . 0.47 ' O ' HG13 ' A' ' 124' ' ' VAL . 7.8 p -119.59 126.41 75.3 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.312 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.972 -179.848 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 125' ' ' PHE . . . . . 0.627 ' CE1' ' CZ ' ' A' ' 120' ' ' PHE . 33.6 m-85 -110.83 118.2 35.49 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.112 179.805 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 11.3 p -76.64 125.25 28.92 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.479 -179.863 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -78.31 -172.67 40.67 Favored Glycine 0 CA--C 1.525 0.666 0 N-CA-C 110.904 -0.878 . . . . 0.0 110.904 179.914 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 18.9 mm-40 -79.62 169.81 17.46 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.649 0.262 . . . . 0.0 110.813 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . 0.547 ' CD ' ' H ' ' A' ' 129' ' ' GLU . 1.3 pm0 -109.33 139.17 44.62 Favored 'General case' 0 N--CA 1.464 0.262 0 N-CA-C 109.721 -0.474 . . . . 0.0 109.721 179.516 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -173.2 169.54 4.52 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.729 -179.994 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 22.6 pttp -86.86 36.34 0.72 Allowed 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.282 178.598 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 1.7 t -154.39 147.75 24.98 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.972 0.415 . . . . 0.0 110.665 -179.854 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -84.08 -25.61 29.66 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.027 179.594 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -66.22 -49.33 67.61 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.32 -178.496 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 4.2 tp -65.18 -42.59 93.49 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.573 -179.296 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -62.81 -54.92 31.52 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.391 -179.125 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -57.31 -46.24 83.41 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.739 0.304 . . . . 0.0 110.572 -179.965 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 36.8 ttm -62.98 -39.34 94.41 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.259 -179.969 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 37.5 m -63.01 -38.85 92.86 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.831 179.8 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -62.4 -40.62 97.1 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.622 -179.909 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -68.38 -27.15 65.98 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.911 -179.807 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 92.6 mttt -72.12 -51.1 23.03 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.802 179.233 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 143' ' ' VAL . . . . . 0.449 HG13 ' N ' ' A' ' 144' ' ' ALA . 7.2 p -66.6 -41.28 88.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.742 -179.625 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 144' ' ' ALA . . . . . 0.449 ' N ' HG13 ' A' ' 143' ' ' VAL . . . -64.07 -46.54 83.88 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.59 -179.798 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 145' ' ' PHE . . . . . . . . . . . . . 71.2 t80 -60.52 -42.66 96.89 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.41 -179.74 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 146' ' ' MET . . . . . 0.451 ' C ' ' SD ' ' A' ' 146' ' ' MET . 14.9 tmm? -61.63 -38.66 88.49 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.8 -179.742 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 6.8 t -69.22 -44.58 71.74 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.916 0.389 . . . . 0.0 110.976 179.874 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 148' ' ' ILE . . . . . . . . . . . . . 86.4 mt -56.17 -31.1 31.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.737 -179.466 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 55.0 mtpt -62.26 -42.29 99.2 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.69 -179.939 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 150' ' ' ASN . . . . . . . . . . . . . 62.3 t30 -94.8 103.73 15.63 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.436 -179.917 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.776 0 CA-C-O 118.041 -1.422 . . . . 0.0 110.924 -179.968 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 35.6 m . . . . . 0 N--CA 1.492 1.626 0 N-CA-C 109.43 -0.582 . . . . 0.0 109.43 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.48 ' C ' ' N ' ' A' ' 84' ' ' LYS . . . -153.67 95.95 1.95 Allowed 'General case' 0 N--CA 1.449 -0.504 0 CA-C-O 121.26 0.552 . . . . 0.0 110.026 179.795 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -46.68 -16.3 0.03 OUTLIER 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.71 -0.677 . . . . 0.0 109.831 179.674 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.48 ' N ' ' C ' ' A' ' 82' ' ' ALA . 68.6 mttm -63.89 -41.98 97.57 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.953 179.709 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 65.7 t30 -66.38 -46.44 76.69 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.599 179.91 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 2.6 tp -60.59 -42.69 97.25 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.374 -179.482 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.442 HD23 HD11 ' A' ' 90' ' ' ILE . 34.1 mt -56.54 -34.81 67.42 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.152 -179.497 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 99.2 mt-30 -71.74 -35.58 70.17 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.42 179.38 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 94.9 mt-10 -61.7 -48.95 78.44 Favored 'General case' 0 C--O 1.231 0.09 0 CA-C-O 120.913 0.387 . . . . 0.0 111.107 -178.887 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.442 HD11 HD23 ' A' ' 87' ' ' LEU . 21.8 pt -62.3 -36.76 76.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.506 -179.929 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -58.18 -47.6 82.91 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.572 -179.518 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 76.1 mm-40 -64.55 -49.09 72.59 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.707 179.973 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 19.3 tptm -62.18 -48.07 81.68 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.724 -179.457 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -71.88 -15.37 62.11 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.429 -179.984 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 1.9 p 74.54 15.52 3.36 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.473 -179.723 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 11.2 p -84.26 161.91 20.32 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.676 -179.984 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 60.2 mt -61.62 124.68 21.37 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.493 -179.948 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.617 ' N ' HD12 ' A' ' 98' ' ' LEU . 9.4 mp -49.09 147.93 4.55 Favored Pre-proline 0 C--N 1.326 -0.436 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.706 -179.513 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_endo -68.45 140.11 47.08 Favored 'Trans proline' 0 C--N 1.311 -1.405 0 C-N-CA 122.508 2.138 . . . . 0.0 112.009 179.452 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 85.9 t80 -132.36 133.84 44.46 Favored 'General case' 0 CA--C 1.517 -0.322 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 179.819 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 45.0 m-85 -103.35 149.32 24.87 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.35 -179.303 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -152.27 93.5 1.82 Allowed 'General case' 0 C--O 1.234 0.265 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.175 179.883 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . 0.433 ' H ' HG22 ' A' ' 103' ' ' THR . 0.0 OUTLIER -70.93 138.95 50.5 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.178 179.848 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -126.59 152.77 46.18 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.209 179.945 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 43.4 p -105.93 134.6 48.79 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-O 120.819 0.342 . . . . 0.0 110.414 179.798 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 51.0 p -161.7 161.0 29.24 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.229 179.902 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 116.83 -176.9 16.49 Favored Glycine 0 CA--C 1.523 0.584 0 N-CA-C 110.889 -0.884 . . . . 0.0 110.889 179.789 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -62.43 152.59 76.19 Favored 'Trans proline' 0 C--N 1.307 -1.644 0 C-N-CA 122.627 2.218 . . . . 0.0 112.298 -179.717 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 78.7 p -67.66 -15.35 63.6 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 109.46 -0.57 . . . . 0.0 109.46 178.833 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 77.2 m80 -90.13 -43.76 10.24 Favored 'General case' 0 CA--C 1.519 -0.242 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.546 179.981 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -124.89 78.67 65.2 Favored Pre-proline 0 N--CA 1.462 0.17 0 CA-C-N 116.018 -0.537 . . . . 0.0 109.636 179.011 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -82.0 126.91 5.22 Favored 'Trans proline' 0 C--N 1.306 -1.686 0 C-N-CA 122.467 2.112 . . . . 0.0 112.168 -179.716 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 3.9 p -108.16 172.9 6.57 Favored 'General case' 0 CA--C 1.516 -0.339 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.078 179.756 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 1.2 m-85 -131.1 145.46 52.0 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.448 -179.743 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 89.7 m -128.98 123.8 33.37 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.035 179.368 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . 0.414 ' OG ' ' O ' ' A' ' 136' ' ' ALA . 93.6 p -92.06 119.37 31.69 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.731 -179.865 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 91.2 m -106.22 123.54 48.2 Favored 'General case' 0 N--CA 1.465 0.301 0 N-CA-C 109.991 -0.374 . . . . 0.0 109.991 179.921 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 7.5 p -109.7 137.81 40.15 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.301 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.144 -179.946 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 82.8 tt0 -123.47 131.29 53.6 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.707 -179.907 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . 0.626 ' CZ ' ' CE1' ' A' ' 125' ' ' PHE . 47.2 p90 -166.53 157.34 12.49 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.428 179.504 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 53.93 21.72 2.98 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.915 0.388 . . . . 0.0 110.494 179.667 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 75.45 21.51 77.28 Favored Glycine 0 CA--C 1.522 0.499 0 N-CA-C 111.024 -0.83 . . . . 0.0 111.024 -179.991 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -132.51 152.95 51.39 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.536 0.208 . . . . 0.0 110.509 179.944 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . 0.471 ' O ' HG13 ' A' ' 124' ' ' VAL . 12.0 p -122.49 128.27 75.33 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.232 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.776 -179.914 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 125' ' ' PHE . . . . . 0.626 ' CE1' ' CZ ' ' A' ' 120' ' ' PHE . 25.5 m-85 -114.02 123.46 49.75 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.257 179.673 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 96.0 p -83.29 137.36 34.02 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.531 -179.912 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -85.12 -171.48 48.28 Favored Glycine 0 CA--C 1.521 0.424 0 N-CA-C 110.711 -0.955 . . . . 0.0 110.711 179.93 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . 0.42 ' O ' ' CG ' ' A' ' 128' ' ' GLU . 9.7 pt-20 -92.74 127.57 38.29 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-O 121.003 0.43 . . . . 0.0 110.858 -179.823 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . 0.602 ' CD ' ' H ' ' A' ' 129' ' ' GLU . 1.2 pm0 -54.64 145.34 19.3 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 121.066 0.46 . . . . 0.0 110.695 179.305 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -171.66 163.15 6.53 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.645 179.884 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 51.8 tttm -89.2 33.91 0.8 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.986 0.422 . . . . 0.0 110.301 179.447 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -154.43 143.05 20.77 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.667 -179.644 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -78.91 -45.65 20.11 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.247 179.938 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 43.9 pttt -53.32 -46.71 69.56 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.539 -179.433 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 4.1 tp -66.69 -42.11 87.01 Favored 'General case' 0 N--CA 1.443 -0.78 0 CA-C-O 120.741 0.305 . . . . 0.0 110.942 -179.756 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 136' ' ' ALA . . . . . 0.414 ' O ' ' OG ' ' A' ' 116' ' ' SER . . . -59.55 -51.96 67.62 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.48 -179.381 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 95.6 mt-10 -55.77 -44.0 77.26 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.384 -179.667 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 47.9 ttp -61.54 -42.54 98.97 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.266 -179.739 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 23.3 m -63.16 -39.01 93.43 Favored 'General case' 0 CA--C 1.519 -0.221 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.954 -179.841 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -64.27 -44.89 90.32 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.009 0.433 . . . . 0.0 110.589 -179.788 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -72.16 -24.17 61.39 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.389 179.934 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 63.4 tttp -71.11 -48.89 49.68 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.293 179.867 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 7.5 p -68.34 -37.75 78.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.698 -179.734 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -62.9 -44.59 95.67 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.781 -179.544 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 145' ' ' PHE . . . . . . . . . . . . . 60.6 t80 -59.9 -43.12 95.02 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.739 -179.39 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 146' ' ' MET . . . . . . . . . . . . . 47.1 ttp -61.26 -39.43 90.34 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.732 0.301 . . . . 0.0 110.848 -179.242 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 12.2 t -67.44 -44.62 78.25 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.966 -179.999 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 148' ' ' ILE . . . . . . . . . . . . . 91.4 mt -56.22 -33.47 37.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.695 -179.665 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 56.0 mtpt -61.8 -40.88 96.77 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.797 -179.929 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 150' ' ' ASN . . . . . . . . . . . . . 60.8 t30 -84.66 109.26 17.87 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.413 -179.82 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.221 -0.71 0 CA-C-O 117.971 -1.461 . . . . 0.0 110.911 179.973 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 6.7 t . . . . . 0 N--CA 1.49 1.57 0 N-CA-C 109.476 -0.565 . . . . 0.0 109.476 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.481 ' C ' ' N ' ' A' ' 84' ' ' LYS . . . -154.31 95.75 1.85 Allowed 'General case' 0 N--CA 1.449 -0.483 0 CA-C-O 121.075 0.464 . . . . 0.0 110.086 179.993 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 -46.7 -16.06 0.03 OUTLIER 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.027 179.533 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.481 ' N ' ' C ' ' A' ' 82' ' ' ALA . 99.4 mttt -64.72 -41.07 96.25 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.844 -0.617 . . . . 0.0 110.125 179.69 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 14.3 m120 -66.71 -47.2 73.1 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.692 -179.823 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 5.8 tt -60.82 -42.96 98.72 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.723 -179.406 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.432 HD23 HD11 ' A' ' 90' ' ' ILE . 33.8 mt -55.86 -35.23 66.22 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.259 -179.56 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 88.8 mt-30 -70.71 -34.0 71.45 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.303 179.459 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 80.9 mm-40 -63.95 -49.98 70.42 Favored 'General case' 0 C--O 1.231 0.098 0 C-N-CA 120.608 -0.437 . . . . 0.0 111.188 -178.807 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.432 HD11 HD23 ' A' ' 87' ' ' LEU . 30.8 pt -63.37 -35.39 72.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.515 179.982 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -58.53 -48.88 79.38 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.666 -179.187 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 87.6 mt-30 -66.09 -43.94 85.83 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.776 179.932 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 88.9 tttt -63.47 -48.32 78.14 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.478 -179.84 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 98.4 mt-10 -72.87 -10.11 59.44 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.31 -179.937 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 2.0 p 74.08 8.53 4.7 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.462 -179.881 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 10.0 p -77.66 164.14 25.57 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.322 179.93 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.589 ' N ' HD12 ' A' ' 97' ' ' LEU . 9.6 mp -68.31 128.23 35.81 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.981 0.42 . . . . 0.0 110.422 -179.555 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.549 ' N ' HD12 ' A' ' 98' ' ' LEU . 10.7 mp -46.39 148.54 1.6 Allowed Pre-proline 0 N--CA 1.448 -0.54 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.822 -179.846 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_endo -69.02 140.3 45.08 Favored 'Trans proline' 0 C--N 1.311 -1.42 0 C-N-CA 122.649 2.232 . . . . 0.0 112.072 179.834 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 49.9 t80 -132.27 132.39 42.99 Favored 'General case' 0 C--O 1.235 0.338 0 N-CA-C 109.696 -0.483 . . . . 0.0 109.696 179.823 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 33.7 m-85 -101.94 149.08 24.58 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.755 -179.578 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -142.27 91.38 2.33 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-O 120.991 0.424 . . . . 0.0 111.349 179.918 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 43.6 m -71.52 133.19 45.64 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.085 179.655 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -138.17 161.31 37.16 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 110.136 -0.32 . . . . 0.0 110.136 -179.969 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 37.4 p -100.72 134.96 42.91 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-O 120.906 0.384 . . . . 0.0 110.508 179.743 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 34.1 p -160.75 163.64 32.15 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.473 -179.899 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 119.83 -165.13 13.49 Favored Glycine 0 CA--C 1.526 0.723 0 N-CA-C 111.128 -0.789 . . . . 0.0 111.128 179.583 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . 0.443 ' HG2' ' HB3' ' A' ' 111' ' ' ALA . 47.3 Cg_endo -70.2 150.72 65.96 Favored 'Trans proline' 0 C--N 1.306 -1.668 0 C-N-CA 122.61 2.207 . . . . 0.0 112.453 -179.422 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 77.8 p -68.47 -20.02 64.59 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.243 178.729 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 73.0 m80 -85.23 -37.88 19.58 Favored 'General case' 0 CA--C 1.518 -0.251 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.413 179.706 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . 0.511 ' HB1' ' HE2' ' A' ' 131' ' ' LYS . . . -126.91 78.29 73.96 Favored Pre-proline 0 N--CA 1.465 0.291 0 CA-C-O 121.18 0.515 . . . . 0.0 110.396 178.76 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -62.63 122.46 10.82 Favored 'Trans proline' 0 C--N 1.301 -1.966 0 C-N-CA 122.315 2.01 . . . . 0.0 112.367 -179.693 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 40.8 p -111.69 173.96 6.1 Favored 'General case' 0 CA--C 1.515 -0.391 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.198 179.638 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 1.6 m-85 -130.28 144.37 51.33 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.506 -179.579 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 86.1 m -131.26 127.55 38.03 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.479 179.514 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 10.5 t -97.73 122.01 40.31 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.419 -179.934 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 98.5 m -107.78 127.7 53.94 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.183 -179.95 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 7.4 p -111.82 139.24 37.16 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.303 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.239 -179.945 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 84.1 tt0 -124.27 131.21 53.51 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.53 179.736 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . 0.612 ' CZ ' ' CE1' ' A' ' 125' ' ' PHE . 45.2 p90 -167.84 159.1 11.31 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.177 179.249 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 54.57 20.84 3.05 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.145 0.498 . . . . 0.0 109.767 -179.908 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 72.73 23.56 77.68 Favored Glycine 0 CA--C 1.521 0.448 0 N-CA-C 110.937 -0.865 . . . . 0.0 110.937 -179.77 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 62.9 mttp -132.6 152.25 51.69 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.587 0.232 . . . . 0.0 110.382 -179.884 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . 0.491 ' O ' HG13 ' A' ' 124' ' ' VAL . 12.7 p -120.19 127.26 75.89 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.167 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.926 -179.742 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 125' ' ' PHE . . . . . 0.612 ' CE1' ' CZ ' ' A' ' 120' ' ' PHE . 39.2 m-85 -112.74 119.88 39.57 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.079 179.312 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 6.8 m -82.26 138.43 34.6 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.638 -179.998 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -86.65 -168.21 44.56 Favored Glycine 0 CA--C 1.523 0.532 0 N-CA-C 110.646 -0.981 . . . . 0.0 110.646 179.724 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . 0.414 ' H ' ' CB ' ' A' ' 139' ' ' SER . 9.1 pt-20 -98.87 133.26 43.41 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.819 0.342 . . . . 0.0 110.522 -179.87 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -57.33 148.09 23.93 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.072 0.463 . . . . 0.0 110.545 179.068 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -170.78 162.74 7.72 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.811 179.818 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . 0.511 ' HE2' ' HB1' ' A' ' 111' ' ' ALA . 97.2 mttt -88.35 32.79 0.76 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.369 179.22 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 3.1 t -158.43 151.4 22.56 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.741 179.877 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 68.9 mttm -81.56 -36.32 29.22 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.083 0.468 . . . . 0.0 110.442 179.508 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 30.7 mmtp -53.42 -54.28 39.08 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.828 -178.979 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 4.4 tp -64.89 -40.5 95.2 Favored 'General case' 0 N--CA 1.446 -0.639 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.066 -179.906 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -55.64 -54.63 41.81 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.659 -179.172 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 97.3 mt-10 -60.96 -40.01 91.73 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.733 0.302 . . . . 0.0 110.404 -179.458 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 48.2 ttp -62.48 -46.68 87.35 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.735 -179.595 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . 0.414 ' CB ' ' H ' ' A' ' 128' ' ' GLU . 68.8 m -61.95 -39.07 90.85 Favored 'General case' 0 CA--C 1.518 -0.269 0 CA-C-N 116.554 -0.294 . . . . 0.0 110.965 -179.356 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -63.66 -46.05 87.37 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.981 0.419 . . . . 0.0 110.563 -179.879 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -72.35 -23.5 61.15 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.563 -179.973 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 66.2 tttm -70.35 -48.63 55.53 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.054 0.454 . . . . 0.0 111.428 179.713 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 6.9 p -67.94 -36.41 75.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.614 -179.631 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -64.07 -45.01 90.64 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.614 -179.334 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 145' ' ' PHE . . . . . . . . . . . . . 62.1 t80 -60.46 -41.92 95.13 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.505 -179.615 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 146' ' ' MET . . . . . . . . . . . . . 47.9 ttp -63.74 -40.04 95.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.689 -179.648 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 67.8 m -68.27 -43.64 77.35 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.913 -179.885 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 148' ' ' ILE . . . . . . . . . . . . . 78.5 mt -55.77 -31.85 30.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.704 -179.686 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 54.3 mtpt -62.43 -39.39 93.15 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.462 179.85 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 150' ' ' ASN . . . . . . . . . . . . . 98.8 m-20 -64.33 -39.83 94.67 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.362 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.221 -0.703 0 CA-C-O 118.028 -1.429 . . . . 0.0 110.941 -179.862 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 12.7 p . . . . . 0 N--CA 1.489 1.503 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.483 ' C ' ' N ' ' A' ' 84' ' ' LYS . . . -153.82 96.34 1.97 Allowed 'General case' 0 N--CA 1.45 -0.461 0 CA-C-O 121.245 0.545 . . . . 0.0 109.968 -179.913 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -47.48 -15.99 0.06 Allowed 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.616 -0.72 . . . . 0.0 109.777 179.633 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.483 ' N ' ' C ' ' A' ' 82' ' ' ALA . 99.3 mttt -64.59 -41.84 95.98 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.038 179.958 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 57.0 t-20 -65.01 -46.47 81.27 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.615 -179.625 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 5.8 tt -61.21 -41.8 97.48 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.896 -179.665 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.485 HD23 HD11 ' A' ' 90' ' ' ILE . 34.9 mt -57.01 -37.18 71.33 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.223 -0.444 . . . . 0.0 109.939 -179.565 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 87.0 mt-30 -71.29 -34.78 70.96 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.413 179.395 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -63.0 -46.6 86.89 Favored 'General case' 0 N--CA 1.462 0.158 0 C-N-CA 120.727 -0.389 . . . . 0.0 111.412 -179.163 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.485 HD11 HD23 ' A' ' 87' ' ' LEU . 17.5 pt -64.93 -44.15 96.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.891 -179.876 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . 0.474 ' O ' ' N ' ' A' ' 95' ' ' SER . . . -67.21 -47.68 70.15 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.955 -179.643 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 52.0 tt0 -66.85 -45.08 79.31 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.83 -179.921 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 88.9 tttt -62.87 -46.98 85.32 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.577 -179.865 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 70.0 mm-40 -90.85 2.1 56.42 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.328 -179.645 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . 0.474 ' N ' ' O ' ' A' ' 91' ' ' ALA . 3.2 t 40.99 78.01 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.488 179.911 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . 0.416 ' O ' ' CB ' ' A' ' 97' ' ' LEU . 67.0 p -136.44 38.59 2.68 Favored 'General case' 0 CA--C 1.513 -0.462 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.485 -179.702 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.416 ' CB ' ' O ' ' A' ' 96' ' ' SER . 3.2 tp 78.15 94.47 0.06 Allowed 'General case' 0 N--CA 1.454 -0.254 0 CA-C-O 120.896 0.379 . . . . 0.0 111.026 179.514 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.544 ' N ' HD12 ' A' ' 98' ' ' LEU . 10.8 mp -44.99 148.8 0.93 Allowed Pre-proline 0 C--N 1.326 -0.428 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.484 -179.784 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_endo -68.99 138.3 39.94 Favored 'Trans proline' 0 N--CA 1.495 1.591 0 C-N-CA 122.53 2.154 . . . . 0.0 112.174 -179.879 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 90.8 t80 -125.56 127.32 46.19 Favored 'General case' 0 CA--C 1.513 -0.463 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 179.991 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 92.8 m-85 -93.78 141.26 28.7 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.5 -179.182 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -136.7 138.0 40.57 Favored 'General case' 0 CA--C 1.514 -0.424 0 N-CA-C 110.064 -0.347 . . . . 0.0 110.064 179.619 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 25.2 m -120.31 126.6 50.94 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.455 -179.963 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -127.31 153.57 46.01 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.092 179.654 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 33.7 p -102.69 133.41 47.77 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-O 120.879 0.371 . . . . 0.0 110.196 179.836 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 50.8 p -162.7 166.36 24.51 Favored 'General case' 0 CA--C 1.515 -0.403 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.273 -179.745 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 120.58 -163.2 14.26 Favored Glycine 0 CA--C 1.527 0.79 0 N-CA-C 111.153 -0.779 . . . . 0.0 111.153 179.572 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 40.9 Cg_endo -69.53 147.42 64.28 Favored 'Trans proline' 0 N--CA 1.494 1.533 0 C-N-CA 122.59 2.193 . . . . 0.0 112.335 -179.324 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 78.8 p -68.5 -16.69 63.97 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.848 179.092 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 95.8 m-70 -86.01 -41.32 14.94 Favored 'General case' 0 CA--C 1.516 -0.364 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.181 179.998 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -126.96 78.33 74.11 Favored Pre-proline 0 N--CA 1.467 0.418 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.264 178.562 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_exo -59.92 125.68 18.33 Favored 'Trans proline' 0 C--N 1.304 -1.78 0 C-N-CA 122.465 2.11 . . . . 0.0 112.395 -179.693 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 69.1 p -111.57 173.83 6.16 Favored 'General case' 0 CA--C 1.514 -0.416 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.097 179.825 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 -132.1 146.66 52.19 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.651 -179.714 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 86.4 m -129.55 124.38 33.72 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.023 179.446 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 60.3 m -94.75 121.93 36.85 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.538 -179.953 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . 0.427 ' CG2' ' CG2' ' A' ' 124' ' ' VAL . 81.3 m -112.92 127.29 56.16 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.218 -179.891 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 11.9 p -112.89 144.91 19.62 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.23 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.015 -179.792 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 82.9 tt0 -126.28 133.03 51.54 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.695 -179.867 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . 0.628 ' CZ ' ' CE1' ' A' ' 125' ' ' PHE . 48.7 p90 -166.73 157.96 12.59 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.508 179.478 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 53.38 19.98 1.81 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.871 0.367 . . . . 0.0 110.755 179.599 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 77.51 21.43 72.48 Favored Glycine 0 CA--C 1.524 0.655 0 N-CA-C 111.131 -0.788 . . . . 0.0 111.131 179.872 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -132.67 152.04 51.8 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 110.198 -0.297 . . . . 0.0 110.198 179.917 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . 0.49 ' O ' HG13 ' A' ' 124' ' ' VAL . 13.1 p -120.69 127.69 75.96 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.301 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.861 -179.804 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 125' ' ' PHE . . . . . 0.628 ' CE1' ' CZ ' ' A' ' 120' ' ' PHE . 53.0 m-85 -113.08 120.12 40.2 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.159 179.879 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 72.0 m -83.32 138.78 33.4 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.468 179.955 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -85.0 -169.38 45.92 Favored Glycine 0 CA--C 1.52 0.379 0 N-CA-C 110.591 -1.004 . . . . 0.0 110.591 179.871 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . 0.428 ' H ' ' CB ' ' A' ' 139' ' ' SER . 6.6 pt-20 -97.34 132.99 42.54 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-O 120.839 0.352 . . . . 0.0 110.95 -179.711 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 98.1 mt-10 -55.38 146.0 20.8 Favored 'General case' 0 C--N 1.32 -0.717 0 C-N-CA 120.508 -0.477 . . . . 0.0 110.484 179.522 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -169.53 160.4 9.04 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.524 -179.997 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 29.3 ttpt -91.12 32.48 1.02 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.044 0.449 . . . . 0.0 110.479 179.789 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -151.49 140.9 21.51 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.573 -179.75 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 28.6 ttmt -74.66 -47.08 33.86 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.352 179.885 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . 0.404 ' HG3' ' N ' ' A' ' 135' ' ' LEU . 47.1 pttt -53.7 -46.22 70.66 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.509 -179.252 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . 0.404 ' N ' ' HG3' ' A' ' 134' ' ' LYS . 4.7 tp -65.32 -39.44 92.45 Favored 'General case' 0 N--CA 1.444 -0.768 0 CA-C-O 120.811 0.338 . . . . 0.0 110.977 -179.678 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -57.68 -52.06 66.97 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.745 -179.311 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 69.9 mm-40 -57.85 -41.26 82.02 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.866 0.365 . . . . 0.0 110.608 -179.75 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 94.8 mtp -63.81 -41.39 97.88 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.575 -179.789 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . 0.428 ' CB ' ' H ' ' A' ' 128' ' ' GLU . 15.2 m -64.05 -39.2 93.54 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-N 116.544 -0.298 . . . . 0.0 110.72 -179.687 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -65.69 -44.38 86.36 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.819 -179.896 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -71.74 -24.79 61.84 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.568 179.983 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 38.1 ttmt -71.24 -48.56 50.39 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.201 179.773 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 143' ' ' VAL . . . . . 0.401 HG13 ' N ' ' A' ' 144' ' ' ALA . 7.1 p -70.11 -37.81 73.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.799 -179.626 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 144' ' ' ALA . . . . . 0.401 ' N ' HG13 ' A' ' 143' ' ' VAL . . . -63.89 -47.08 82.06 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-O 120.838 0.352 . . . . 0.0 110.801 -179.764 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 145' ' ' PHE . . . . . . . . . . . . . 63.7 t80 -60.55 -43.47 97.19 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.795 179.935 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 146' ' ' MET . . . . . . . . . . . . . 63.9 ttp -60.24 -38.64 84.05 Favored 'General case' 0 C--N 1.327 -0.407 0 O-C-N 123.331 0.394 . . . . 0.0 111.077 -179.433 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 48.8 m -72.26 -42.61 65.4 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.165 179.81 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 148' ' ' ILE . . . . . . . . . . . . . 71.9 mt -54.87 -25.33 15.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.63 -179.695 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 36.6 mtmt -59.31 -41.24 88.57 Favored 'General case' 0 C--N 1.319 -0.728 0 C-N-CA 120.573 -0.451 . . . . 0.0 110.556 -179.617 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 150' ' ' ASN . . . . . . . . . . . . . 9.7 m120 -63.68 -40.62 97.28 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.591 179.85 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.67 0 CA-C-O 117.912 -1.493 . . . . 0.0 110.9 -179.934 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 20.3 m . . . . . 0 N--CA 1.49 1.536 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.481 ' O ' ' N ' ' A' ' 84' ' ' LYS . . . -154.04 95.75 1.88 Allowed 'General case' 0 N--CA 1.45 -0.45 0 CA-C-O 120.895 0.379 . . . . 0.0 110.379 179.85 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 -46.63 -15.83 0.03 OUTLIER 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.203 179.509 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.481 ' N ' ' O ' ' A' ' 82' ' ' ALA . 63.8 mttp -64.45 -41.64 96.43 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.182 179.311 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 14.6 m120 -65.29 -47.14 77.68 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.522 -179.33 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 7.0 tt -59.74 -43.65 94.16 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.692 -179.126 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.454 HD23 HD11 ' A' ' 90' ' ' ILE . 59.0 mt -55.93 -35.56 66.76 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.523 -179.937 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 88.9 mt-30 -70.84 -34.98 72.24 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.425 179.496 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -63.78 -48.12 78.22 Favored 'General case' 0 C--O 1.23 0.054 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.001 -178.794 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.454 HD11 HD23 ' A' ' 87' ' ' LEU . 29.8 pt -66.48 -35.09 74.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.606 179.919 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -58.05 -49.65 76.17 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.36 -179.398 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 56.8 tt0 -65.19 -44.26 88.96 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.707 -179.656 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 65.2 tttm -63.43 -47.15 83.12 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.557 -179.938 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -76.47 -0.45 23.0 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.351 -179.825 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 3.9 t 65.49 7.4 4.33 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.653 -179.813 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 26.0 m -75.15 158.03 33.69 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.483 -179.93 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.562 ' N ' HD12 ' A' ' 97' ' ' LEU . 10.2 mp -64.39 128.19 34.7 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.398 -179.789 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.574 ' N ' HD12 ' A' ' 98' ' ' LEU . 10.2 mp -50.13 148.02 6.52 Favored Pre-proline 0 N--CA 1.451 -0.396 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.609 179.764 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -71.08 142.96 43.35 Favored 'Trans proline' 0 C--N 1.311 -1.401 0 C-N-CA 122.772 2.314 . . . . 0.0 112.173 179.539 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 74.4 t80 -130.72 132.96 45.66 Favored 'General case' 0 C--O 1.233 0.237 0 N-CA-C 109.809 -0.441 . . . . 0.0 109.809 -179.994 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' TYR . . . . . . . . . . . . . 39.0 m-85 -103.81 149.53 24.96 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.655 -179.734 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -150.02 92.99 1.95 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.924 0.392 . . . . 0.0 111.025 -179.908 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . 0.479 ' H ' HG22 ' A' ' 103' ' ' THR . 0.0 OUTLIER -70.4 136.99 50.07 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.195 179.911 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -128.25 153.32 47.08 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 120.866 0.365 . . . . 0.0 110.244 179.873 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 35.0 p -103.86 135.71 44.89 Favored 'General case' 0 N--CA 1.455 -0.208 0 CA-C-O 120.912 0.387 . . . . 0.0 110.642 179.9 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 24.8 m -163.1 161.81 25.41 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.447 179.987 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 116.68 -175.07 15.55 Favored Glycine 0 CA--C 1.522 0.52 0 N-CA-C 111.035 -0.826 . . . . 0.0 111.035 179.592 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_endo -64.66 152.22 82.72 Favored 'Trans proline' 0 C--N 1.301 -1.962 0 C-N-CA 122.725 2.283 . . . . 0.0 112.251 -179.904 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 78.1 p -66.39 -19.29 65.76 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.351 178.93 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 57.7 t-80 -86.84 -43.65 12.31 Favored 'General case' 0 CA--C 1.52 -0.188 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.541 179.821 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -124.66 77.75 63.9 Favored Pre-proline 0 N--CA 1.463 0.211 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.261 179.19 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -78.94 128.5 8.44 Favored 'Trans proline' 0 C--N 1.305 -1.716 0 C-N-CA 122.595 2.197 . . . . 0.0 112.375 -179.452 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 2.9 p -109.68 173.7 6.2 Favored 'General case' 0 CA--C 1.517 -0.305 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.321 179.485 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -131.25 143.89 50.9 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.526 -179.657 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 88.3 m -127.13 125.5 41.3 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.642 179.489 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 7.3 t -97.27 120.4 37.56 Favored 'General case' 0 CA--C 1.518 -0.258 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.389 -179.958 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 94.9 m -105.93 127.37 53.09 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.163 179.916 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 8.8 p -110.2 137.14 43.82 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.271 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.272 -179.901 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 9.1 tm-20 -124.16 130.42 52.52 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.613 -179.909 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . 0.626 ' CZ ' ' CE1' ' A' ' 125' ' ' PHE . 45.4 p90 -164.93 158.12 16.8 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.566 179.006 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . 53.61 23.42 3.56 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.606 179.819 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 73.85 22.49 78.06 Favored Glycine 0 CA--C 1.521 0.461 0 N-CA-C 110.881 -0.888 . . . . 0.0 110.881 179.874 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -133.25 153.81 51.22 Favored 'General case' 0 CA--C 1.516 -0.337 0 CA-C-O 120.889 0.376 . . . . 0.0 110.606 179.789 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . 0.431 ' O ' HG13 ' A' ' 124' ' ' VAL . 7.2 p -122.2 128.61 75.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.862 -179.75 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 125' ' ' PHE . . . . . 0.626 ' CE1' ' CZ ' ' A' ' 120' ' ' PHE . 26.1 m-85 -113.33 122.33 47.09 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.249 179.408 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 4.8 p -81.97 136.64 35.26 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.512 -179.898 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . -88.86 -170.26 45.23 Favored Glycine 0 CA--C 1.522 0.51 0 N-CA-C 110.785 -0.926 . . . . 0.0 110.785 179.902 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . 0.497 ' H ' ' CB ' ' A' ' 139' ' ' SER . 14.9 tt0 -96.55 133.98 40.34 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-O 120.872 0.368 . . . . 0.0 110.71 179.581 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -58.93 149.39 27.27 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.501 179.209 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -171.17 160.78 6.46 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.613 179.982 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -86.59 33.55 0.64 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.624 179.011 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 4.6 t -158.42 150.82 21.92 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.579 179.833 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . 0.417 ' NZ ' ' OG1' ' A' ' 103' ' ' THR . 68.4 mttm -82.41 -21.85 35.59 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.741 179.66 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -68.92 -54.79 13.52 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.774 -179.106 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 4.3 tp -63.61 -41.67 98.3 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 116.51 -0.314 . . . . 0.0 111.046 -179.635 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -55.46 -54.91 38.0 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.497 -179.365 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -61.01 -38.31 85.64 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.46 179.847 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 48.0 ttp -62.85 -42.7 99.85 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.387 -179.512 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . 0.497 ' CB ' ' H ' ' A' ' 128' ' ' GLU . 63.3 m -65.23 -38.65 91.05 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.893 -179.781 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -63.42 -46.44 86.36 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.962 0.411 . . . . 0.0 110.717 -179.892 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -71.21 -22.98 61.94 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.449 179.95 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 65.7 tttm -71.62 -49.27 41.72 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.327 179.674 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 143' ' ' VAL . . . . . 0.407 HG13 ' N ' ' A' ' 144' ' ' ALA . 6.4 p -67.45 -39.03 81.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.652 -179.4 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 144' ' ' ALA . . . . . 0.407 ' N ' HG13 ' A' ' 143' ' ' VAL . . . -61.96 -44.91 95.77 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.564 -179.3 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 145' ' ' PHE . . . . . . . . . . . . . 60.2 t80 -58.48 -42.74 88.2 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.522 -179.261 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 146' ' ' MET . . . . . . . . . . . . . 56.3 mtt -63.74 -39.62 94.72 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.943 -179.604 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 68.1 m -67.18 -45.69 76.19 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.974 -179.946 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 148' ' ' ILE . . . . . . . . . . . . . 81.5 mt -52.56 -36.24 21.99 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.54 -179.509 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 54.7 mtpt -59.12 -42.75 91.35 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.782 -179.484 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 150' ' ' ASN . . . . . . . . . . . . . 94.6 m-20 -62.93 -40.12 96.68 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.362 179.803 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.743 0 CA-C-O 117.896 -1.502 . . . . 0.0 110.847 179.933 . . . . . . . . 0 0 . 1 stop_ save_