data_2n1v_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 2n1v _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 ' 22' ' ' ILE . . . . . . . . . . . . . 18.3 pt . . . . . 0 N--CA 1.444 -0.729 0 CA-C-O 121.32 0.581 . . . . 0.0 110.356 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.487 ' HG2' ' HG2' ' A' ' 37' ' ' LYS . 50.9 mtmt -111.1 146.31 37.03 Favored 'General case' 0 C--N 1.305 -1.335 0 N-CA-C 109.726 -0.472 . . . . 0.0 109.726 179.756 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.9 mp -139.4 159.44 42.15 Favored 'General case' 0 C--N 1.295 -1.774 0 CA-C-O 121.095 0.474 . . . . 0.0 110.381 173.233 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.446 ' HE2' ' HB3' ' A' ' 25' ' ' LYS . 5.0 tmmm? -129.9 142.67 50.62 Favored 'General case' 0 N--CA 1.437 -1.083 0 CA-C-O 121.325 0.583 . . . . 0.0 110.426 -179.349 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . 0.613 ' O ' ' HA ' ' A' ' 33' ' ' GLU . 0.9 OUTLIER -114.6 142.53 27.01 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.384 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.592 -179.163 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.406 HD12 ' HG2' ' A' ' 33' ' ' GLU . 47.4 mm -105.79 113.83 43.62 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.987 0 N-CA-C 107.243 -1.391 . . . . 0.0 107.243 174.691 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . 0.462 ' HA2' ' HB ' ' A' ' 90' ' ' VAL . . . -83.39 171.64 50.06 Favored Glycine 0 N--CA 1.425 -2.089 0 C-N-CA 119.998 -1.096 . . . . 0.0 111.804 -176.622 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.86 -23.61 65.28 Favored 'General case' 0 C--N 1.305 -1.363 0 CA-C-O 121.438 0.637 . . . . 0.0 111.03 178.108 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -103.34 15.32 29.42 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-O 121.578 0.704 . . . . 0.0 109.642 178.931 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 32.4 m 73.91 23.34 2.26 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-O 122.635 1.207 . . . . 0.0 108.192 -178.907 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.1 m -66.6 95.58 0.34 Allowed 'General case' 0 N--CA 1.428 -1.548 0 CA-C-N 113.285 -1.78 . . . . 0.0 111.106 -179.17 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.613 ' HA ' ' O ' ' A' ' 26' ' ' VAL . 38.6 mt-10 -83.71 106.89 15.78 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 121.533 0.682 . . . . 0.0 111.127 179.424 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.42 ' CG2' ' HG3' ' A' ' 54' ' ' ARG . 40.1 mm -103.62 140.42 21.83 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.431 0 CA-C-N 115.7 -0.682 . . . . 0.0 109.57 179.393 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 13.0 m170 -115.97 132.48 56.64 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 -179.625 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -147.24 159.33 43.77 Favored 'General case' 0 C--N 1.312 -1.031 0 CA-C-O 121.445 0.64 . . . . 0.0 112.003 -178.904 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.487 ' HG2' ' HG2' ' A' ' 23' ' ' LYS . 28.6 mtmt -120.92 119.11 31.65 Favored 'General case' 0 C--N 1.312 -1.053 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.363 -179.109 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 20.5 m -138.38 159.48 31.9 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-O 121.172 0.51 . . . . 0.0 110.947 -178.516 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.512 ' O ' HG22 ' A' ' 42' ' ' THR . 0.9 OUTLIER -74.85 154.56 38.2 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-O 121.058 0.456 . . . . 0.0 111.193 178.625 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -69.85 -37.31 76.11 Favored 'General case' 0 CA--C 1.507 -0.691 0 CA-C-O 121.22 0.533 . . . . 0.0 110.458 178.49 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 11.8 t -99.8 25.59 7.1 Favored 'General case' 0 N--CA 1.436 -1.169 0 CA-C-O 121.375 0.607 . . . . 0.0 112.424 -175.462 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' THR . . . . . 0.512 HG22 ' O ' ' A' ' 39' ' ' LYS . 6.1 t -108.17 168.26 9.43 Favored 'General case' 0 C--N 1.32 -0.713 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 176.995 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 14.8 m170 -78.26 140.35 38.87 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 121.734 0.778 . . . . 0.0 111.885 -179.125 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.638 ' HB2' ' O ' ' A' ' 75' ' ' HIS . 0.2 OUTLIER -64.98 -18.44 65.28 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.051 -0.977 . . . . 0.0 109.813 -179.911 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.709 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -51.25 -45.84 62.14 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.734 -179.212 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . 0.441 ' HA ' ' CG ' ' A' ' 49' ' ' GLU . 21.4 ptmt -66.47 -31.82 72.81 Favored 'General case' 0 C--O 1.22 -0.498 0 CA-C-O 121.427 0.632 . . . . 0.0 110.933 -177.647 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.503 ' HB3' HD13 ' A' ' 44' ' ' LEU . 8.1 tt -67.97 -47.84 67.5 Favored 'General case' 0 C--N 1.308 -1.202 0 CA-C-O 121.6 0.714 . . . . 0.0 109.259 178.025 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.474 ' HA ' ' CE2' ' A' ' 51' ' ' TYR . 40.5 mtpt -60.63 -45.2 94.93 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.066 -0.97 . . . . 0.0 111.535 -178.763 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.709 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 3.7 pt-20 -71.03 -33.85 70.72 Favored 'General case' 0 C--N 1.312 -1.05 0 CA-C-O 120.958 0.408 . . . . 0.0 110.376 178.639 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' SER . . . . . 0.57 ' O ' ' HG2' ' A' ' 54' ' ' ARG . 21.9 t -64.19 -44.91 90.53 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-O 120.881 0.372 . . . . 0.0 111.257 -178.744 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . 0.474 ' CE2' ' HA ' ' A' ' 48' ' ' LYS . 3.6 p90 -75.73 -32.39 60.0 Favored 'General case' 0 N--CA 1.443 -0.81 0 C-N-CA 119.639 -0.824 . . . . 0.0 110.659 -178.618 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . 0.602 ' SG ' ' HG2' ' A' ' 59' ' ' MET . 69.3 m -62.77 -43.55 98.5 Favored 'General case' 0 C--O 1.238 0.451 0 CA-C-O 120.868 0.366 . . . . 0.0 110.822 178.667 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 6.6 pt20 -66.49 -36.06 81.79 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 120.649 -0.421 . . . . 0.0 110.284 178.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.57 ' HG2' ' O ' ' A' ' 50' ' ' SER . 29.7 mmt180 -53.76 -45.77 70.73 Favored 'General case' 0 C--N 1.351 0.668 0 CA-C-O 121.233 0.54 . . . . 0.0 110.594 176.667 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.417 HE21 ' HB2' ' A' ' 55' ' ' GLN . 2.2 mt-30 -76.73 -23.43 53.05 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.881 -179.609 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 83.27 29.34 33.83 Favored Glycine 0 N--CA 1.445 -0.716 0 C-N-CA 120.565 -0.826 . . . . 0.0 112.086 178.464 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 26.6 m -128.49 153.45 79.3 Favored Pre-proline 0 C--N 1.327 -0.393 0 O-C-N 122.659 -0.318 . . . . 0.0 110.326 -178.725 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -69.01 149.14 71.31 Favored 'Trans proline' 0 C--O 1.239 0.571 0 C-N-CA 122.334 2.022 . . . . 0.0 112.188 178.226 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.602 ' HG2' ' SG ' ' A' ' 52' ' ' CYS . 75.3 mtp -71.46 -9.23 57.85 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.791 -0.64 . . . . 0.0 112.112 -176.06 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 21.0 p30 -89.72 -13.41 36.91 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-O 121.115 0.483 . . . . 0.0 111.529 -178.64 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 67.6 m -88.36 -16.1 33.88 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-O 121.164 0.507 . . . . 0.0 112.162 -179.204 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.523 HD13 ' SG ' ' A' ' 52' ' ' CYS . 1.5 pp -126.66 168.47 14.31 Favored 'General case' 0 C--N 1.309 -1.172 0 N-CA-C 112.817 0.673 . . . . 0.0 112.817 -178.457 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.553 ' O ' ' HA ' ' A' ' 90' ' ' VAL . 14.4 mtp180 -121.14 127.09 51.24 Favored 'General case' 0 CA--C 1.506 -0.73 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.658 -177.814 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -106.91 113.9 27.67 Favored 'General case' 0 C--N 1.305 -1.338 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.643 178.147 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.46 ' C ' HD23 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -141.23 162.12 36.24 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.361 0.6 . . . . 0.0 111.056 179.541 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 86.1 t80 -142.89 135.16 27.36 Favored 'General case' 0 C--N 1.311 -1.068 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 178.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 6.2 pt-20 48.96 29.32 2.32 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 124.23 1.012 . . . . 0.0 112.405 -179.729 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 81.77 27.65 45.63 Favored Glycine 0 N--CA 1.445 -0.709 0 C-N-CA 120.72 -0.752 . . . . 0.0 113.131 -179.273 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 3.5 pt20 -132.61 136.47 46.54 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 109.217 -0.661 . . . . 0.0 109.217 178.018 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.91 145.74 49.98 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-O 121.638 0.732 . . . . 0.0 110.672 178.292 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.458 HG12 ' HA ' ' A' ' 65' ' ' LEU . 16.8 mm -99.74 121.27 50.21 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.592 0 CA-C-O 121.161 0.505 . . . . 0.0 109.989 -179.632 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -95.86 164.58 12.68 Favored 'General case' 0 C--N 1.309 -1.153 0 N-CA-C 109.946 -0.391 . . . . 0.0 109.946 -179.382 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -65.49 -21.75 66.66 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-O 121.287 0.565 . . . . 0.0 110.584 179.411 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 6.5 m-80 -97.93 2.31 48.94 Favored 'General case' 0 CA--C 1.508 -0.653 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.162 -179.61 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . 0.638 ' O ' ' HB2' ' A' ' 44' ' ' LEU . 1.6 m170 -82.33 146.18 29.54 Favored 'General case' 0 CA--C 1.505 -0.786 0 C-N-CA 119.96 -0.696 . . . . 0.0 109.305 -179.832 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.479 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 82.1 p -120.7 155.53 56.97 Favored Pre-proline 0 C--N 1.308 -1.198 0 C-N-CA 120.961 -0.296 . . . . 0.0 111.27 179.514 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_exo -61.85 -38.71 57.23 Favored 'Trans proline' 0 C--N 1.348 0.516 0 C-N-CA 122.459 2.106 . . . . 0.0 111.161 179.335 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . 0.52 ' HG3' ' N ' ' A' ' 79' ' ' GLU . 47.0 pttt -67.22 -39.58 86.3 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.801 -178.835 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . 0.52 ' N ' ' HG3' ' A' ' 78' ' ' LYS . 4.3 mm-40 -75.26 -33.57 61.3 Favored 'General case' 0 N--CA 1.44 -0.974 0 CA-C-O 120.947 0.404 . . . . 0.0 111.614 -177.31 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.479 ' HG ' ' O ' ' A' ' 76' ' ' THR . 6.5 mt -82.8 -1.32 51.43 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.214 0.53 . . . . 0.0 110.78 179.573 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 76.3 46.43 12.61 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 121.133 -0.556 . . . . 0.0 113.114 177.248 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 60.7 mtt -107.04 167.72 9.7 Favored 'General case' 0 C--N 1.313 -1.021 0 N-CA-C 109.627 -0.509 . . . . 0.0 109.627 178.569 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -148.42 -171.3 3.81 Favored 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 109.938 -0.393 . . . . 0.0 109.938 178.168 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -66.29 135.31 54.23 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.531 0.681 . . . . 0.0 111.659 -178.48 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 74.63 6.74 4.48 Favored 'General case' 0 C--N 1.324 -0.539 0 C-N-CA 124.816 1.246 . . . . 0.0 112.558 178.746 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -62.27 162.54 9.64 Favored 'General case' 0 C--O 1.238 0.491 0 CA-C-O 121.093 0.473 . . . . 0.0 110.081 175.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . 0.432 ' HA ' ' O ' ' A' ' 25' ' ' LYS . 7.3 p -127.56 142.19 44.3 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.264 0 CA-C-O 121.537 0.684 . . . . 0.0 111.925 -176.392 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 3.7 mp -114.4 153.62 15.89 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 179.699 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -104.67 135.53 45.9 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 121.046 0.451 . . . . 0.0 109.994 -176.401 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . 0.553 ' HA ' ' O ' ' A' ' 63' ' ' ARG . 96.7 t -128.57 134.74 64.03 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.904 0 CA-C-O 121.268 0.556 . . . . 0.0 110.825 179.039 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 80.7 m-85 -121.24 179.07 4.53 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-N 116.213 -0.449 . . . . 0.0 109.858 179.43 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 8.7 tp60 -108.22 128.23 54.53 Favored 'General case' 0 C--N 1.313 -1.005 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 179.54 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 . . . . . 0 C--N 1.326 -0.433 0 CA-C-O 121.316 0.579 . . . . 0.0 111.037 178.209 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . 0.401 ' HB ' ' HA ' ' A' ' 84' ' ' GLU . 22.3 pt . . . . . 0 N--CA 1.444 -0.768 0 CA-C-O 121.569 0.699 . . . . 0.0 110.25 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 14.2 mtmt -117.63 146.69 43.49 Favored 'General case' 0 C--N 1.298 -1.636 0 N-CA-C 109.058 -0.719 . . . . 0.0 109.058 -179.071 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.6 mp -141.35 161.48 37.79 Favored 'General case' 0 C--N 1.303 -1.434 0 CA-C-O 121.337 0.589 . . . . 0.0 111.473 174.957 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.414 ' HE2' ' HB3' ' A' ' 25' ' ' LYS . 5.5 tmmm? -133.34 142.88 48.65 Favored 'General case' 0 N--CA 1.436 -1.16 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.463 -178.993 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . 0.476 ' O ' ' HA ' ' A' ' 33' ' ' GLU . 0.9 OUTLIER -114.46 141.72 29.83 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.341 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.247 -179.701 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.44 ' O ' ' HB ' ' A' ' 90' ' ' VAL . 45.5 mm -105.11 117.74 51.31 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.971 0 N-CA-C 107.685 -1.228 . . . . 0.0 107.685 175.652 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -87.56 168.1 37.75 Favored Glycine 0 N--CA 1.421 -2.359 0 C-N-CA 120.372 -0.918 . . . . 0.0 111.845 -177.316 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.04 -22.59 66.96 Favored 'General case' 0 C--N 1.305 -1.348 0 CA-C-O 121.592 0.711 . . . . 0.0 110.704 178.832 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -97.99 12.18 35.07 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.663 -0.699 . . . . 0.0 109.555 179.672 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 15.1 m 71.54 16.56 5.86 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.337 -178.961 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 9.6 t -76.09 115.94 16.3 Favored 'General case' 0 N--CA 1.444 -0.737 0 CA-C-N 115.551 -0.749 . . . . 0.0 110.234 -179.731 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.476 ' HA ' ' O ' ' A' ' 26' ' ' VAL . 40.9 mt-10 -89.15 112.68 23.74 Favored 'General case' 0 CA--C 1.509 -0.598 0 CA-C-O 120.942 0.401 . . . . 0.0 110.415 178.678 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 30.6 mm -99.48 135.53 34.45 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.515 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 177.193 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 11.9 m170 -116.13 132.74 56.57 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 109.549 -0.537 . . . . 0.0 109.549 -178.52 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 1.4 p90 -147.22 166.77 26.0 Favored 'General case' 0 C--N 1.314 -0.972 0 CA-C-O 121.424 0.63 . . . . 0.0 111.6 -178.164 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 89.9 mttt -125.17 121.34 33.91 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.835 -178.79 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 28.1 m -139.15 156.97 28.08 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 CA-C-O 120.949 0.404 . . . . 0.0 110.165 179.455 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.529 ' O ' HG23 ' A' ' 42' ' ' THR . 80.4 tttt -84.21 167.25 16.85 Favored 'General case' 0 C--N 1.311 -1.072 0 O-C-N 121.98 -0.45 . . . . 0.0 110.654 179.832 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -73.39 -36.28 66.02 Favored 'General case' 0 N--CA 1.464 0.269 0 N-CA-C 112.907 0.706 . . . . 0.0 112.907 -176.931 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 11.3 t -96.18 15.72 20.16 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 112.02 0.378 . . . . 0.0 112.02 -177.182 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' THR . . . . . 0.529 HG23 ' O ' ' A' ' 39' ' ' LYS . 5.3 t -93.58 171.62 8.78 Favored 'General case' 0 C--N 1.319 -0.742 0 O-C-N 121.627 -0.67 . . . . 0.0 109.917 -179.604 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 51.6 m170 -88.39 141.23 28.71 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 121.381 0.61 . . . . 0.0 111.188 -179.535 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.623 ' HB2' ' O ' ' A' ' 75' ' ' HIS . 0.2 OUTLIER -69.49 -15.22 63.22 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.571 -0.74 . . . . 0.0 110.033 -179.815 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.777 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -54.75 -44.98 74.1 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-N 115.756 -0.656 . . . . 0.0 111.934 -179.225 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . 0.458 ' N ' ' HD3' ' A' ' 45' ' ' LYS . 21.4 ptmt -69.49 -29.12 66.7 Favored 'General case' 0 C--O 1.218 -0.602 0 CA-C-O 121.286 0.565 . . . . 0.0 110.482 -178.233 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.462 ' HB3' HD12 ' A' ' 44' ' ' LEU . 8.0 tt -72.55 -49.83 29.89 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.498 -179.653 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.501 ' HG2' ' O ' ' A' ' 44' ' ' LEU . 8.3 ptmm? -61.76 -41.76 98.1 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.418 -178.306 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.777 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 8.2 pt-20 -72.16 -30.49 65.05 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-O 121.021 0.439 . . . . 0.0 110.716 177.841 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' SER . . . . . 0.562 ' O ' ' HG2' ' A' ' 53' ' ' GLN . 29.3 t -68.57 -43.7 76.01 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.431 -0.35 . . . . 0.0 111.5 -178.75 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . 0.458 ' OH ' ' HB3' ' A' ' 64' ' ' PHE . 2.5 p90 -75.66 -32.46 60.19 Favored 'General case' 0 N--CA 1.446 -0.658 0 C-N-CA 119.531 -0.868 . . . . 0.0 110.206 -178.619 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . 0.491 ' SG ' HD12 ' A' ' 62' ' ' LEU . 98.9 m -65.14 -42.75 93.55 Favored 'General case' 0 CA--C 1.504 -0.807 0 CA-C-O 121.236 0.541 . . . . 0.0 110.601 179.765 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . 0.562 ' HG2' ' O ' ' A' ' 50' ' ' SER . 25.4 pt20 -67.37 -35.89 80.25 Favored 'General case' 0 N--CA 1.434 -1.271 0 CA-C-N 115.97 -0.559 . . . . 0.0 109.596 -179.728 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.411 ' HA ' ' NE ' ' A' ' 54' ' ' ARG . 1.0 OUTLIER -56.91 -39.35 74.28 Favored 'General case' 0 C--N 1.355 0.832 0 CA-C-O 121.315 0.578 . . . . 0.0 111.279 178.831 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.433 ' NE2' ' HA ' ' A' ' 52' ' ' CYS . 3.5 mt-30 -77.7 -20.91 52.81 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.888 179.964 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 80.86 33.63 29.57 Favored Glycine 0 N--CA 1.447 -0.615 0 C-N-CA 120.787 -0.721 . . . . 0.0 111.88 179.899 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 31.2 m -133.8 150.67 75.27 Favored Pre-proline 0 C--O 1.238 0.488 0 O-C-N 122.606 -0.349 . . . . 0.0 110.743 -178.685 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . 0.526 ' HG2' ' OG ' ' A' ' 61' ' ' SER . 29.9 Cg_endo -65.37 149.57 88.03 Favored 'Trans proline' 0 N--CA 1.455 -0.739 0 C-N-CA 122.558 2.172 . . . . 0.0 111.479 176.829 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.48 ' HG2' ' SG ' ' A' ' 52' ' ' CYS . 68.5 mtp -73.5 -8.38 55.69 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 121.246 0.546 . . . . 0.0 111.52 -176.686 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . 0.4 ' OD1' ' HB2' ' A' ' 58' ' ' PRO . 2.0 p-10 -90.82 -10.19 43.67 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-O 121.272 0.558 . . . . 0.0 111.046 -179.124 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.526 ' OG ' ' HG2' ' A' ' 58' ' ' PRO . 67.1 m -87.59 -19.22 28.12 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 121.08 0.467 . . . . 0.0 111.59 179.766 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.491 HD12 ' SG ' ' A' ' 52' ' ' CYS . 1.8 pp -127.66 170.31 12.83 Favored 'General case' 0 C--N 1.317 -0.829 0 N-CA-C 112.948 0.721 . . . . 0.0 112.948 -177.949 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.449 ' O ' ' HA ' ' A' ' 90' ' ' VAL . 44.2 mtm180 -120.18 119.4 33.14 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.606 -0.724 . . . . 0.0 110.824 -176.686 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . 0.458 ' HB3' ' OH ' ' A' ' 51' ' ' TYR . 0.2 OUTLIER -102.33 116.11 31.96 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-O 121.085 0.469 . . . . 0.0 111.034 178.458 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.47 ' C ' HD23 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -143.3 162.52 35.45 Favored 'General case' 0 N--CA 1.444 -0.755 0 CA-C-O 121.395 0.616 . . . . 0.0 111.285 179.412 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . 0.409 ' CB ' HD12 ' A' ' 71' ' ' ILE . 90.2 t80 -143.64 134.48 25.29 Favored 'General case' 0 C--N 1.306 -1.287 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 179.432 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 6.4 pt-20 49.34 27.34 1.9 Allowed 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 124.006 0.923 . . . . 0.0 112.354 -179.071 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 87.19 19.94 54.02 Favored Glycine 0 N--CA 1.449 -0.463 0 C-N-CA 121.079 -0.582 . . . . 0.0 113.687 -179.541 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 3.3 pt20 -128.68 137.3 51.55 Favored 'General case' 0 C--N 1.319 -0.737 0 O-C-N 122.058 -0.672 . . . . 0.0 109.486 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -68.8 146.64 52.72 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-O 121.292 0.567 . . . . 0.0 110.225 178.241 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.409 HD12 ' CB ' ' A' ' 66' ' ' PHE . 24.5 mm -93.15 119.09 40.3 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.54 0 CA-C-O 120.931 0.396 . . . . 0.0 110.161 -179.613 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -96.96 163.54 12.91 Favored 'General case' 0 N--CA 1.437 -1.095 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 -179.505 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . 0.447 ' CA ' ' HB3' ' A' ' 45' ' ' LYS . 13.8 m-20 -65.02 -28.17 69.31 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-O 121.563 0.697 . . . . 0.0 110.769 -178.901 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 6.2 m-80 -95.36 4.13 53.7 Favored 'General case' 0 C--N 1.313 -0.981 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.994 -176.443 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . 0.623 ' O ' ' HB2' ' A' ' 44' ' ' LEU . 1.7 m170 -80.29 141.69 35.25 Favored 'General case' 0 CA--C 1.509 -0.629 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 179.974 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 69.7 p -116.57 154.11 49.1 Favored Pre-proline 0 C--N 1.308 -1.236 0 C-N-CA 120.829 -0.348 . . . . 0.0 111.286 178.942 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -58.64 -40.6 72.02 Favored 'Trans proline' 0 C--N 1.349 0.594 0 C-N-CA 122.624 2.216 . . . . 0.0 111.602 179.264 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . 0.48 ' HG3' ' N ' ' A' ' 79' ' ' GLU . 17.3 pttt -68.66 -35.52 77.36 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.05 0.452 . . . . 0.0 111.114 -178.146 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . 0.48 ' N ' ' HG3' ' A' ' 78' ' ' LYS . 32.8 mm-40 -76.24 -32.74 59.04 Favored 'General case' 0 CA--C 1.508 -0.672 0 CA-C-O 120.854 0.359 . . . . 0.0 111.233 -179.29 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.473 HD23 ' CG ' ' A' ' 75' ' ' HIS . 5.5 mt -83.27 -2.76 56.43 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.417 0.627 . . . . 0.0 110.361 178.954 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 75.06 44.52 23.28 Favored Glycine 0 N--CA 1.449 -0.456 0 CA-C-N 115.852 -0.613 . . . . 0.0 112.552 177.696 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 63.0 mtt -101.65 162.02 13.21 Favored 'General case' 0 C--N 1.316 -0.874 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 178.745 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -139.85 -172.76 3.46 Favored 'General case' 0 C--N 1.309 -1.181 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 178.471 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.437 ' O ' ' HB2' ' A' ' 85' ' ' GLU . 10.0 pt-20 -73.34 136.23 44.41 Favored 'General case' 0 N--CA 1.443 -0.813 0 C-N-CA 119.843 -0.743 . . . . 0.0 110.836 179.443 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . 0.437 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 42.9 mt-10 76.04 5.06 3.8 Favored 'General case' 0 C--N 1.321 -0.644 0 C-N-CA 124.612 1.165 . . . . 0.0 111.557 -179.114 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 1.8 t0 -63.22 163.84 9.69 Favored 'General case' 0 C--O 1.238 0.488 0 CA-C-O 121.007 0.432 . . . . 0.0 110.309 176.435 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 9.1 p -126.92 143.14 41.37 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.267 0 CA-C-O 121.421 0.629 . . . . 0.0 111.713 -175.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 3.4 mp -113.2 152.19 14.96 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.746 0 N-CA-C 108.611 -0.885 . . . . 0.0 108.611 178.134 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -105.42 137.24 43.55 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-O 121.182 0.515 . . . . 0.0 110.754 -175.89 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . 0.449 ' HA ' ' O ' ' A' ' 63' ' ' ARG . 58.3 t -130.02 134.97 62.01 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.843 0 CA-C-O 121.398 0.618 . . . . 0.0 110.74 178.68 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 95.7 m-85 -123.33 -178.79 4.09 Favored 'General case' 0 C--N 1.307 -1.276 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 178.645 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 8.0 tp60 -104.65 152.75 22.09 Favored 'General case' 0 C--N 1.305 -1.344 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 179.332 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 . . . . . 0 C--N 1.325 -0.463 0 CA-C-O 121.424 0.63 . . . . 0.0 110.329 175.207 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 21.1 pt . . . . . 0 N--CA 1.445 -0.72 0 CA-C-O 121.261 0.553 . . . . 0.0 110.391 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -117.17 143.0 46.32 Favored 'General case' 0 C--N 1.303 -1.427 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 -179.68 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.4 mp -135.21 162.02 33.71 Favored 'General case' 0 C--N 1.309 -1.177 0 CA-C-O 121.202 0.525 . . . . 0.0 110.863 176.778 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.556 ' HG3' ' NE2' ' A' ' 35' ' ' HIS . 2.9 tmmt? -133.22 144.02 49.52 Favored 'General case' 0 N--CA 1.439 -1.002 0 CA-C-O 121.391 0.615 . . . . 0.0 111.186 -178.648 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . 0.527 HG12 ' CD1' ' A' ' 51' ' ' TYR . 1.0 OUTLIER -118.54 139.03 47.31 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.314 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.231 178.904 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.447 HD13 ' HZ1' ' A' ' 25' ' ' LYS . 40.1 mm -107.19 99.13 7.95 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.01 0 N-CA-C 108.525 -0.917 . . . . 0.0 108.525 175.039 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . 0.543 ' HA2' ' HB ' ' A' ' 90' ' ' VAL . . . -69.8 161.9 52.68 Favored Glycine 0 N--CA 1.42 -2.396 0 C-N-CA 120.27 -0.966 . . . . 0.0 112.943 178.382 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . 0.407 ' HG2' ' NE2' ' A' ' 92' ' ' GLN . 0.0 OUTLIER -54.62 -28.55 47.54 Favored 'General case' 0 C--N 1.306 -1.293 0 C-N-CA 123.675 0.79 . . . . 0.0 112.01 176.914 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -88.49 14.88 8.82 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-O 121.249 0.547 . . . . 0.0 110.362 179.597 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 55.6 m 67.62 14.56 9.57 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-O 121.76 0.791 . . . . 0.0 110.353 -177.639 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 2.2 t -72.82 101.48 3.15 Favored 'General case' 0 N--CA 1.438 -1.07 0 CA-C-N 115.238 -0.892 . . . . 0.0 110.4 -179.664 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.426 ' HG2' ' CD1' ' A' ' 27' ' ' ILE . 23.9 mt-10 -79.7 103.61 9.72 Favored 'General case' 0 N--CA 1.444 -0.749 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 177.569 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 23.0 mm -97.33 130.97 45.21 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.587 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 -178.918 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . 0.556 ' NE2' ' HG3' ' A' ' 25' ' ' LYS . 12.1 m170 -115.95 123.77 48.87 Favored 'General case' 0 CA--C 1.505 -0.768 0 N-CA-C 109.646 -0.501 . . . . 0.0 109.646 -178.953 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 1.3 p90 -138.15 147.28 43.73 Favored 'General case' 0 C--N 1.301 -1.534 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.763 -177.156 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 96.2 mttt -109.7 117.92 35.17 Favored 'General case' 0 C--N 1.311 -1.068 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.022 -179.333 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 24.6 m -137.17 167.04 24.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.351 -178.433 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.413 ' HG2' ' N ' ' A' ' 40' ' ' MET . 81.7 tttt -90.76 160.03 16.01 Favored 'General case' 0 C--N 1.318 -0.8 0 O-C-N 121.782 -0.574 . . . . 0.0 110.695 -179.769 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' MET . . . . . 0.413 ' N ' ' HG2' ' A' ' 39' ' ' LYS . 0.0 OUTLIER -66.21 -37.85 86.56 Favored 'General case' 0 CA--C 1.517 -0.317 0 N-CA-C 112.594 0.591 . . . . 0.0 112.594 -177.466 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 11.0 t -98.84 17.87 18.44 Favored 'General case' 0 C--N 1.312 -1.032 0 CA-C-O 120.952 0.406 . . . . 0.0 111.741 -175.739 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 1.1 t -95.16 165.73 12.26 Favored 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 120.205 -0.598 . . . . 0.0 109.788 179.069 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 18.3 m170 -81.28 137.52 35.79 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-O 121.498 0.666 . . . . 0.0 112.029 -179.917 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.595 ' HB2' ' O ' ' A' ' 75' ' ' HIS . 0.4 OUTLIER -65.71 -14.39 61.19 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.034 -0.984 . . . . 0.0 110.968 179.784 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.75 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -51.01 -54.45 24.45 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.505 0.557 . . . . 0.0 112.505 -178.432 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . 0.431 ' HD3' ' N ' ' A' ' 47' ' ' LEU . 0.1 OUTLIER -66.85 -25.27 66.34 Favored 'General case' 0 C--O 1.218 -0.573 0 CA-C-O 121.289 0.566 . . . . 0.0 111.491 -178.192 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.431 ' N ' ' HD3' ' A' ' 46' ' ' LYS . 8.2 tt -73.51 -51.34 17.4 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.708 178.93 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.5 ' HG2' ' O ' ' A' ' 44' ' ' LEU . 8.7 ptmm? -62.39 -40.27 95.95 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.904 0.383 . . . . 0.0 111.522 -177.566 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.75 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 11.5 pt-20 -72.57 -31.29 65.12 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-O 120.909 0.385 . . . . 0.0 110.632 177.838 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 38.1 t -65.86 -44.33 85.73 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-O 120.932 0.396 . . . . 0.0 111.226 -179.292 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . 0.527 ' CD1' HG12 ' A' ' 26' ' ' VAL . 1.2 p90 -76.49 -33.17 58.66 Favored 'General case' 0 N--CA 1.443 -0.78 0 C-N-CA 119.676 -0.81 . . . . 0.0 110.266 -177.78 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 84.5 m -61.81 -44.75 96.24 Favored 'General case' 0 CA--C 1.512 -0.513 0 CA-C-O 121.174 0.512 . . . . 0.0 110.57 179.727 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 12.9 pt20 -69.63 -32.5 71.23 Favored 'General case' 0 N--CA 1.444 -0.727 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.552 -179.022 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.557 ' HA ' ' NE ' ' A' ' 54' ' ' ARG . 6.9 mmp_? -59.61 -29.41 67.97 Favored 'General case' 0 C--N 1.344 0.337 0 CA-C-O 121.13 0.491 . . . . 0.0 111.465 177.319 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.445 HE21 ' HB2' ' A' ' 55' ' ' GLN . 3.4 mt-30 -89.36 -21.09 23.27 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-O 121.04 0.448 . . . . 0.0 111.046 179.57 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 84.8 28.58 31.48 Favored Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 120.855 -0.688 . . . . 0.0 112.272 179.476 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 27.3 m -133.05 153.37 80.88 Favored Pre-proline 0 C--N 1.324 -0.542 0 O-C-N 122.375 -0.486 . . . . 0.0 110.948 -178.656 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . 0.408 ' HB2' ' OD1' ' A' ' 60' ' ' ASN . 59.1 Cg_endo -77.6 164.57 28.14 Favored 'Trans proline' 0 N--CA 1.457 -0.63 0 C-N-CA 122.631 2.221 . . . . 0.0 112.417 177.864 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 42.0 mtt -69.75 -8.67 49.99 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-N 116.184 -0.462 . . . . 0.0 112.111 -177.415 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . 0.408 ' OD1' ' HB2' ' A' ' 58' ' ' PRO . 1.4 p-10 -92.7 -11.74 33.26 Favored 'General case' 0 C--N 1.312 -1.037 0 CA-C-O 121.319 0.581 . . . . 0.0 111.023 -177.649 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 50.0 m -88.43 -22.67 23.6 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-O 121.275 0.56 . . . . 0.0 111.314 -179.114 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -135.27 165.09 26.23 Favored 'General case' 0 C--N 1.307 -1.257 0 CA-C-O 121.372 0.606 . . . . 0.0 112.401 -176.954 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.561 ' O ' ' HA ' ' A' ' 90' ' ' VAL . 9.8 mtp180 -116.27 118.88 33.99 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.256 -178.123 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . 0.506 ' HB3' ' OH ' ' A' ' 51' ' ' TYR . 0.2 OUTLIER -96.72 112.36 24.14 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-O 121.064 0.459 . . . . 0.0 110.671 177.515 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.454 ' C ' HD21 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -143.12 164.7 29.44 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-O 121.614 0.721 . . . . 0.0 111.928 -179.258 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 91.8 t80 -145.41 135.14 23.46 Favored 'General case' 0 C--N 1.31 -1.116 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 179.056 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 49.19 27.81 1.95 Allowed 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 124.214 1.006 . . . . 0.0 112.292 -179.19 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 85.59 23.21 47.78 Favored Glycine 0 CA--C 1.523 0.591 0 C-N-CA 120.885 -0.674 . . . . 0.0 113.312 -178.817 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 3.0 pt20 -131.75 134.27 45.68 Favored 'General case' 0 C--N 1.321 -0.655 0 O-C-N 122.191 -0.594 . . . . 0.0 109.452 179.341 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . 0.408 ' CD ' ' H ' ' A' ' 70' ' ' ARG . 0.1 OUTLIER -73.58 145.03 45.78 Favored 'General case' 0 C--N 1.31 -1.131 0 CA-C-O 121.695 0.76 . . . . 0.0 110.497 178.113 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 23.0 mm -91.58 126.82 44.19 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.516 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.78 -176.671 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -102.15 165.49 11.12 Favored 'General case' 0 N--CA 1.44 -0.934 0 N-CA-C 109.891 -0.411 . . . . 0.0 109.891 179.906 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . 0.437 ' CG ' ' HZ2' ' A' ' 48' ' ' LYS . 3.7 m-20 -69.22 -21.66 63.93 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-O 121.288 0.566 . . . . 0.0 111.562 -178.951 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 12.0 m-80 -98.26 1.45 47.23 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-O 121.369 0.604 . . . . 0.0 109.863 -179.803 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . 0.595 ' O ' ' HB2' ' A' ' 44' ' ' LEU . 5.2 m170 -79.85 142.32 35.36 Favored 'General case' 0 CA--C 1.505 -0.765 0 CA-C-N 116.14 -0.482 . . . . 0.0 109.948 179.933 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.423 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 66.7 p -118.51 154.5 52.36 Favored Pre-proline 0 C--N 1.304 -1.391 0 CA-C-N 116.751 -0.204 . . . . 0.0 110.637 178.514 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 24.9 Cg_exo -62.33 -37.51 60.51 Favored 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 122.429 2.086 . . . . 0.0 110.917 179.457 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . 0.539 ' HG3' ' N ' ' A' ' 79' ' ' GLU . 41.3 pttt -65.56 -43.22 90.51 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.794 -179.501 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . 0.539 ' N ' ' HG3' ' A' ' 78' ' ' LYS . 5.9 mm-40 -70.59 -40.32 73.33 Favored 'General case' 0 CA--C 1.509 -0.628 0 CA-C-O 120.902 0.382 . . . . 0.0 111.475 -177.919 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.435 HD23 ' CG ' ' A' ' 75' ' ' HIS . 5.2 mt -74.63 -10.47 59.57 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.328 0.585 . . . . 0.0 110.282 179.971 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 81.78 44.18 7.91 Favored Glycine 0 N--CA 1.45 -0.417 0 CA-C-N 115.887 -0.597 . . . . 0.0 113.246 176.698 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 57.2 mtt -100.99 166.31 10.88 Favored 'General case' 0 C--N 1.314 -0.94 0 N-CA-C 109.489 -0.559 . . . . 0.0 109.489 178.514 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . 0.424 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 12.8 pt-20 -135.31 -169.76 2.45 Favored 'General case' 0 C--N 1.311 -1.066 0 N-CA-C 109.662 -0.496 . . . . 0.0 109.662 177.162 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -73.64 143.29 46.35 Favored 'General case' 0 N--CA 1.445 -0.717 0 C-N-CA 120.306 -0.557 . . . . 0.0 110.156 179.183 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 70.25 8.91 6.84 Favored 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 123.437 0.695 . . . . 0.0 111.497 -179.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . 0.424 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 3.2 t0 -65.71 162.11 19.24 Favored 'General case' 0 C--O 1.24 0.562 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.155 175.893 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 11.6 p -127.54 142.81 42.59 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.443 0 CA-C-O 121.653 0.739 . . . . 0.0 111.48 -177.049 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 3.6 mp -112.63 149.82 15.02 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.213 0 N-CA-C 107.885 -1.154 . . . . 0.0 107.885 178.288 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 20.3 tp10 -106.84 141.38 38.17 Favored 'General case' 0 C--N 1.308 -1.205 0 CA-C-O 120.958 0.409 . . . . 0.0 110.39 -175.144 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . 0.561 ' HA ' ' O ' ' A' ' 63' ' ' ARG . 77.4 t -130.93 133.82 62.5 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.188 0 CA-C-O 120.986 0.422 . . . . 0.0 110.413 178.811 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 82.2 m-85 -117.86 173.29 6.84 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-O 120.753 0.311 . . . . 0.0 110.376 -178.566 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . 0.407 ' NE2' ' HG2' ' A' ' 29' ' ' GLN . 7.5 tp60 -103.41 133.39 48.55 Favored 'General case' 0 C--N 1.311 -1.074 0 CA-C-O 120.915 0.388 . . . . 0.0 110.966 -179.752 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 . . . . . 0 C--N 1.323 -0.579 0 CA-C-O 121.481 0.658 . . . . 0.0 110.201 176.137 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 22.4 pt . . . . . 0 N--CA 1.457 -0.124 0 CA-C-O 121.434 0.635 . . . . 0.0 110.607 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.407 ' HE3' ' HB2' ' A' ' 23' ' ' LYS . 31.5 mtmt -117.83 139.0 51.71 Favored 'General case' 0 C--N 1.308 -1.203 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.328 -178.106 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.4 mp -134.94 163.74 29.17 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-O 121.163 0.506 . . . . 0.0 110.816 176.704 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.444 ' NZ ' HD13 ' A' ' 27' ' ' ILE . 2.3 tmmt? -132.94 144.88 50.44 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-O 121.164 0.507 . . . . 0.0 110.344 179.878 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . 0.439 ' O ' ' HA ' ' A' ' 33' ' ' GLU . 0.9 OUTLIER -114.83 142.3 28.16 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.286 0 CA-C-O 121.091 0.472 . . . . 0.0 111.351 179.121 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.444 HD13 ' NZ ' ' A' ' 25' ' ' LYS . 45.9 mm -104.89 112.69 39.55 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.213 0 N-CA-C 107.634 -1.247 . . . . 0.0 107.634 175.274 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -79.28 171.87 55.01 Favored Glycine 0 N--CA 1.424 -2.158 0 C-N-CA 120.447 -0.882 . . . . 0.0 112.565 -176.198 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . 0.716 ' H ' ' NE2' ' A' ' 29' ' ' GLN . 0.0 OUTLIER -67.5 -23.01 65.42 Favored 'General case' 0 C--N 1.309 -1.183 0 CA-C-O 121.739 0.78 . . . . 0.0 109.573 179.082 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -97.83 12.42 34.01 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.315 -0.857 . . . . 0.0 109.362 177.465 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 49.5 m 70.24 15.81 7.42 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.809 -178.906 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 21.9 t -71.19 116.3 11.34 Favored 'General case' 0 N--CA 1.445 -0.677 0 CA-C-N 115.416 -0.811 . . . . 0.0 109.846 178.901 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.439 ' HA ' ' O ' ' A' ' 26' ' ' VAL . 32.4 mt-10 -89.4 108.69 19.78 Favored 'General case' 0 N--CA 1.445 -0.725 0 CA-C-O 121.226 0.536 . . . . 0.0 109.988 179.268 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 34.4 mm -97.79 138.79 21.59 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.371 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 179.4 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 13.3 m170 -116.95 129.6 56.15 Favored 'General case' 0 C--N 1.317 -0.829 0 N-CA-C 109.511 -0.551 . . . . 0.0 109.511 -178.387 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 1.9 p90 -147.02 158.02 43.8 Favored 'General case' 0 C--N 1.307 -1.25 0 CA-C-O 121.477 0.656 . . . . 0.0 110.603 -179.158 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 47.1 mtmt -126.17 116.31 21.14 Favored 'General case' 0 C--N 1.301 -1.502 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.652 -178.593 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 17.6 m -132.81 163.85 36.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.525 -176.74 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.465 ' O ' HG23 ' A' ' 42' ' ' THR . 84.9 tttt -85.67 160.33 19.59 Favored 'General case' 0 C--N 1.316 -0.857 0 O-C-N 121.923 -0.486 . . . . 0.0 111.413 -178.279 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -70.39 -37.18 74.45 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.031 0.444 . . . . 0.0 112.154 -177.625 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 14.5 t -90.51 9.35 29.69 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.531 -177.79 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' THR . . . . . 0.465 HG23 ' O ' ' A' ' 39' ' ' LYS . 1.2 t -92.06 167.73 11.87 Favored 'General case' 0 C--N 1.322 -0.591 0 C-N-CA 120.03 -0.668 . . . . 0.0 110.298 -178.482 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . 0.452 ' HB3' ' HG2' ' A' ' 45' ' ' LYS . 31.9 m170 -87.93 141.65 28.41 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-O 121.51 0.671 . . . . 0.0 111.589 -179.26 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.512 ' HB2' ' O ' ' A' ' 75' ' ' HIS . 0.6 OUTLIER -65.68 -19.26 65.83 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.554 -0.748 . . . . 0.0 111.515 179.944 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.491 ' HA ' ' HD3' ' A' ' 48' ' ' LYS . 7.5 ptpt -50.82 -49.24 59.08 Favored 'General case' 0 N--CA 1.463 0.188 0 N-CA-C 112.018 0.377 . . . . 0.0 112.018 -179.167 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.6 -29.67 69.06 Favored 'General case' 0 C--O 1.207 -1.162 0 CA-C-O 120.893 0.378 . . . . 0.0 111.239 -178.847 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 8.3 tt -70.71 -47.83 57.76 Favored 'General case' 0 C--N 1.311 -1.106 0 CA-C-O 121.3 0.571 . . . . 0.0 109.608 178.29 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.491 ' HD3' ' HA ' ' A' ' 45' ' ' LYS . 30.9 mtpt -58.82 -45.9 88.88 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.204 -179.718 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.87 -30.56 65.54 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 121.282 0.563 . . . . 0.0 110.713 -179.383 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 5.6 m -68.67 -44.43 74.09 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-N 115.984 -0.553 . . . . 0.0 112.089 -179.754 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . 0.446 ' CE2' ' HA ' ' A' ' 48' ' ' LYS . 3.0 p90 -74.59 -33.55 62.66 Favored 'General case' 0 C--N 1.324 -0.541 0 C-N-CA 119.551 -0.86 . . . . 0.0 110.178 -178.936 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . 0.563 ' SG ' HD13 ' A' ' 62' ' ' LEU . 84.2 m -59.22 -46.87 87.31 Favored 'General case' 0 C--O 1.238 0.454 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.09 178.658 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 7.1 pt20 -68.06 -32.68 73.19 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 120.526 -0.469 . . . . 0.0 110.95 -179.217 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.409 ' HA ' ' NE ' ' A' ' 54' ' ' ARG . 1.6 mmp_? -59.42 -34.58 72.66 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-O 121.062 0.458 . . . . 0.0 111.662 177.669 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 3.2 mt-30 -81.81 -20.4 39.18 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-O 121.372 0.606 . . . . 0.0 110.286 179.034 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 82.2 28.9 39.04 Favored Glycine 0 N--CA 1.443 -0.872 0 CA-C-N 115.823 -0.626 . . . . 0.0 112.02 -179.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 33.9 m -131.45 145.95 59.83 Favored Pre-proline 0 C--N 1.326 -0.443 0 O-C-N 122.548 -0.384 . . . . 0.0 110.74 -179.313 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . 0.435 ' HG2' ' OG ' ' A' ' 61' ' ' SER . 28.0 Cg_endo -65.05 150.49 87.88 Favored 'Trans proline' 0 C--O 1.24 0.599 0 C-N-CA 122.513 2.142 . . . . 0.0 112.228 178.505 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.518 ' HG2' ' SG ' ' A' ' 52' ' ' CYS . 77.8 mtp -66.16 -13.66 60.57 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.851 -177.849 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 30.7 p30 -84.39 -12.78 53.85 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 121.507 0.67 . . . . 0.0 110.929 -178.456 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.435 ' OG ' ' HG2' ' A' ' 58' ' ' PRO . 70.6 m -87.79 -20.42 26.15 Favored 'General case' 0 C--N 1.309 -1.176 0 N-CA-C 112.407 0.521 . . . . 0.0 112.407 -178.072 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.563 HD13 ' SG ' ' A' ' 52' ' ' CYS . 1.4 pp -127.05 171.98 10.9 Favored 'General case' 0 C--N 1.309 -1.187 0 N-CA-C 113.487 0.921 . . . . 0.0 113.487 -176.327 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.465 ' O ' ' HA ' ' A' ' 90' ' ' VAL . 46.6 mtm180 -122.88 122.45 38.66 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.25 -0.886 . . . . 0.0 110.55 -177.358 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -105.5 118.63 37.07 Favored 'General case' 0 C--N 1.313 -1.007 0 CA-C-O 121.173 0.511 . . . . 0.0 111.248 179.561 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.476 ' HA ' HG12 ' A' ' 71' ' ' ILE . 0.0 OUTLIER -146.26 164.58 31.87 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 121.41 0.624 . . . . 0.0 111.034 179.613 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 88.1 t80 -142.88 134.92 27.12 Favored 'General case' 0 C--N 1.31 -1.143 0 N-CA-C 108.978 -0.749 . . . . 0.0 108.978 179.455 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 49.95 26.94 2.19 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 123.96 0.904 . . . . 0.0 112.268 -178.968 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 85.1 21.5 55.02 Favored Glycine 0 CA--C 1.523 0.534 0 C-N-CA 120.99 -0.624 . . . . 0.0 113.57 -178.598 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 3.2 pt20 -128.23 134.91 49.07 Favored 'General case' 0 C--N 1.322 -0.622 0 O-C-N 122.245 -0.562 . . . . 0.0 109.548 179.69 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -64.52 145.01 56.78 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-O 121.677 0.751 . . . . 0.0 111.09 177.473 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.476 HG12 ' HA ' ' A' ' 65' ' ' LEU . 22.3 mm -97.15 118.11 42.99 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.29 0 CA-C-O 121.142 0.496 . . . . 0.0 110.117 179.634 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -89.67 162.55 15.54 Favored 'General case' 0 N--CA 1.437 -1.116 0 N-CA-C 109.457 -0.572 . . . . 0.0 109.457 -179.83 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . 0.418 ' HB3' ' HB3' ' A' ' 45' ' ' LYS . 67.4 m-20 -65.47 -25.43 67.49 Favored 'General case' 0 C--N 1.313 -0.993 0 CA-C-O 121.609 0.719 . . . . 0.0 110.318 179.093 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 7.4 m-80 -97.46 9.21 42.99 Favored 'General case' 0 C--N 1.312 -1.041 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.178 -179.254 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . 0.512 ' O ' ' HB2' ' A' ' 44' ' ' LEU . 2.2 m170 -84.54 141.2 30.9 Favored 'General case' 0 CA--C 1.504 -0.798 0 N-CA-C 109.398 -0.593 . . . . 0.0 109.398 179.234 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 70.7 p -118.65 154.64 52.65 Favored Pre-proline 0 C--N 1.306 -1.324 0 C-N-CA 121.099 -0.24 . . . . 0.0 110.435 -179.891 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_exo -59.99 -39.47 70.34 Favored 'Trans proline' 0 N--CA 1.457 -0.637 0 C-N-CA 122.37 2.047 . . . . 0.0 111.459 179.861 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . 0.504 ' HG3' ' N ' ' A' ' 79' ' ' GLU . 37.6 pttt -68.96 -38.53 79.45 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 120.974 0.416 . . . . 0.0 111.163 -178.463 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . 0.504 ' N ' ' HG3' ' A' ' 78' ' ' LYS . 11.1 mm-40 -72.4 -34.07 67.61 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-O 120.994 0.426 . . . . 0.0 110.896 -178.266 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.439 HD22 ' CG ' ' A' ' 75' ' ' HIS . 5.8 mt -84.63 2.11 43.07 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.24 0.543 . . . . 0.0 111.021 179.624 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 73.84 41.2 42.5 Favored Glycine 0 C--O 1.237 0.335 0 C-N-CA 120.99 -0.624 . . . . 0.0 112.964 177.199 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 63.9 mtt -100.01 164.88 11.8 Favored 'General case' 0 C--N 1.313 -1.012 0 N-CA-C 109.233 -0.654 . . . . 0.0 109.233 178.857 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -144.23 -170.4 3.35 Favored 'General case' 0 C--N 1.31 -1.12 0 N-CA-C 110.096 -0.335 . . . . 0.0 110.096 178.606 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -64.44 141.53 58.74 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 120.707 0.289 . . . . 0.0 110.372 178.926 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 73.42 1.2 3.9 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 123.558 0.743 . . . . 0.0 112.211 176.814 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -61.89 160.87 11.35 Favored 'General case' 0 N--CA 1.476 0.871 0 CA-C-O 121.364 0.602 . . . . 0.0 111.521 -179.546 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . 0.409 ' HA ' ' O ' ' A' ' 25' ' ' LYS . 7.8 p -128.45 143.91 39.57 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.953 0 CA-C-O 121.429 0.633 . . . . 0.0 111.494 -177.09 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 3.7 mp -113.2 151.92 15.0 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.802 0 N-CA-C 109.245 -0.65 . . . . 0.0 109.245 179.144 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . 0.418 ' O ' HD11 ' A' ' 65' ' ' LEU . 6.2 tp10 -104.69 137.06 43.07 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.947 0.403 . . . . 0.0 110.47 -176.531 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . 0.465 ' HA ' ' O ' ' A' ' 63' ' ' ARG . 95.2 t -128.54 132.45 67.9 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.852 0 CA-C-O 121.282 0.563 . . . . 0.0 111.482 179.088 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 77.1 m-85 -115.0 179.17 4.03 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 178.663 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 7.9 tp60 -106.65 144.61 33.06 Favored 'General case' 0 C--N 1.311 -1.096 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 178.614 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 . . . . . 0 C--N 1.324 -0.515 0 CA-C-O 121.103 0.478 . . . . 0.0 110.706 176.253 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 18.5 pt . . . . . 0 N--CA 1.445 -0.722 0 CA-C-O 121.6 0.714 . . . . 0.0 110.427 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 31.5 mtmt -116.98 142.37 47.03 Favored 'General case' 0 C--N 1.299 -1.618 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 -179.04 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.0 mp -136.79 164.71 27.63 Favored 'General case' 0 C--N 1.308 -1.198 0 CA-C-O 121.187 0.518 . . . . 0.0 110.713 175.218 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.408 ' HE2' ' HB3' ' A' ' 25' ' ' LYS . 5.3 tmmm? -136.79 143.18 43.05 Favored 'General case' 0 C--N 1.313 -1.003 0 CA-C-O 121.254 0.55 . . . . 0.0 110.544 -178.982 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . 0.495 ' O ' ' HA ' ' A' ' 33' ' ' GLU . 1.0 OUTLIER -114.62 142.16 28.42 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.251 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.651 -179.647 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.43 HD12 ' HG2' ' A' ' 33' ' ' GLU . 32.9 mm -111.05 97.59 5.94 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.007 0 N-CA-C 108.117 -1.068 . . . . 0.0 108.117 175.752 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . 0.552 ' HA2' ' HB ' ' A' ' 90' ' ' VAL . . . -65.86 167.74 33.76 Favored Glycine 0 N--CA 1.437 -1.286 0 C-N-CA 120.506 -0.854 . . . . 0.0 113.127 178.924 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.22 -18.8 28.8 Favored 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 112.586 0.587 . . . . 0.0 112.586 177.753 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -102.76 13.49 34.28 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-O 121.519 0.676 . . . . 0.0 109.932 179.861 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 49.7 m 73.68 21.38 2.81 Favored 'General case' 0 CA--C 1.509 -0.617 0 CA-C-O 122.629 1.204 . . . . 0.0 108.39 -178.508 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -67.68 96.14 0.53 Allowed 'General case' 0 N--CA 1.424 -1.745 0 CA-C-N 113.362 -1.744 . . . . 0.0 111.474 -178.641 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.495 ' HA ' ' O ' ' A' ' 26' ' ' VAL . 15.0 mt-10 -78.74 104.32 9.28 Favored 'General case' 0 CA--C 1.496 -1.107 0 CA-C-O 121.138 0.494 . . . . 0.0 110.69 177.447 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.445 HG22 ' HA ' ' A' ' 51' ' ' TYR . 33.1 mm -97.67 132.58 42.14 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.319 0 N-CA-C 108.159 -1.052 . . . . 0.0 108.159 175.457 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 12.4 m170 -116.92 121.95 42.91 Favored 'General case' 0 C--N 1.317 -0.823 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 -176.958 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 1.5 p90 -137.93 162.26 34.5 Favored 'General case' 0 C--N 1.308 -1.225 0 CA-C-O 121.379 0.609 . . . . 0.0 111.292 -177.38 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 15.5 mtpt -124.38 115.84 21.61 Favored 'General case' 0 C--N 1.313 -0.979 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.646 -178.793 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 32.8 m -134.03 166.48 28.75 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.435 0 CA-C-O 121.073 0.463 . . . . 0.0 110.735 -178.296 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.523 ' O ' HG23 ' A' ' 42' ' ' THR . 84.2 tttt -89.65 167.85 12.59 Favored 'General case' 0 C--N 1.313 -1.021 0 O-C-N 122.035 -0.416 . . . . 0.0 110.538 -178.541 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -79.11 -37.12 39.48 Favored 'General case' 0 N--CA 1.464 0.26 0 N-CA-C 112.626 0.602 . . . . 0.0 112.626 -178.131 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 13.5 t -93.84 19.86 8.36 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-O 121.079 0.466 . . . . 0.0 111.688 -176.682 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' THR . . . . . 0.523 HG23 ' O ' ' A' ' 39' ' ' LYS . 6.7 t -99.76 173.28 6.77 Favored 'General case' 0 C--N 1.32 -0.708 0 O-C-N 122.006 -0.434 . . . . 0.0 109.961 179.844 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 29.8 m170 -88.04 142.31 27.88 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-O 121.491 0.662 . . . . 0.0 111.354 179.116 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.599 ' O ' ' HG3' ' A' ' 48' ' ' LYS . 0.2 OUTLIER -69.92 -18.34 63.37 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.54 -0.755 . . . . 0.0 109.725 -179.19 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.665 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -53.89 -44.71 70.71 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-N 115.849 -0.614 . . . . 0.0 112.305 -177.932 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . 0.483 ' N ' ' HD3' ' A' ' 45' ' ' LYS . 21.8 ptmt -67.41 -28.17 67.69 Favored 'General case' 0 CA--C 1.517 -0.29 0 CA-C-O 121.449 0.643 . . . . 0.0 110.538 -178.156 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.466 ' HB3' HD12 ' A' ' 44' ' ' LEU . 7.9 tt -72.08 -47.44 51.39 Favored 'General case' 0 C--N 1.313 -1.01 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.886 179.083 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.599 ' HG3' ' O ' ' A' ' 44' ' ' LEU . 29.5 mtpt -58.69 -48.3 81.59 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.419 -179.233 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.665 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 5.6 pt-20 -68.83 -31.9 71.21 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.709 -179.281 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 28.8 t -67.44 -46.11 74.07 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-O 121.028 0.442 . . . . 0.0 111.234 -178.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . 0.451 ' CD1' HG11 ' A' ' 26' ' ' VAL . 2.0 p90 -75.83 -32.78 59.95 Favored 'General case' 0 N--CA 1.445 -0.683 0 C-N-CA 119.801 -0.76 . . . . 0.0 110.544 -177.217 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . 0.539 ' SG ' ' HG2' ' A' ' 59' ' ' MET . 86.8 m -62.58 -44.41 96.38 Favored 'General case' 0 C--O 1.238 0.489 0 CA-C-O 120.85 0.357 . . . . 0.0 110.792 179.163 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 11.8 pt20 -67.96 -32.97 73.77 Favored 'General case' 0 N--CA 1.447 -0.585 0 C-N-CA 120.668 -0.413 . . . . 0.0 110.527 -179.828 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 15.9 mmt180 -57.78 -45.07 86.49 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-O 121.292 0.568 . . . . 0.0 111.115 177.433 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.443 ' NE2' ' HA ' ' A' ' 52' ' ' CYS . 3.2 mt-30 -71.36 -20.62 62.14 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.629 179.441 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 79.98 30.51 42.52 Favored Glycine 0 N--CA 1.441 -1.03 0 C-N-CA 120.861 -0.685 . . . . 0.0 111.558 -179.774 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 25.9 m -129.21 152.79 80.01 Favored Pre-proline 0 C--N 1.323 -0.555 0 O-C-N 122.502 -0.411 . . . . 0.0 110.723 -178.592 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . 0.413 ' HG2' ' OG ' ' A' ' 61' ' ' SER . 43.2 Cg_endo -71.45 150.61 58.27 Favored 'Trans proline' 0 N--CA 1.455 -0.772 0 C-N-CA 122.347 2.031 . . . . 0.0 111.903 177.538 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.539 ' HG2' ' SG ' ' A' ' 52' ' ' CYS . 79.8 mtp -70.37 -9.93 57.63 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.451 -177.443 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 33.6 p30 -84.52 -16.4 42.46 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.241 0.543 . . . . 0.0 111.365 -179.244 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.413 ' OG ' ' HG2' ' A' ' 58' ' ' PRO . 69.2 m -89.72 -20.63 23.36 Favored 'General case' 0 C--N 1.311 -1.101 0 N-CA-C 112.877 0.695 . . . . 0.0 112.877 -175.367 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.456 HD13 ' SG ' ' A' ' 52' ' ' CYS . 1.4 pp -124.09 170.95 10.17 Favored 'General case' 0 C--N 1.306 -1.309 0 N-CA-C 112.945 0.72 . . . . 0.0 112.945 -177.446 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.477 ' O ' ' HA ' ' A' ' 90' ' ' VAL . 47.2 mtm180 -121.66 120.76 35.67 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.674 -0.693 . . . . 0.0 110.844 -177.099 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -102.64 115.33 30.36 Favored 'General case' 0 C--N 1.311 -1.105 0 CA-C-O 121.084 0.469 . . . . 0.0 111.024 179.166 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.478 ' C ' HD23 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -144.38 164.15 31.67 Favored 'General case' 0 N--CA 1.445 -0.688 0 CA-C-O 121.469 0.652 . . . . 0.0 111.238 -179.769 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 83.2 t80 -143.62 134.15 24.88 Favored 'General case' 0 C--N 1.309 -1.192 0 N-CA-C 109.565 -0.532 . . . . 0.0 109.565 179.192 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 49.91 26.86 2.13 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 124.214 1.006 . . . . 0.0 112.75 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 87.45 20.89 50.44 Favored Glycine 0 N--CA 1.447 -0.613 0 C-N-CA 120.949 -0.643 . . . . 0.0 113.211 -179.596 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -128.55 134.34 48.62 Favored 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 108.766 -0.827 . . . . 0.0 108.766 179.181 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . 0.434 ' HE ' ' HB2' ' A' ' 70' ' ' ARG . 0.0 OUTLIER -72.44 144.95 47.94 Favored 'General case' 0 C--N 1.309 -1.157 0 O-C-N 121.66 -0.65 . . . . 0.0 110.706 179.349 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 22.3 mm -91.44 121.61 42.06 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.243 0 CA-C-O 121.321 0.582 . . . . 0.0 110.791 -178.276 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.415 ' O ' ' HB2' ' A' ' 75' ' ' HIS . . . -94.47 162.2 13.91 Favored 'General case' 0 N--CA 1.435 -1.18 0 N-CA-C 109.384 -0.598 . . . . 0.0 109.384 179.185 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 46.4 m-20 -69.42 -26.28 64.54 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-O 121.435 0.636 . . . . 0.0 110.558 -178.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 5.5 m-80 -93.19 4.72 53.52 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-O 121.311 0.577 . . . . 0.0 109.655 -178.763 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . 0.589 ' O ' ' HB2' ' A' ' 44' ' ' LEU . 8.4 m170 -83.13 146.22 28.78 Favored 'General case' 0 CA--C 1.496 -1.099 0 CA-C-N 116.222 -0.444 . . . . 0.0 109.906 -179.349 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 57.3 p -120.86 154.42 57.58 Favored Pre-proline 0 C--N 1.304 -1.412 0 C-N-CA 120.815 -0.354 . . . . 0.0 111.209 178.894 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -58.93 -39.72 78.38 Favored 'Trans proline' 0 C--N 1.348 0.508 0 C-N-CA 122.673 2.249 . . . . 0.0 111.758 179.334 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . 0.489 ' HG3' ' N ' ' A' ' 79' ' ' GLU . 29.0 pttt -68.92 -36.37 77.92 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.208 0.528 . . . . 0.0 110.792 -178.301 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . 0.489 ' N ' ' HG3' ' A' ' 78' ' ' LYS . 33.5 mm-40 -72.38 -41.16 66.64 Favored 'General case' 0 N--CA 1.444 -0.74 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.903 -179.124 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 5.5 mt -78.35 -3.51 43.43 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.084 0.468 . . . . 0.0 111.402 -179.011 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 78.14 45.0 10.63 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 121.001 -0.619 . . . . 0.0 112.858 177.153 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 61.0 mtt -105.05 164.98 11.4 Favored 'General case' 0 C--N 1.313 -1.019 0 N-CA-C 110.008 -0.367 . . . . 0.0 110.008 179.162 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -145.21 -169.64 3.25 Favored 'General case' 0 C--N 1.314 -0.97 0 N-CA-C 109.915 -0.402 . . . . 0.0 109.915 177.54 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -70.54 139.67 51.6 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 121.117 0.484 . . . . 0.0 110.98 -179.63 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 75.43 2.46 3.84 Favored 'General case' 0 C--O 1.239 0.531 0 C-N-CA 124.487 1.115 . . . . 0.0 111.266 179.969 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 7.9 t0 -62.34 157.54 19.57 Favored 'General case' 0 C--O 1.239 0.51 0 CA-C-O 121.37 0.605 . . . . 0.0 110.639 177.9 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 7.7 p -125.45 142.94 40.7 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.231 0 CA-C-O 121.457 0.646 . . . . 0.0 111.533 -176.485 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 3.6 mp -113.15 152.05 14.93 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.924 0 N-CA-C 108.809 -0.811 . . . . 0.0 108.809 178.704 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 13.8 tp10 -106.61 139.3 41.28 Favored 'General case' 0 C--N 1.314 -0.962 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 -176.4 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . 0.552 ' HB ' ' HA2' ' A' ' 28' ' ' GLY . 88.0 t -130.61 136.08 59.07 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.084 0 CA-C-O 121.358 0.599 . . . . 0.0 110.747 178.694 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 88.2 m-85 -120.39 -178.9 3.8 Favored 'General case' 0 C--N 1.311 -1.099 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 178.813 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 7.5 tp60 -105.76 148.96 26.89 Favored 'General case' 0 C--N 1.307 -1.247 0 N-CA-C 109.512 -0.551 . . . . 0.0 109.512 178.559 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 . . . . . 0 N--CA 1.469 0.52 0 CA-C-O 121.053 0.454 . . . . 0.0 111.076 175.975 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . 0.414 ' HB ' ' HA ' ' A' ' 84' ' ' GLU . 18.6 pt . . . . . 0 N--CA 1.436 -1.145 0 CA-C-O 121.305 0.574 . . . . 0.0 109.775 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 9.1 mtmt -118.27 140.57 49.61 Favored 'General case' 0 C--N 1.298 -1.667 0 N-CA-C 109.152 -0.684 . . . . 0.0 109.152 -178.387 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.5 mp -137.04 162.28 33.75 Favored 'General case' 0 C--N 1.305 -1.36 0 CA-C-O 121.354 0.597 . . . . 0.0 110.827 176.375 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.454 ' HG3' ' CD2' ' A' ' 35' ' ' HIS . 3.7 tmmt? -134.68 143.73 47.39 Favored 'General case' 0 C--N 1.308 -1.235 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.396 179.974 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . 0.591 HG12 ' CD1' ' A' ' 51' ' ' TYR . 0.9 OUTLIER -114.29 141.13 31.71 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.538 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.3 178.576 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.411 HD11 ' HZ1' ' A' ' 25' ' ' LYS . 32.0 mm -111.43 99.22 8.24 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.025 0 N-CA-C 108.403 -0.962 . . . . 0.0 108.403 175.414 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . 0.522 ' HA2' ' HB ' ' A' ' 90' ' ' VAL . . . -66.0 164.24 40.11 Favored Glycine 0 N--CA 1.424 -2.162 0 C-N-CA 120.63 -0.795 . . . . 0.0 113.625 179.124 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.06 -23.72 66.65 Favored 'General case' 0 C--N 1.308 -1.207 0 C-N-CA 123.785 0.834 . . . . 0.0 110.528 177.902 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -91.78 11.55 24.31 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.279 -0.873 . . . . 0.0 109.518 179.197 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 48.0 m 70.17 14.98 7.63 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-O 121.785 0.802 . . . . 0.0 110.319 -179.254 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 8.4 t -73.34 103.86 4.16 Favored 'General case' 0 N--CA 1.443 -0.801 0 CA-C-N 115.082 -0.963 . . . . 0.0 110.469 179.397 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.459 ' HA ' ' O ' ' A' ' 26' ' ' VAL . 1.3 mp0 -85.11 107.47 17.21 Favored 'General case' 0 CA--C 1.511 -0.543 0 CA-C-O 121.246 0.546 . . . . 0.0 109.981 178.834 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 29.8 mm -100.42 138.75 23.71 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.283 0 N-CA-C 109.72 -0.474 . . . . 0.0 109.72 -179.194 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . 0.454 ' CD2' ' HG3' ' A' ' 25' ' ' LYS . 11.6 m170 -118.38 131.38 56.3 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 -179.305 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 1.1 p90 -146.91 151.08 36.46 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-O 121.207 0.527 . . . . 0.0 111.305 -177.38 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 41.9 mmtm -108.78 119.61 40.05 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 -179.558 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 35.6 m -137.37 161.04 35.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-O 121.397 0.618 . . . . 0.0 111.331 -179.167 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.487 ' O ' HG22 ' A' ' 42' ' ' THR . 10.5 mmmt -83.28 161.12 21.56 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.78 178.896 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -74.71 -36.27 62.71 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-O 121.001 0.429 . . . . 0.0 111.319 179.833 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 8.5 t -94.19 10.76 32.65 Favored 'General case' 0 N--CA 1.443 -0.803 0 CA-C-O 121.405 0.621 . . . . 0.0 111.766 -177.085 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' THR . . . . . 0.487 HG22 ' O ' ' A' ' 39' ' ' LYS . 2.0 t -92.48 169.09 10.82 Favored 'General case' 0 C--N 1.323 -0.55 0 O-C-N 121.688 -0.633 . . . . 0.0 109.862 -178.857 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 27.9 m170 -82.77 141.89 32.0 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-O 121.483 0.659 . . . . 0.0 111.821 -179.795 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.637 ' O ' ' HG3' ' A' ' 48' ' ' LYS . 0.2 OUTLIER -70.48 -18.14 62.97 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 115.421 -0.808 . . . . 0.0 109.922 -179.662 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.659 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -52.32 -45.31 65.55 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.068 -0.514 . . . . 0.0 112.117 -178.467 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . 0.418 ' N ' ' HD3' ' A' ' 45' ' ' LYS . 16.3 ptmt -65.63 -29.59 70.18 Favored 'General case' 0 C--O 1.218 -0.581 0 CA-C-O 121.42 0.629 . . . . 0.0 110.47 -178.066 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.507 ' HB3' HD11 ' A' ' 44' ' ' LEU . 7.9 tt -73.86 -45.7 49.42 Favored 'General case' 0 C--N 1.309 -1.188 0 CA-C-N 115.481 -0.781 . . . . 0.0 109.716 179.939 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.637 ' HG3' ' O ' ' A' ' 44' ' ' LEU . 26.9 mtpt -58.7 -50.17 74.86 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-O 121.38 0.609 . . . . 0.0 110.156 -179.15 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.659 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 8.3 pt-20 -68.33 -33.76 74.89 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.865 -178.294 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 31.3 t -65.46 -46.74 78.65 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-O 121.201 0.524 . . . . 0.0 111.341 -178.674 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . 0.591 ' CD1' HG12 ' A' ' 26' ' ' VAL . 1.6 p90 -76.43 -33.14 58.79 Favored 'General case' 0 N--CA 1.441 -0.878 0 C-N-CA 120.061 -0.656 . . . . 0.0 110.541 -176.836 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . 0.46 ' SG ' ' HG2' ' A' ' 59' ' ' MET . 88.1 m -62.36 -45.36 93.53 Favored 'General case' 0 CA--C 1.509 -0.609 0 CA-C-O 121.098 0.475 . . . . 0.0 110.674 -179.97 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 13.5 pt20 -69.49 -32.36 71.19 Favored 'General case' 0 N--CA 1.441 -0.908 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.545 -179.269 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 30.8 mmt180 -57.2 -40.48 77.52 Favored 'General case' 0 C--N 1.342 0.278 0 CA-C-O 121.25 0.548 . . . . 0.0 110.834 176.937 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.401 HE21 ' HB2' ' A' ' 55' ' ' GLN . 3.0 mt-30 -78.25 -21.04 50.5 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.874 179.616 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 80.73 34.03 28.94 Favored Glycine 0 N--CA 1.443 -0.883 0 C-N-CA 120.946 -0.645 . . . . 0.0 112.163 179.705 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 34.7 m -134.25 150.44 74.07 Favored Pre-proline 0 C--N 1.325 -0.469 0 O-C-N 122.567 -0.373 . . . . 0.0 110.553 -179.918 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . 0.465 ' HG2' ' OG ' ' A' ' 61' ' ' SER . 37.1 Cg_endo -66.8 150.18 83.37 Favored 'Trans proline' 0 C--O 1.239 0.56 0 C-N-CA 122.496 2.131 . . . . 0.0 112.354 179.243 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.46 ' HG2' ' SG ' ' A' ' 52' ' ' CYS . 78.2 mtp -70.39 -14.32 62.51 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.396 -177.163 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 2.0 p-10 -88.73 -9.16 52.91 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-O 121.031 0.443 . . . . 0.0 111.899 -178.547 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.465 ' OG ' ' HG2' ' A' ' 58' ' ' PRO . 73.1 m -94.2 -16.51 23.61 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 112.195 0.442 . . . . 0.0 112.195 179.67 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.457 HD13 ' SG ' ' A' ' 52' ' ' CYS . 1.3 pp -125.44 162.49 24.72 Favored 'General case' 0 C--N 1.315 -0.896 0 N-CA-C 113.056 0.762 . . . . 0.0 113.056 -178.796 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.528 ' O ' ' HA ' ' A' ' 90' ' ' VAL . 3.2 mmp_? -109.19 118.4 36.64 Favored 'General case' 0 C--N 1.311 -1.07 0 CA-C-N 115.078 -0.965 . . . . 0.0 110.801 -177.876 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . 0.436 ' HB3' ' OH ' ' A' ' 51' ' ' TYR . 0.2 OUTLIER -102.54 113.05 26.08 Favored 'General case' 0 C--N 1.304 -1.372 0 CA-C-O 121.102 0.477 . . . . 0.0 110.388 176.044 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.454 ' C ' HD23 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -142.67 163.6 32.38 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-O 121.555 0.693 . . . . 0.0 111.231 -179.226 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 89.7 t80 -143.41 134.48 25.64 Favored 'General case' 0 C--N 1.309 -1.173 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 179.323 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 49.25 27.59 1.92 Allowed 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 124.04 0.936 . . . . 0.0 112.421 -179.51 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 85.64 22.28 50.88 Favored Glycine 0 CA--C 1.521 0.461 0 C-N-CA 121.069 -0.586 . . . . 0.0 113.167 -179.676 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -129.81 135.67 48.69 Favored 'General case' 0 C--N 1.323 -0.556 0 O-C-N 122.235 -0.567 . . . . 0.0 109.697 179.887 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -64.8 148.31 51.51 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-O 121.55 0.691 . . . . 0.0 110.988 177.764 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.406 HG12 ' HA ' ' A' ' 65' ' ' LEU . 22.6 mm -100.0 117.3 44.98 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.407 0 CA-C-O 121.101 0.476 . . . . 0.0 109.954 178.435 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.417 ' O ' ' HB2' ' A' ' 75' ' ' HIS . . . -93.79 163.77 13.39 Favored 'General case' 0 N--CA 1.436 -1.137 0 N-CA-C 109.755 -0.461 . . . . 0.0 109.755 -179.898 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 26.4 m-20 -69.82 -24.52 63.48 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-O 121.354 0.597 . . . . 0.0 111.064 -178.141 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 7.1 m-80 -95.38 5.56 51.31 Favored 'General case' 0 C--N 1.313 -1.001 0 CA-C-O 121.414 0.626 . . . . 0.0 109.42 -179.802 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . 0.551 ' O ' ' HB2' ' A' ' 44' ' ' LEU . 2.3 m170 -84.08 147.28 27.46 Favored 'General case' 0 CA--C 1.503 -0.853 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 -179.874 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.446 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 68.7 p -123.07 155.15 64.7 Favored Pre-proline 0 C--N 1.306 -1.316 0 CA-C-O 120.548 0.213 . . . . 0.0 110.949 179.255 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_exo -59.96 -38.62 77.43 Favored 'Trans proline' 0 N--CA 1.458 -0.581 0 C-N-CA 122.435 2.09 . . . . 0.0 111.277 178.724 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . 0.514 ' HG3' ' N ' ' A' ' 79' ' ' GLU . 33.7 pttt -67.09 -40.1 86.89 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.232 -178.663 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . 0.514 ' N ' ' HG3' ' A' ' 78' ' ' LYS . 65.7 mm-40 -72.88 -36.85 67.43 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-O 121.178 0.513 . . . . 0.0 110.937 -178.763 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.459 HD23 ' CG ' ' A' ' 75' ' ' HIS . 5.4 mt -79.64 -3.02 45.31 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.198 0.523 . . . . 0.0 110.895 -179.651 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 75.51 42.16 27.97 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 121.145 -0.55 . . . . 0.0 112.9 177.635 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 64.0 mtt -99.78 162.75 12.81 Favored 'General case' 0 C--N 1.312 -1.054 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 179.111 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . 0.501 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 11.3 pt-20 -142.42 -170.42 3.18 Favored 'General case' 0 C--N 1.31 -1.115 0 N-CA-C 109.975 -0.38 . . . . 0.0 109.975 177.641 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.414 ' HA ' ' HB ' ' A' ' 22' ' ' ILE . 11.3 pt-20 -70.65 143.84 51.29 Favored 'General case' 0 N--CA 1.441 -0.886 0 C-N-CA 120.121 -0.631 . . . . 0.0 110.644 -179.132 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 74.51 3.0 4.22 Favored 'General case' 0 C--N 1.322 -0.587 0 C-N-CA 124.078 0.951 . . . . 0.0 111.192 178.818 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . 0.501 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 1.8 t0 -63.11 158.48 19.64 Favored 'General case' 0 CA--C 1.513 -0.463 0 CA-C-O 121.325 0.584 . . . . 0.0 110.727 178.452 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 9.3 p -127.66 144.25 38.1 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.539 0 CA-C-O 121.351 0.595 . . . . 0.0 111.077 -177.496 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 3.6 mp -112.24 149.91 14.66 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.066 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 178.129 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . 0.417 ' O ' HD13 ' A' ' 65' ' ' LEU . 8.9 tp10 -104.72 137.52 42.41 Favored 'General case' 0 C--N 1.312 -1.041 0 N-CA-C 109.611 -0.514 . . . . 0.0 109.611 -176.001 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . 0.528 ' HA ' ' O ' ' A' ' 63' ' ' ARG . 65.3 t -126.12 131.9 71.13 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.895 0 CA-C-O 121.186 0.517 . . . . 0.0 111.08 178.81 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . 0.52 ' HB2' ' HB2' ' A' ' 63' ' ' ARG . 67.3 m-85 -114.18 176.15 5.16 Favored 'General case' 0 C--N 1.315 -0.909 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 179.644 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 10.4 tp60 -109.19 130.49 55.49 Favored 'General case' 0 C--N 1.304 -1.392 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 179.513 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 . . . . . 0 C--N 1.32 -0.709 0 CA-C-O 121.207 0.527 . . . . 0.0 110.45 178.038 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 23.4 pt . . . . . 0 N--CA 1.447 -0.619 0 CA-C-O 121.212 0.529 . . . . 0.0 110.13 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.515 ' HD3' ' N ' ' A' ' 23' ' ' LYS . 0.0 OUTLIER -121.14 143.07 49.3 Favored 'General case' 0 C--N 1.305 -1.35 0 N-CA-C 108.815 -0.809 . . . . 0.0 108.815 -178.751 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.5 mp -136.28 159.34 42.06 Favored 'General case' 0 C--N 1.3 -1.559 0 CA-C-O 121.194 0.521 . . . . 0.0 110.982 176.662 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.416 ' O ' ' HA ' ' A' ' 87' ' ' VAL . 5.3 tmmm? -126.82 142.45 51.54 Favored 'General case' 0 N--CA 1.439 -0.999 0 CA-C-O 121.513 0.673 . . . . 0.0 110.458 -179.404 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . 0.49 HG13 ' CD1' ' A' ' 51' ' ' TYR . 0.9 OUTLIER -117.57 142.23 32.72 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.458 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.975 -179.581 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.513 ' O ' ' HB ' ' A' ' 90' ' ' VAL . 48.5 mm -103.68 118.63 51.07 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.289 0 N-CA-C 107.164 -1.421 . . . . 0.0 107.164 174.318 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . 0.424 ' HA2' ' HB ' ' A' ' 90' ' ' VAL . . . -90.71 162.94 29.37 Favored Glycine 0 N--CA 1.419 -2.462 0 C-N-CA 120.049 -1.072 . . . . 0.0 111.717 -176.021 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.87 -25.32 64.97 Favored 'General case' 0 C--N 1.309 -1.153 0 CA-C-O 121.653 0.74 . . . . 0.0 110.72 176.356 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -82.0 1.44 35.57 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.199 177.451 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 9.7 m 73.52 13.18 4.53 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 122.216 1.008 . . . . 0.0 109.017 -175.413 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 2.9 t -76.91 116.46 17.59 Favored 'General case' 0 N--CA 1.44 -0.93 0 CA-C-N 114.46 -1.246 . . . . 0.0 110.475 -178.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.404 ' HA ' ' O ' ' A' ' 26' ' ' VAL . 45.1 mt-10 -89.49 110.78 21.58 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.286 0.565 . . . . 0.0 109.857 177.638 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 39.1 mm -99.8 137.76 26.28 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.44 0 N-CA-C 109.724 -0.472 . . . . 0.0 109.724 -178.928 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 12.5 m170 -117.91 132.41 56.41 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 108.648 -0.871 . . . . 0.0 108.648 179.514 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 1.3 p90 -145.39 168.0 21.56 Favored 'General case' 0 C--N 1.31 -1.11 0 CA-C-O 121.025 0.441 . . . . 0.0 111.026 -178.485 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 88.9 mttt -126.93 115.86 19.92 Favored 'General case' 0 N--CA 1.445 -0.677 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.542 -177.013 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 33.1 m -134.54 162.52 38.74 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 CA-C-O 120.964 0.411 . . . . 0.0 110.153 179.517 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.557 ' O ' HG22 ' A' ' 42' ' ' THR . 81.6 tttt -89.01 165.78 14.33 Favored 'General case' 0 C--N 1.31 -1.128 0 O-C-N 122.011 -0.431 . . . . 0.0 110.859 -179.155 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -73.45 -36.79 65.94 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 112.675 0.62 . . . . 0.0 112.675 -177.156 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 10.1 t -93.34 13.64 20.84 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 120.926 0.393 . . . . 0.0 111.814 -177.695 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' THR . . . . . 0.557 HG22 ' O ' ' A' ' 39' ' ' LYS . 3.4 t -95.37 173.14 7.67 Favored 'General case' 0 C--N 1.321 -0.664 0 C-N-CA 120.11 -0.636 . . . . 0.0 110.366 -179.248 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 34.5 m170 -92.39 141.65 28.3 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-O 121.432 0.634 . . . . 0.0 111.699 -178.854 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.472 ' HB2' ' O ' ' A' ' 75' ' ' HIS . 0.8 OUTLIER -63.87 -18.27 64.01 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.437 -0.801 . . . . 0.0 111.279 179.31 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.437 ' HA ' ' HD3' ' A' ' 48' ' ' LYS . 0.0 OUTLIER -51.07 -40.43 58.32 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.801 -179.751 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . 0.605 ' O ' ' HG3' ' A' ' 49' ' ' GLU . 19.2 mtpp -66.88 -46.0 76.3 Favored 'General case' 0 CA--C 1.488 -1.417 0 CA-C-O 121.95 0.881 . . . . 0.0 109.286 178.253 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 9.0 tt -60.14 -49.68 76.68 Favored 'General case' 0 C--N 1.291 -1.948 0 CA-C-N 114.616 -1.175 . . . . 0.0 110.11 -176.044 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.507 ' HA ' ' CE2' ' A' ' 51' ' ' TYR . 29.9 mtpt -59.26 -46.51 88.32 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.745 -0.661 . . . . 0.0 111.018 179.46 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.605 ' HG3' ' O ' ' A' ' 46' ' ' LYS . 1.4 pp20? -71.92 -30.68 65.59 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 121.336 0.589 . . . . 0.0 110.406 -178.346 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 17.8 m -70.42 -42.64 71.35 Favored 'General case' 0 N--CA 1.44 -0.954 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.943 -179.338 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . 0.507 ' CE2' ' HA ' ' A' ' 48' ' ' LYS . 3.0 p90 -76.3 -32.87 58.98 Favored 'General case' 0 C--N 1.321 -0.649 0 C-N-CA 119.3 -0.96 . . . . 0.0 110.102 179.182 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . 0.522 ' SG ' HD12 ' A' ' 62' ' ' LEU . 47.4 m -60.82 -44.08 97.39 Favored 'General case' 0 CA--C 1.512 -0.483 0 CA-C-O 120.975 0.417 . . . . 0.0 110.691 177.749 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 12.3 pt20 -66.76 -35.06 79.21 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.58 179.463 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 2.5 mmm180 -59.02 -30.12 67.77 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-O 121.006 0.432 . . . . 0.0 111.246 177.024 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.458 HE21 ' HB2' ' A' ' 55' ' ' GLN . 3.5 mt-30 -90.4 -21.74 21.8 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 120.953 0.406 . . . . 0.0 110.844 179.602 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 78.85 34.03 35.5 Favored Glycine 0 N--CA 1.444 -0.772 0 C-N-CA 120.492 -0.861 . . . . 0.0 111.897 179.722 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 33.4 m -134.02 150.18 73.64 Favored Pre-proline 0 C--N 1.327 -0.401 0 O-C-N 122.543 -0.386 . . . . 0.0 110.417 -179.213 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . 0.488 ' HG2' ' OG ' ' A' ' 61' ' ' SER . 28.6 Cg_endo -64.12 150.9 87.39 Favored 'Trans proline' 0 N--CA 1.46 -0.498 0 C-N-CA 122.681 2.254 . . . . 0.0 112.269 179.199 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.429 ' HG2' ' SG ' ' A' ' 52' ' ' CYS . 74.4 mtp -73.07 -10.32 59.67 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.12 -178.142 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 2.2 p-10 -91.87 -9.68 42.43 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.232 -179.457 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.488 ' OG ' ' HG2' ' A' ' 58' ' ' PRO . 68.4 m -93.87 -12.89 27.94 Favored 'General case' 0 C--N 1.317 -0.807 0 N-CA-C 113.127 0.788 . . . . 0.0 113.127 -179.406 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.522 HD12 ' SG ' ' A' ' 52' ' ' CYS . 1.3 pp -128.26 165.56 20.28 Favored 'General case' 0 C--N 1.308 -1.213 0 O-C-N 121.638 -0.664 . . . . 0.0 112.726 -179.349 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.557 ' O ' ' HA ' ' A' ' 90' ' ' VAL . 3.7 mmp_? -111.95 118.12 34.61 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.814 -177.361 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -103.06 113.75 27.48 Favored 'General case' 0 C--N 1.302 -1.461 0 CA-C-O 120.94 0.4 . . . . 0.0 110.559 176.026 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.464 ' C ' HD22 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -142.25 161.21 38.61 Favored 'General case' 0 N--CA 1.445 -0.685 0 CA-C-O 121.605 0.716 . . . . 0.0 111.438 -179.455 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 93.7 t80 -144.63 136.73 26.1 Favored 'General case' 0 C--N 1.311 -1.093 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 179.061 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 48.88 27.06 1.48 Allowed 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 124.358 1.063 . . . . 0.0 112.631 -179.368 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 84.62 25.43 42.42 Favored Glycine 0 N--CA 1.447 -0.593 0 C-N-CA 120.806 -0.712 . . . . 0.0 113.025 -179.112 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -131.95 137.66 48.02 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 178.896 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -74.31 145.36 44.0 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-O 121.324 0.583 . . . . 0.0 109.747 178.492 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 23.6 mm -90.36 119.93 38.33 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.606 0 CA-C-O 121.15 0.5 . . . . 0.0 110.622 -178.508 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -90.64 163.46 14.53 Favored 'General case' 0 N--CA 1.437 -1.075 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 179.636 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . 0.416 ' HB3' ' HB3' ' A' ' 45' ' ' LYS . 59.6 m-20 -71.17 -21.38 62.17 Favored 'General case' 0 C--N 1.313 -1.007 0 CA-C-O 121.627 0.727 . . . . 0.0 110.362 -179.818 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 9.0 m-80 -97.73 6.83 47.4 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.735 -0.666 . . . . 0.0 109.504 179.528 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . 0.472 ' O ' ' HB2' ' A' ' 44' ' ' LEU . 3.4 m170 -82.81 140.74 32.78 Favored 'General case' 0 CA--C 1.508 -0.664 0 N-CA-C 109.538 -0.542 . . . . 0.0 109.538 178.858 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.404 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 67.0 p -117.73 154.77 51.08 Favored Pre-proline 0 C--N 1.309 -1.154 0 CA-C-O 120.45 0.166 . . . . 0.0 110.703 179.601 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -59.57 -39.79 71.74 Favored 'Trans proline' 0 N--CA 1.458 -0.576 0 C-N-CA 122.439 2.093 . . . . 0.0 111.43 179.129 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . 0.488 ' HG3' ' N ' ' A' ' 79' ' ' GLU . 28.2 pttt -67.77 -38.92 84.06 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.225 -178.013 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . 0.488 ' N ' ' HG3' ' A' ' 78' ' ' LYS . 9.4 mm-40 -73.32 -36.26 66.18 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.929 0.395 . . . . 0.0 110.953 -178.291 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.452 HD23 ' CG ' ' A' ' 75' ' ' HIS . 5.8 mt -82.3 2.72 30.72 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.212 0.529 . . . . 0.0 110.996 -179.704 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 72.62 39.6 55.58 Favored Glycine 0 N--CA 1.453 -0.188 0 C-N-CA 120.962 -0.637 . . . . 0.0 112.618 177.745 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 65.0 mtt -98.55 162.5 13.11 Favored 'General case' 0 C--N 1.312 -1.046 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 179.514 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -143.59 -170.74 3.37 Favored 'General case' 0 C--N 1.306 -1.293 0 CA-C-O 120.803 0.335 . . . . 0.0 110.201 -179.563 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.417 ' O ' ' HB2' ' A' ' 85' ' ' GLU . 5.6 pt-20 -70.84 136.01 48.44 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 120.994 0.426 . . . . 0.0 110.829 179.875 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . 0.417 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 16.1 mm-40 74.25 5.58 4.64 Favored 'General case' 0 C--O 1.238 0.485 0 C-N-CA 124.008 0.923 . . . . 0.0 111.813 178.356 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 6.2 t0 -60.54 160.37 9.09 Favored 'General case' 0 C--O 1.238 0.453 0 CA-C-O 121.271 0.558 . . . . 0.0 110.874 176.109 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . 0.416 ' HA ' ' O ' ' A' ' 25' ' ' LYS . 7.5 p -126.54 143.62 39.42 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.002 0 CA-C-O 121.255 0.55 . . . . 0.0 111.443 -177.238 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 3.7 mp -116.1 153.72 17.68 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 179.063 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -106.11 138.76 41.73 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.923 0.392 . . . . 0.0 110.37 -176.737 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . 0.557 ' HA ' ' O ' ' A' ' 63' ' ' ARG . 89.4 t -128.33 134.38 64.96 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-O 121.389 0.614 . . . . 0.0 111.475 178.987 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . 0.546 ' HB2' ' HB2' ' A' ' 63' ' ' ARG . 70.4 m-85 -116.31 176.24 5.19 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.85 -0.614 . . . . 0.0 109.693 178.536 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 9.3 tp60 -108.41 129.58 55.25 Favored 'General case' 0 C--N 1.31 -1.109 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 178.429 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 . . . . . 0 C--N 1.323 -0.576 0 CA-C-O 121.079 0.466 . . . . 0.0 110.629 178.177 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 27.9 pt . . . . . 0 N--CA 1.442 -0.859 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 6.8 mtmt -112.37 145.9 39.28 Favored 'General case' 0 C--N 1.289 -2.055 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 -178.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.6 mp -140.84 160.29 40.37 Favored 'General case' 0 C--N 1.302 -1.459 0 CA-C-O 121.21 0.529 . . . . 0.0 110.797 173.799 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.409 ' HE2' ' HB3' ' A' ' 25' ' ' LYS . 5.1 tmmm? -132.74 142.69 49.16 Favored 'General case' 0 C--N 1.312 -1.039 0 CA-C-O 121.391 0.615 . . . . 0.0 110.721 -179.088 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . 0.502 ' O ' ' HA ' ' A' ' 33' ' ' GLU . 0.9 OUTLIER -117.27 141.18 36.94 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.439 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.608 -179.991 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.462 ' O ' ' HB ' ' A' ' 90' ' ' VAL . 43.7 mm -104.24 114.77 44.72 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.037 0 N-CA-C 107.409 -1.33 . . . . 0.0 107.409 174.378 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . 0.45 ' HA2' ' HB ' ' A' ' 90' ' ' VAL . . . -87.01 162.84 34.21 Favored Glycine 0 N--CA 1.423 -2.207 0 C-N-CA 119.856 -1.164 . . . . 0.0 111.241 -177.337 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.68 -30.07 30.02 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-O 121.116 0.484 . . . . 0.0 112.258 177.175 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -93.55 13.62 21.34 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-O 121.272 0.558 . . . . 0.0 110.193 -179.301 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 23.6 m 74.65 21.01 2.28 Favored 'General case' 0 CA--C 1.504 -0.811 0 CA-C-O 122.623 1.201 . . . . 0.0 108.396 -178.91 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 2.5 m -68.78 94.57 0.61 Allowed 'General case' 0 N--CA 1.425 -1.721 0 CA-C-N 113.295 -1.775 . . . . 0.0 111.763 -179.164 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.502 ' HA ' ' O ' ' A' ' 26' ' ' VAL . 37.9 mt-10 -82.33 104.08 12.38 Favored 'General case' 0 CA--C 1.506 -0.746 0 C-N-CA 120.369 -0.532 . . . . 0.0 110.265 176.968 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.422 HG21 ' HA ' ' A' ' 51' ' ' TYR . 36.8 mm -100.18 133.73 42.21 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.767 0 N-CA-C 108.963 -0.755 . . . . 0.0 108.963 178.419 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 12.5 m170 -113.34 128.81 56.58 Favored 'General case' 0 C--N 1.316 -0.854 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 -179.43 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 1.1 p90 -140.91 149.08 41.43 Favored 'General case' 0 C--N 1.306 -1.301 0 CA-C-O 121.488 0.661 . . . . 0.0 111.311 -177.937 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 96.3 mttt -113.97 105.65 13.49 Favored 'General case' 0 C--N 1.31 -1.117 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.859 -178.691 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . 0.462 ' HB ' HG21 ' A' ' 42' ' ' THR . 14.6 m -129.88 162.58 37.29 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.277 -177.592 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.412 ' O ' HG23 ' A' ' 42' ' ' THR . 46.3 mtpt -79.46 178.32 8.2 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-O 121.731 0.777 . . . . 0.0 112.093 -178.779 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -87.59 -31.03 20.06 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.538 -0.756 . . . . 0.0 109.91 178.3 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 10.2 t -92.87 13.0 21.76 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 115.617 -0.719 . . . . 0.0 111.465 -177.631 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' THR . . . . . 0.462 HG21 ' HB ' ' A' ' 38' ' ' VAL . 6.4 t -94.56 162.83 13.64 Favored 'General case' 0 C--N 1.318 -0.795 0 O-C-N 122.029 -0.419 . . . . 0.0 109.974 -178.371 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . 0.498 ' O ' ' HG3' ' A' ' 46' ' ' LYS . 24.5 m170 -85.37 141.15 30.21 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-O 121.033 0.444 . . . . 0.0 110.149 177.838 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.651 ' O ' ' HG3' ' A' ' 48' ' ' LYS . 0.5 OUTLIER -63.76 -20.28 65.64 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.888 -179.898 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.703 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -50.7 -47.29 59.04 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 112.173 0.435 . . . . 0.0 112.173 -178.476 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . 0.498 ' HG3' ' O ' ' A' ' 43' ' ' HIS . 0.0 OUTLIER -68.84 -30.11 68.59 Favored 'General case' 0 C--O 1.222 -0.363 0 CA-C-O 121.165 0.507 . . . . 0.0 110.964 -178.872 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 7.8 tt -72.19 -48.53 42.53 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.549 178.559 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.651 ' HG3' ' O ' ' A' ' 44' ' ' LEU . 24.4 mtpt -57.16 -46.6 82.63 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-O 121.374 0.607 . . . . 0.0 110.46 -178.463 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.703 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 8.3 pt-20 -71.95 -32.94 67.79 Favored 'General case' 0 C--N 1.312 -1.052 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.692 -179.166 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' SER . . . . . 0.536 ' O ' ' HG2' ' A' ' 54' ' ' ARG . 23.2 t -62.18 -46.23 89.88 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-O 121.01 0.433 . . . . 0.0 110.699 -179.178 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . 0.474 ' CD1' HG13 ' A' ' 26' ' ' VAL . 2.4 p90 -75.39 -33.0 60.96 Favored 'General case' 0 N--CA 1.441 -0.924 0 C-N-CA 119.744 -0.783 . . . . 0.0 110.701 -178.064 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . 0.549 ' SG ' ' HG2' ' A' ' 59' ' ' MET . 97.0 m -63.08 -45.89 90.0 Favored 'General case' 0 CA--C 1.509 -0.615 0 CA-C-O 121.08 0.467 . . . . 0.0 110.644 179.607 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -66.8 -34.45 77.85 Favored 'General case' 0 N--CA 1.442 -0.847 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.476 -179.499 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.536 ' HG2' ' O ' ' A' ' 50' ' ' SER . 40.0 mmt180 -57.23 -40.44 77.56 Favored 'General case' 0 C--N 1.349 0.572 0 CA-C-O 121.105 0.478 . . . . 0.0 111.153 176.813 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.503 ' NE2' ' HA ' ' A' ' 52' ' ' CYS . 2.8 mt-30 -77.24 -21.45 53.73 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.028 0.442 . . . . 0.0 110.982 -179.335 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 80.63 38.28 17.41 Favored Glycine 0 N--CA 1.443 -0.863 0 C-N-CA 120.674 -0.774 . . . . 0.0 111.793 -179.908 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 29.9 m -140.67 149.19 55.98 Favored Pre-proline 0 C--N 1.327 -0.392 0 N-CA-C 110.172 -0.307 . . . . 0.0 110.172 -179.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -66.07 150.7 85.1 Favored 'Trans proline' 0 C--O 1.241 0.674 0 C-N-CA 122.325 2.016 . . . . 0.0 111.964 178.529 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.549 ' HG2' ' SG ' ' A' ' 52' ' ' CYS . 81.2 mtp -69.19 -8.87 49.66 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.95 -176.845 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 22.8 p30 -91.94 -12.46 33.36 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-O 121.134 0.492 . . . . 0.0 111.534 -178.476 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 75.3 m -84.28 -23.14 30.46 Favored 'General case' 0 N--CA 1.442 -0.831 0 CA-C-O 121.225 0.536 . . . . 0.0 111.391 179.848 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.523 HD11 ' SG ' ' A' ' 52' ' ' CYS . 2.0 pp -131.82 151.96 51.32 Favored 'General case' 0 C--N 1.309 -1.183 0 CA-C-O 121.549 0.69 . . . . 0.0 112.204 -178.231 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.432 ' O ' ' HA ' ' A' ' 90' ' ' VAL . 1.1 ptp180 -109.97 139.96 44.51 Favored 'General case' 0 C--N 1.312 -1.06 0 CA-C-O 121.5 0.667 . . . . 0.0 112.657 -179.417 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -112.3 119.71 39.23 Favored 'General case' 0 C--N 1.311 -1.077 0 CA-C-N 114.96 -1.018 . . . . 0.0 110.726 -177.969 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.457 ' C ' HD23 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -142.79 164.23 30.65 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-O 121.327 0.584 . . . . 0.0 111.101 178.955 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 88.4 t80 -145.68 134.12 21.94 Favored 'General case' 0 C--N 1.312 -1.053 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 179.091 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 6.5 pt-20 49.1 28.08 1.98 Allowed 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 124.155 0.982 . . . . 0.0 112.102 -179.351 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 84.55 25.26 43.37 Favored Glycine 0 N--CA 1.447 -0.571 0 C-N-CA 120.848 -0.692 . . . . 0.0 113.195 -178.906 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 3.0 pt20 -131.63 134.68 46.25 Favored 'General case' 0 C--N 1.32 -0.695 0 O-C-N 122.21 -0.582 . . . . 0.0 109.893 178.681 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . 0.425 ' HD3' ' N ' ' A' ' 70' ' ' ARG . 0.0 OUTLIER -65.77 144.1 57.09 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-O 121.553 0.692 . . . . 0.0 110.43 176.767 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 23.3 mm -94.5 119.79 42.98 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.573 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 179.471 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -98.02 162.9 13.0 Favored 'General case' 0 N--CA 1.438 -1.031 0 CA-C-O 120.909 0.385 . . . . 0.0 110.0 -178.237 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . 0.454 ' HB3' ' HB3' ' A' ' 45' ' ' LYS . 62.0 m-20 -67.65 -23.75 65.37 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-O 121.375 0.607 . . . . 0.0 111.381 -178.511 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 3.1 m-80 -97.25 4.93 50.77 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-O 121.433 0.635 . . . . 0.0 109.69 -178.719 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . 0.521 ' O ' ' HB2' ' A' ' 44' ' ' LEU . 5.9 m170 -84.72 142.69 29.67 Favored 'General case' 0 CA--C 1.504 -0.826 0 CA-C-N 116.187 -0.46 . . . . 0.0 109.768 179.908 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 81.8 p -117.29 154.0 50.13 Favored Pre-proline 0 C--N 1.304 -1.401 0 CA-C-N 116.631 -0.259 . . . . 0.0 110.792 179.177 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_exo -60.33 -37.71 80.16 Favored 'Trans proline' 0 N--CA 1.456 -0.68 0 C-N-CA 122.435 2.09 . . . . 0.0 111.204 179.298 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . 0.459 ' HG3' ' N ' ' A' ' 79' ' ' GLU . 34.5 pttt -68.93 -35.88 77.32 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.14 -178.279 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . 0.459 ' N ' ' HG3' ' A' ' 78' ' ' LYS . 14.4 mm-40 -76.61 -37.35 56.57 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-O 121.039 0.447 . . . . 0.0 111.322 -178.898 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.463 HD22 ' CG ' ' A' ' 75' ' ' HIS . 5.2 mt -78.72 -5.16 52.42 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.241 0.543 . . . . 0.0 110.627 179.626 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 78.73 43.43 11.72 Favored Glycine 0 N--CA 1.45 -0.368 0 CA-C-N 115.884 -0.598 . . . . 0.0 112.883 176.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 61.1 mtt -101.89 162.29 13.02 Favored 'General case' 0 C--N 1.312 -1.025 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 178.652 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -138.14 -170.98 2.92 Favored 'General case' 0 C--N 1.313 -1.016 0 N-CA-C 110.04 -0.356 . . . . 0.0 110.04 179.506 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -70.11 129.38 39.25 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-O 121.273 0.559 . . . . 0.0 111.049 179.755 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 76.25 11.98 2.78 Favored 'General case' 0 C--N 1.316 -0.865 0 C-N-CA 124.312 1.045 . . . . 0.0 112.399 178.216 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -66.11 167.24 10.34 Favored 'General case' 0 C--O 1.239 0.551 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.107 174.332 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . 0.407 ' HA ' ' O ' ' A' ' 25' ' ' LYS . 8.8 p -129.39 145.27 35.99 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.105 0 CA-C-O 121.298 0.57 . . . . 0.0 111.751 -176.928 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 3.8 mp -115.82 153.71 17.37 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.741 0 N-CA-C 108.63 -0.878 . . . . 0.0 108.63 178.824 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -106.35 137.66 43.92 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 120.981 0.42 . . . . 0.0 110.491 -176.149 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . 0.462 ' HB ' ' O ' ' A' ' 27' ' ' ILE . 97.9 t -129.61 135.89 60.43 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.909 0 CA-C-O 121.254 0.55 . . . . 0.0 110.821 178.971 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . 0.406 ' HB2' ' HG3' ' A' ' 63' ' ' ARG . 84.5 m-85 -122.77 171.75 8.95 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.065 179.853 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 9.0 tp60 -97.49 135.83 38.78 Favored 'General case' 0 C--N 1.308 -1.205 0 N-CA-C 109.779 -0.452 . . . . 0.0 109.779 179.482 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 . . . . . 0 C--N 1.321 -0.667 0 CA-C-O 121.306 0.574 . . . . 0.0 110.764 176.994 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 29.0 pt . . . . . 0 N--CA 1.448 -0.559 0 CA-C-O 121.785 0.803 . . . . 0.0 110.632 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.402 ' HE3' ' HG3' ' A' ' 85' ' ' GLU . 11.2 mtmt -115.57 145.86 42.28 Favored 'General case' 0 C--N 1.295 -1.781 0 CA-C-N 115.791 -0.641 . . . . 0.0 109.54 -178.356 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.0 mp -141.03 163.48 32.85 Favored 'General case' 0 C--N 1.306 -1.289 0 CA-C-O 121.213 0.53 . . . . 0.0 111.335 174.25 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.498 ' NZ ' HD13 ' A' ' 27' ' ' ILE . 3.1 tmmt? -135.52 144.26 46.21 Favored 'General case' 0 N--CA 1.445 -0.71 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.568 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . 0.557 ' O ' ' HA ' ' A' ' 33' ' ' GLU . 0.9 OUTLIER -114.41 142.48 26.97 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.121 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.891 179.886 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.498 HD13 ' NZ ' ' A' ' 25' ' ' LYS . 41.4 mm -110.94 97.71 6.09 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.842 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 176.079 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . 0.525 ' HA2' ' HB ' ' A' ' 90' ' ' VAL . . . -66.21 165.06 39.71 Favored Glycine 0 N--CA 1.434 -1.476 0 C-N-CA 120.646 -0.787 . . . . 0.0 113.918 178.691 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.91 -19.48 18.04 Favored 'General case' 0 C--N 1.315 -0.933 0 C-N-CA 124.286 1.034 . . . . 0.0 112.411 178.906 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.415 ' O ' ' HB2' ' A' ' 31' ' ' SER . 23.4 t70 -106.9 13.4 27.76 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.521 0.677 . . . . 0.0 110.03 -179.039 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' SER . . . . . 0.415 ' HB2' ' O ' ' A' ' 30' ' ' ASP . 62.6 m 74.72 23.6 1.78 Allowed 'General case' 0 CA--C 1.506 -0.742 0 CA-C-O 122.768 1.271 . . . . 0.0 108.076 -178.076 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 9.6 m -71.09 91.51 0.91 Allowed 'General case' 0 N--CA 1.426 -1.655 0 CA-C-N 113.384 -1.734 . . . . 0.0 110.411 179.096 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.557 ' HA ' ' O ' ' A' ' 26' ' ' VAL . 24.8 mt-10 -83.09 107.33 15.59 Favored 'General case' 0 CA--C 1.511 -0.555 0 CA-C-O 121.279 0.561 . . . . 0.0 110.887 -179.816 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 28.2 mm -103.65 138.12 29.43 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.242 0 N-CA-C 109.147 -0.686 . . . . 0.0 109.147 178.637 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . 0.401 ' CD2' ' HG3' ' A' ' 25' ' ' LYS . 12.3 m170 -115.45 133.64 55.84 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 -179.915 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -146.6 165.31 29.89 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-O 121.141 0.496 . . . . 0.0 111.035 -177.997 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 64.7 mmtt -123.79 115.33 21.18 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.14 -0.482 . . . . 0.0 109.912 -177.683 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 20.3 m -136.79 154.5 31.85 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-O 120.91 0.386 . . . . 0.0 110.346 179.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.564 ' O ' HG21 ' A' ' 42' ' ' THR . 83.4 tttt -81.14 163.03 23.4 Favored 'General case' 0 C--N 1.314 -0.955 0 O-C-N 121.837 -0.54 . . . . 0.0 111.07 -178.663 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' MET . . . . . 0.475 ' O ' ' HG2' ' A' ' 78' ' ' LYS . 0.0 OUTLIER -68.64 -39.59 80.68 Favored 'General case' 0 N--CA 1.466 0.327 0 O-C-N 121.905 -0.497 . . . . 0.0 111.986 -177.785 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 14.9 t -93.23 13.39 21.37 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-O 121.167 0.508 . . . . 0.0 111.742 -175.777 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' THR . . . . . 0.564 HG21 ' O ' ' A' ' 39' ' ' LYS . 2.2 t -92.95 164.37 13.32 Favored 'General case' 0 C--N 1.323 -0.57 0 O-C-N 121.833 -0.542 . . . . 0.0 110.34 -179.031 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . 0.488 ' O ' ' HG2' ' A' ' 46' ' ' LYS . 17.2 m170 -77.12 139.55 39.99 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.42 0.628 . . . . 0.0 111.146 178.93 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.615 ' HB2' ' O ' ' A' ' 75' ' ' HIS . 0.2 OUTLIER -70.03 -17.6 63.27 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 115.68 -0.691 . . . . 0.0 109.516 -179.224 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.738 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -53.94 -45.64 71.31 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.963 -178.456 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . 0.488 ' HG2' ' O ' ' A' ' 43' ' ' HIS . 13.6 ptmm? -63.5 -30.15 71.32 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 121.563 0.697 . . . . 0.0 110.61 -178.649 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.51 ' HB3' HD13 ' A' ' 44' ' ' LEU . 8.2 tt -72.44 -48.91 37.42 Favored 'General case' 0 C--N 1.31 -1.139 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.085 179.37 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.575 ' HG3' ' O ' ' A' ' 44' ' ' LEU . 27.0 mtpt -58.57 -46.84 86.07 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 121.321 0.581 . . . . 0.0 110.619 -178.292 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.738 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 5.9 pt-20 -70.3 -31.55 68.94 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.683 -179.167 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 26.6 t -67.28 -45.85 75.39 Favored 'General case' 0 N--CA 1.455 -0.193 0 CA-C-O 121.102 0.477 . . . . 0.0 111.32 -179.129 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . 0.439 ' CD1' HG12 ' A' ' 26' ' ' VAL . 2.1 p90 -76.03 -32.53 59.4 Favored 'General case' 0 N--CA 1.443 -0.784 0 C-N-CA 119.613 -0.835 . . . . 0.0 110.359 -176.992 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . 0.495 ' SG ' ' HG2' ' A' ' 59' ' ' MET . 85.1 m -63.01 -43.65 98.19 Favored 'General case' 0 CA--C 1.513 -0.449 0 CA-C-O 120.969 0.414 . . . . 0.0 110.864 178.878 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 12.7 pt20 -68.74 -33.58 74.15 Favored 'General case' 0 N--CA 1.448 -0.546 0 C-N-CA 120.513 -0.475 . . . . 0.0 110.419 -179.638 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.486 ' HA ' ' NE ' ' A' ' 54' ' ' ARG . 3.2 mmp_? -57.79 -43.45 85.62 Favored 'General case' 0 C--N 1.341 0.236 0 CA-C-O 121.233 0.54 . . . . 0.0 111.117 177.319 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.415 HE21 ' HB2' ' A' ' 55' ' ' GLN . 2.9 mt-30 -75.33 -20.24 59.16 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 121.222 0.534 . . . . 0.0 110.814 179.299 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 79.94 29.39 47.02 Favored Glycine 0 N--CA 1.446 -0.698 0 C-N-CA 121.056 -0.592 . . . . 0.0 112.044 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 34.7 m -129.47 148.99 71.57 Favored Pre-proline 0 C--N 1.322 -0.607 0 O-C-N 122.48 -0.423 . . . . 0.0 110.981 -178.527 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . 0.5 ' HG2' ' OG ' ' A' ' 61' ' ' SER . 33.5 Cg_endo -66.99 150.87 82.82 Favored 'Trans proline' 0 N--CA 1.456 -0.728 0 C-N-CA 122.459 2.106 . . . . 0.0 112.296 178.713 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.495 ' HG2' ' SG ' ' A' ' 52' ' ' CYS . 75.8 mtp -70.61 -8.83 54.57 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.589 -177.086 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.8 p-10 -92.37 -9.74 40.68 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.662 -179.466 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.5 ' OG ' ' HG2' ' A' ' 58' ' ' PRO . 70.0 m -89.64 -22.78 22.13 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-O 121.016 0.436 . . . . 0.0 111.703 -179.182 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 1.2 pp -126.05 171.15 11.05 Favored 'General case' 0 C--N 1.314 -0.978 0 O-C-N 121.965 -0.46 . . . . 0.0 111.996 -178.69 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.5 ' CG ' ' HB3' ' A' ' 93' ' ' GLU . 57.1 mtp180 -122.38 122.8 39.88 Favored 'General case' 0 CA--C 1.506 -0.744 0 CA-C-O 120.967 0.413 . . . . 0.0 110.663 -177.698 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -100.83 115.01 29.33 Favored 'General case' 0 C--N 1.304 -1.384 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.614 177.671 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.457 ' C ' HD23 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -143.87 162.01 37.21 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-O 121.46 0.648 . . . . 0.0 111.396 179.728 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 87.1 t80 -143.18 135.56 27.28 Favored 'General case' 0 C--N 1.306 -1.304 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 179.002 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 49.62 31.12 3.98 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.057 0.943 . . . . 0.0 112.166 -179.564 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 84.94 14.24 70.13 Favored Glycine 0 N--CA 1.447 -0.612 0 CA-C-N 116.019 -0.537 . . . . 0.0 113.447 179.025 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . 0.413 ' O ' ' HB2' ' A' ' 65' ' ' LEU . 2.7 pt20 -122.25 135.16 54.71 Favored 'General case' 0 C--N 1.317 -0.807 0 O-C-N 122.139 -0.624 . . . . 0.0 109.505 -178.737 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.46 140.57 48.35 Favored 'General case' 0 C--N 1.313 -1.005 0 CA-C-O 121.44 0.638 . . . . 0.0 109.961 178.843 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 22.8 mm -86.74 121.76 38.04 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.517 0 CA-C-O 121.075 0.464 . . . . 0.0 110.344 -178.338 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.409 ' O ' ' HB2' ' A' ' 75' ' ' HIS . . . -95.75 161.15 14.14 Favored 'General case' 0 N--CA 1.434 -1.246 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 179.667 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 48.5 m-20 -66.01 -27.89 68.46 Favored 'General case' 0 C--N 1.311 -1.108 0 CA-C-O 121.352 0.596 . . . . 0.0 110.925 -178.689 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 8.0 m-80 -91.92 1.64 57.05 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-O 121.107 0.48 . . . . 0.0 109.97 -178.793 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . 0.615 ' O ' ' HB2' ' A' ' 44' ' ' LEU . 7.6 m170 -81.02 146.75 30.5 Favored 'General case' 0 CA--C 1.498 -1.033 0 N-CA-C 109.778 -0.453 . . . . 0.0 109.778 -179.381 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.408 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 80.5 p -122.13 155.69 60.98 Favored Pre-proline 0 C--N 1.303 -1.44 0 C-N-CA 121.086 -0.245 . . . . 0.0 111.072 178.897 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_exo -60.79 -36.91 82.02 Favored 'Trans proline' 0 N--CA 1.46 -0.46 0 C-N-CA 122.385 2.056 . . . . 0.0 111.086 178.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . 0.475 ' HG2' ' O ' ' A' ' 40' ' ' MET . 16.4 ptmt -67.47 -38.92 85.13 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.848 -0.614 . . . . 0.0 111.376 -179.306 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -77.96 -32.71 51.58 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.602 -178.317 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.437 HD22 ' CG ' ' A' ' 75' ' ' HIS . 5.5 mt -83.16 0.92 43.05 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.137 0.494 . . . . 0.0 110.733 179.27 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 72.86 44.45 37.66 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 121.158 -0.544 . . . . 0.0 112.975 176.746 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 62.9 mtt -102.52 166.33 10.59 Favored 'General case' 0 C--N 1.313 -0.998 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 179.285 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . 0.411 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 11.3 pt-20 -140.8 -171.28 3.21 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-O 120.717 0.294 . . . . 0.0 110.65 178.829 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -69.15 126.91 31.27 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-O 121.687 0.756 . . . . 0.0 111.698 -177.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . 0.402 ' HG3' ' HE3' ' A' ' 23' ' ' LYS . 44.0 mt-10 76.2 13.34 2.61 Favored 'General case' 0 C--N 1.316 -0.859 0 C-N-CA 124.745 1.218 . . . . 0.0 111.498 178.03 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . 0.411 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 4.3 t0 -59.43 162.05 5.19 Favored 'General case' 0 C--O 1.239 0.549 0 CA-C-N 115.456 -0.793 . . . . 0.0 109.842 173.965 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 12.1 p -125.78 143.76 38.22 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.467 0 CA-C-O 121.342 0.591 . . . . 0.0 111.086 -176.415 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 3.8 mp -113.4 153.26 14.98 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.994 0 N-CA-C 109.087 -0.708 . . . . 0.0 109.087 179.207 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -105.72 138.7 41.47 Favored 'General case' 0 C--N 1.314 -0.946 0 CA-C-O 120.992 0.425 . . . . 0.0 109.932 -176.652 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . 0.525 ' HB ' ' HA2' ' A' ' 28' ' ' GLY . 91.4 t -131.04 134.73 61.14 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.066 0 CA-C-O 121.382 0.611 . . . . 0.0 110.733 179.394 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 92.0 m-85 -121.87 -178.92 3.97 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-N 115.913 -0.585 . . . . 0.0 109.511 179.543 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 8.1 tp60 -103.32 144.94 30.7 Favored 'General case' 0 C--N 1.307 -1.275 0 N-CA-C 109.747 -0.464 . . . . 0.0 109.747 179.135 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' GLU . . . . . 0.5 ' HB3' ' CG ' ' A' ' 63' ' ' ARG . 10.1 pt-20 . . . . . 0 C--N 1.326 -0.414 0 CA-C-O 121.322 0.582 . . . . 0.0 110.684 176.12 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 28.2 pt . . . . . 0 N--CA 1.44 -0.958 0 CA-C-O 121.325 0.583 . . . . 0.0 110.365 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 1.5 mppt? -119.12 145.41 45.98 Favored 'General case' 0 C--N 1.298 -1.638 0 N-CA-C 108.744 -0.835 . . . . 0.0 108.744 -179.356 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.4 mp -138.36 164.59 28.92 Favored 'General case' 0 C--N 1.303 -1.444 0 CA-C-O 121.332 0.587 . . . . 0.0 111.089 176.19 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.428 ' HE2' ' HB3' ' A' ' 25' ' ' LYS . 5.5 tmmm? -133.26 143.02 48.82 Favored 'General case' 0 N--CA 1.434 -1.228 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.358 -178.965 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . 0.526 ' O ' ' HA ' ' A' ' 33' ' ' GLU . 0.9 OUTLIER -114.4 142.68 26.24 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.377 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.039 -179.261 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 46.5 mm -105.04 115.16 46.37 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.028 0 N-CA-C 107.505 -1.295 . . . . 0.0 107.505 175.042 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . 0.415 ' HA2' ' HB ' ' A' ' 90' ' ' VAL . . . -82.77 166.9 45.54 Favored Glycine 0 N--CA 1.42 -2.37 0 C-N-CA 120.202 -0.999 . . . . 0.0 111.748 -176.58 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.38 -23.07 65.53 Favored 'General case' 0 C--N 1.305 -1.343 0 CA-C-O 121.527 0.68 . . . . 0.0 111.023 178.395 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -103.4 15.36 29.26 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.429 0.633 . . . . 0.0 109.493 178.704 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 29.2 t 73.12 16.85 4.2 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 123.771 0.828 . . . . 0.0 111.139 179.526 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 12.5 t -73.45 111.57 8.71 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 116.154 -0.476 . . . . 0.0 109.822 179.477 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.526 ' HA ' ' O ' ' A' ' 26' ' ' VAL . 43.9 mt-10 -88.37 108.64 19.45 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 121.376 0.607 . . . . 0.0 110.701 179.768 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 27.0 mm -98.37 137.22 26.51 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.269 0 N-CA-C 109.233 -0.654 . . . . 0.0 109.233 179.741 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 12.8 m170 -115.75 133.1 56.37 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 -179.846 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 1.2 p90 -147.79 165.13 31.48 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-O 121.147 0.499 . . . . 0.0 111.552 -178.428 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 9.4 ptpp? -119.91 125.23 47.94 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.173 0.511 . . . . 0.0 110.94 179.713 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 33.9 m -140.56 154.94 22.45 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 178.773 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.431 ' O ' HG23 ' A' ' 42' ' ' THR . 83.9 tttt -87.87 162.81 16.73 Favored 'General case' 0 C--N 1.306 -1.29 0 O-C-N 121.796 -0.565 . . . . 0.0 111.442 -178.02 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -78.45 15.26 1.02 Allowed 'General case' 0 N--CA 1.479 1.018 0 O-C-N 121.856 -0.527 . . . . 0.0 112.25 -177.03 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 14.4 t -138.66 3.34 2.28 Favored 'General case' 0 C--N 1.308 -1.236 0 CA-C-O 121.23 0.538 . . . . 0.0 110.784 -177.162 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' THR . . . . . 0.431 HG23 ' O ' ' A' ' 39' ' ' LYS . 7.3 t -96.84 166.22 11.73 Favored 'General case' 0 N--CA 1.44 -0.97 0 CA-C-O 120.913 0.387 . . . . 0.0 110.357 -175.355 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 63.4 m170 -84.63 144.12 28.81 Favored 'General case' 0 C--N 1.314 -0.974 0 CA-C-O 121.498 0.666 . . . . 0.0 111.276 -178.896 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.546 ' O ' ' HG2' ' A' ' 48' ' ' LYS . 0.9 OUTLIER -65.7 -15.0 62.39 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.423 -0.808 . . . . 0.0 111.129 178.975 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.673 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -52.07 -48.37 64.71 Favored 'General case' 0 C--O 1.222 -0.391 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.803 -179.481 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 20.5 ptmt -67.03 -31.65 72.33 Favored 'General case' 0 C--O 1.208 -1.117 0 CA-C-O 120.894 0.378 . . . . 0.0 110.892 -179.943 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 8.6 tt -71.19 -49.97 38.02 Favored 'General case' 0 C--N 1.307 -1.241 0 CA-C-O 121.021 0.438 . . . . 0.0 110.766 -178.834 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.546 ' HG2' ' O ' ' A' ' 44' ' ' LEU . 6.1 ptmm? -62.41 -41.16 98.47 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.657 -178.207 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.673 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 8.7 pt-20 -72.04 -34.2 68.59 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-O 121.09 0.472 . . . . 0.0 110.417 178.072 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 5.4 m -65.06 -43.53 91.97 Favored 'General case' 0 C--O 1.234 0.262 0 N-CA-C 112.296 0.48 . . . . 0.0 112.296 -178.118 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . 0.473 ' CD1' HG12 ' A' ' 26' ' ' VAL . 2.1 p90 -76.03 -33.38 59.63 Favored 'General case' 0 N--CA 1.444 -0.767 0 C-N-CA 119.326 -0.95 . . . . 0.0 110.189 -178.951 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . 0.5 ' SG ' HD12 ' A' ' 62' ' ' LEU . 91.6 m -62.42 -44.91 95.31 Favored 'General case' 0 CA--C 1.511 -0.544 0 CA-C-O 121.199 0.523 . . . . 0.0 110.611 179.556 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 13.2 pt20 -67.35 -34.79 78.04 Favored 'General case' 0 N--CA 1.443 -0.78 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.533 -179.032 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 2.3 mmp_? -56.3 -43.06 78.52 Favored 'General case' 0 C--N 1.346 0.427 0 CA-C-O 121.045 0.45 . . . . 0.0 111.232 177.331 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.406 HE21 ' HB2' ' A' ' 55' ' ' GLN . 2.9 mt-30 -73.86 -21.46 60.1 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.127 0.489 . . . . 0.0 110.931 179.631 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 84.68 28.12 33.19 Favored Glycine 0 N--CA 1.444 -0.769 0 C-N-CA 120.814 -0.707 . . . . 0.0 112.247 179.501 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 31.4 m -128.83 150.2 74.36 Favored Pre-proline 0 C--N 1.327 -0.405 0 O-C-N 122.418 -0.46 . . . . 0.0 110.753 -178.706 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . 0.466 ' HG2' ' OG ' ' A' ' 61' ' ' SER . 28.8 Cg_endo -65.39 153.96 75.83 Favored 'Trans proline' 0 N--CA 1.456 -0.715 0 C-N-CA 122.216 1.944 . . . . 0.0 111.5 177.115 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.454 ' HG2' ' SG ' ' A' ' 52' ' ' CYS . 77.3 mtp -74.97 -8.63 57.07 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.437 -176.201 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 24.2 p30 -90.55 -12.13 38.03 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-O 121.102 0.477 . . . . 0.0 111.596 -178.225 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.466 ' OG ' ' HG2' ' A' ' 58' ' ' PRO . 64.3 m -83.95 -21.08 31.93 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-O 121.24 0.543 . . . . 0.0 111.275 -179.234 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.5 HD12 ' SG ' ' A' ' 52' ' ' CYS . 1.2 pp -129.9 173.04 11.06 Favored 'General case' 0 C--N 1.309 -1.179 0 CA-C-O 121.479 0.657 . . . . 0.0 112.667 -176.932 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.435 ' HG3' ' HB2' ' A' ' 91' ' ' TYR . 1.1 ptp180 -129.35 132.64 47.12 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 115.53 -0.759 . . . . 0.0 111.741 -179.659 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . 0.463 ' CZ ' ' HE2' ' A' ' 48' ' ' LYS . 0.1 OUTLIER -107.66 120.29 41.82 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-N 115.187 -0.915 . . . . 0.0 110.758 -177.662 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.469 ' C ' HD23 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -145.51 163.91 33.24 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-O 121.491 0.662 . . . . 0.0 111.173 179.72 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 80.3 t80 -146.29 135.59 22.84 Favored 'General case' 0 C--N 1.307 -1.267 0 N-CA-C 109.199 -0.667 . . . . 0.0 109.199 178.503 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 49.89 28.57 2.89 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 124.126 0.971 . . . . 0.0 112.387 179.525 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 85.03 22.69 51.83 Favored Glycine 0 N--CA 1.445 -0.742 0 C-N-CA 121.146 -0.55 . . . . 0.0 112.96 179.596 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 2.6 pt20 -130.15 134.41 47.3 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 179.085 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 1.3 ppt_? -71.98 148.39 45.98 Favored 'General case' 0 C--N 1.31 -1.142 0 CA-C-O 121.298 0.57 . . . . 0.0 110.252 178.303 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 23.4 mm -95.39 123.23 47.46 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.226 0 O-C-N 121.919 -0.488 . . . . 0.0 110.901 -177.757 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -99.46 164.56 12.05 Favored 'General case' 0 N--CA 1.447 -0.596 0 N-CA-C 110.168 -0.308 . . . . 0.0 110.168 179.704 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 31.7 m-20 -64.87 -28.06 69.29 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.239 0.542 . . . . 0.0 111.015 -179.298 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 3.3 m-80 -96.12 5.59 50.75 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 121.097 0.475 . . . . 0.0 110.06 -177.373 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . 0.479 ' CG ' HD22 ' A' ' 80' ' ' LEU . 3.4 m170 -83.17 140.52 32.53 Favored 'General case' 0 CA--C 1.502 -0.896 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 179.788 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.417 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 59.9 p -119.08 155.7 53.0 Favored Pre-proline 0 C--N 1.306 -1.311 0 C-N-CA 120.985 -0.286 . . . . 0.0 110.936 179.469 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_exo -61.82 -37.87 63.73 Favored 'Trans proline' 0 N--CA 1.46 -0.461 0 C-N-CA 122.465 2.11 . . . . 0.0 111.341 179.808 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . 0.473 ' HG3' ' N ' ' A' ' 79' ' ' GLU . 34.1 pttt -68.04 -36.01 79.19 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.621 -179.344 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . 0.473 ' N ' ' HG3' ' A' ' 78' ' ' LYS . 11.2 mm-40 -74.01 -42.5 60.25 Favored 'General case' 0 CA--C 1.512 -0.511 0 CA-C-O 121.18 0.514 . . . . 0.0 111.01 -179.576 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.479 HD22 ' CG ' ' A' ' 75' ' ' HIS . 5.7 mt -76.19 -6.45 51.35 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.037 0.446 . . . . 0.0 111.237 -178.246 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 80.57 46.9 7.08 Favored Glycine 0 N--CA 1.447 -0.575 0 C-N-CA 120.862 -0.685 . . . . 0.0 112.744 177.885 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 59.3 mtt -106.64 164.32 12.18 Favored 'General case' 0 C--N 1.314 -0.942 0 O-C-N 122.51 -0.406 . . . . 0.0 109.982 178.437 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -138.18 -169.35 2.55 Favored 'General case' 0 C--N 1.313 -0.987 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 178.256 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.452 ' O ' ' HB2' ' A' ' 85' ' ' GLU . 11.5 pt-20 -78.44 134.32 37.38 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-O 121.545 0.688 . . . . 0.0 111.719 -178.893 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . 0.452 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 37.7 mt-10 78.97 8.22 1.97 Allowed 'General case' 0 C--N 1.325 -0.468 0 C-N-CA 125.104 1.361 . . . . 0.0 111.539 -179.426 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 4.6 t0 -63.26 166.52 6.15 Favored 'General case' 0 C--O 1.239 0.539 0 CA-C-N 115.734 -0.667 . . . . 0.0 110.472 175.687 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . 0.424 ' HA ' ' O ' ' A' ' 25' ' ' LYS . 8.3 p -129.08 143.63 40.65 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.076 0 CA-C-O 121.358 0.599 . . . . 0.0 111.654 -176.754 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 3.5 mp -113.58 154.87 14.9 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 179.18 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 11.0 tp10 -107.88 138.9 43.32 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-O 121.032 0.444 . . . . 0.0 110.686 -176.262 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . 0.415 ' HB ' ' HA2' ' A' ' 28' ' ' GLY . 97.6 t -129.92 135.29 61.44 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.92 0 CA-C-O 121.362 0.601 . . . . 0.0 110.883 178.872 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . 0.435 ' HB2' ' HG3' ' A' ' 63' ' ' ARG . 81.2 m-85 -121.78 173.91 7.18 Favored 'General case' 0 C--N 1.31 -1.147 0 CA-C-N 116.115 -0.493 . . . . 0.0 109.915 178.856 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 9.5 tp60 -101.09 148.83 24.61 Favored 'General case' 0 C--N 1.306 -1.315 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 179.903 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 . . . . . 0 C--N 1.321 -0.637 0 CA-C-O 121.075 0.464 . . . . 0.0 110.998 177.419 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . 0.457 ' HB ' ' HA ' ' A' ' 84' ' ' GLU . 23.9 pt . . . . . 0 N--CA 1.439 -1.021 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.437 ' HG2' ' HG2' ' A' ' 37' ' ' LYS . 34.6 mtmt -110.66 148.85 31.39 Favored 'General case' 0 C--N 1.298 -1.635 0 N-CA-C 109.75 -0.463 . . . . 0.0 109.75 179.739 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.6 mp -140.53 154.22 46.47 Favored 'General case' 0 C--N 1.3 -1.58 0 CA-C-O 121.345 0.593 . . . . 0.0 110.664 171.916 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.468 ' O ' ' HA ' ' A' ' 87' ' ' VAL . 5.4 tmmm? -128.41 143.84 51.05 Favored 'General case' 0 C--N 1.308 -1.212 0 CA-C-O 121.376 0.608 . . . . 0.0 110.334 -178.546 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . 0.496 ' O ' ' HA ' ' A' ' 33' ' ' GLU . 0.9 OUTLIER -115.96 140.16 39.18 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.494 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.249 -179.132 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 46.8 mm -103.81 112.12 36.09 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.28 0 N-CA-C 107.194 -1.41 . . . . 0.0 107.194 174.496 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . 0.471 ' HA2' ' HB ' ' A' ' 90' ' ' VAL . . . -80.87 166.58 48.94 Favored Glycine 0 N--CA 1.428 -1.89 0 C-N-CA 120.181 -1.009 . . . . 0.0 111.493 -176.92 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.92 -20.07 64.83 Favored 'General case' 0 C--N 1.314 -0.978 0 CA-C-O 121.567 0.699 . . . . 0.0 110.902 177.481 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -97.16 12.97 30.87 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 121.685 0.755 . . . . 0.0 109.568 177.653 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 21.7 m 69.81 14.64 8.02 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.744 -179.055 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 7.9 t -72.79 116.93 13.87 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.533 -179.215 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.496 ' HA ' ' O ' ' A' ' 26' ' ' VAL . 41.7 mt-10 -89.44 106.33 18.38 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.214 0.531 . . . . 0.0 110.791 178.333 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 29.5 mm -96.44 136.11 28.36 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.426 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 178.574 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 12.5 m170 -115.62 131.35 56.96 Favored 'General case' 0 C--N 1.321 -0.674 0 N-CA-C 109.783 -0.451 . . . . 0.0 109.783 -178.373 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 2.1 p90 -147.2 149.09 32.26 Favored 'General case' 0 C--N 1.309 -1.163 0 CA-C-O 121.33 0.586 . . . . 0.0 111.379 -179.311 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.437 ' HG2' ' HG2' ' A' ' 23' ' ' LYS . 38.1 mtmt -110.03 123.3 49.43 Favored 'General case' 0 C--N 1.313 -0.979 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.418 178.774 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 22.5 m -141.33 165.19 19.19 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.96 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 179.816 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.437 ' O ' HG23 ' A' ' 42' ' ' THR . 48.0 mtpt -84.81 176.71 8.34 Favored 'General case' 0 C--N 1.308 -1.237 0 CA-C-O 121.566 0.698 . . . . 0.0 111.517 179.854 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.38 -33.99 20.34 Favored 'General case' 0 C--N 1.307 -1.27 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.25 178.672 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 9.0 t -94.06 25.32 3.78 Favored 'General case' 0 N--CA 1.444 -0.732 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.24 -177.765 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' THR . . . . . 0.437 HG23 ' O ' ' A' ' 39' ' ' LYS . 7.0 t -108.08 172.6 6.74 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 109.711 -0.477 . . . . 0.0 109.711 178.85 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . 0.41 ' O ' ' HG3' ' A' ' 46' ' ' LYS . 47.8 m170 -92.92 143.89 25.8 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-O 121.501 0.667 . . . . 0.0 111.479 -179.618 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.534 ' HB2' ' O ' ' A' ' 75' ' ' HIS . 0.7 OUTLIER -68.13 -17.3 64.32 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.564 178.469 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.496 ' HA ' ' HD3' ' A' ' 48' ' ' LYS . 0.0 OUTLIER -54.82 -44.94 74.3 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.883 -179.361 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . 0.597 ' HZ2' ' HB2' ' A' ' 46' ' ' LYS . 0.0 OUTLIER -74.0 -26.12 60.27 Favored 'General case' 0 N--CA 1.439 -1.009 0 CA-C-O 121.296 0.57 . . . . 0.0 110.493 -179.176 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.418 ' C ' HD21 ' A' ' 47' ' ' LEU . 8.7 tt -72.96 -52.03 16.09 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.605 178.464 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.496 ' HD3' ' HA ' ' A' ' 45' ' ' LYS . 6.1 ptmm? -59.7 -41.04 89.88 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.98 0.419 . . . . 0.0 111.557 -178.695 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.47 -31.12 65.16 Favored 'General case' 0 C--N 1.318 -0.779 0 C-N-CA 120.437 -0.505 . . . . 0.0 110.564 178.247 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' SER . . . . . 0.559 ' HB2' ' O ' ' A' ' 46' ' ' LYS . 8.6 t -66.23 -42.89 88.04 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.481 -178.398 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . 0.45 ' CD2' ' HA ' ' A' ' 48' ' ' LYS . 3.4 p90 -76.51 -32.85 58.55 Favored 'General case' 0 N--CA 1.446 -0.625 0 C-N-CA 119.672 -0.811 . . . . 0.0 110.502 -179.473 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . 0.454 ' HA ' ' NE2' ' A' ' 55' ' ' GLN . 90.8 m -63.77 -45.03 91.65 Favored 'General case' 0 CA--C 1.509 -0.625 0 CA-C-O 121.229 0.537 . . . . 0.0 110.291 179.07 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . 0.412 ' HG2' ' O ' ' A' ' 50' ' ' SER . 13.8 pt20 -66.46 -33.96 76.88 Favored 'General case' 0 N--CA 1.444 -0.734 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.319 -178.987 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 2.2 mmp_? -56.05 -39.16 71.6 Favored 'General case' 0 C--N 1.349 0.571 0 CA-C-O 121.244 0.545 . . . . 0.0 111.08 176.204 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.454 ' NE2' ' HA ' ' A' ' 52' ' ' CYS . 2.7 mt-30 -82.32 -22.07 35.78 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.363 -178.482 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 83.6 29.54 32.32 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 120.43 -0.891 . . . . 0.0 111.721 179.736 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 21.0 m -129.11 149.9 73.89 Favored Pre-proline 0 C--O 1.238 0.495 0 O-C-N 122.519 -0.401 . . . . 0.0 110.692 -177.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . 0.489 ' HG2' ' OG ' ' A' ' 61' ' ' SER . 34.3 Cg_endo -65.78 149.71 86.6 Favored 'Trans proline' 0 C--O 1.238 0.483 0 C-N-CA 122.487 2.125 . . . . 0.0 112.383 178.445 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.442 ' HG2' ' SG ' ' A' ' 52' ' ' CYS . 73.4 mtp -74.25 -9.31 58.48 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.514 -177.28 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 2.0 p-10 -91.73 -8.32 47.26 Favored 'General case' 0 C--N 1.311 -1.068 0 CA-C-O 121.142 0.496 . . . . 0.0 111.266 -179.09 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.489 ' OG ' ' HG2' ' A' ' 58' ' ' PRO . 71.0 m -91.76 -20.32 21.65 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 121.012 0.434 . . . . 0.0 111.946 -179.785 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.442 HD12 ' SG ' ' A' ' 52' ' ' CYS . 1.9 pp -130.4 155.21 46.78 Favored 'General case' 0 C--N 1.315 -0.931 0 N-CA-C 112.629 0.603 . . . . 0.0 112.629 -179.229 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.549 ' O ' ' HA ' ' A' ' 90' ' ' VAL . 40.2 mtm-85 -105.79 130.23 53.82 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.576 -177.943 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -107.12 116.12 31.37 Favored 'General case' 0 C--N 1.309 -1.191 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.458 178.131 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.462 ' C ' HD21 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -141.89 163.2 33.54 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 121.464 0.65 . . . . 0.0 111.353 179.704 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 90.5 t80 -145.07 138.04 26.41 Favored 'General case' 0 C--N 1.308 -1.218 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 179.602 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 49.86 26.76 2.06 Favored 'General case' 0 N--CA 1.485 1.314 0 C-N-CA 123.997 0.919 . . . . 0.0 112.118 -179.261 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 82.66 23.11 56.94 Favored Glycine 0 CA--C 1.522 0.512 0 C-N-CA 120.525 -0.845 . . . . 0.0 113.087 -177.618 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 2.6 pt20 -129.57 134.36 47.69 Favored 'General case' 0 C--N 1.319 -0.735 0 O-C-N 122.177 -0.601 . . . . 0.0 109.471 179.797 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -68.31 143.59 55.14 Favored 'General case' 0 C--N 1.307 -1.278 0 CA-C-O 121.53 0.681 . . . . 0.0 110.612 176.662 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 25.1 mm -90.26 122.94 42.18 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.468 0 CA-C-O 121.055 0.455 . . . . 0.0 110.866 -178.148 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.406 ' O ' ' HB2' ' A' ' 75' ' ' HIS . . . -96.04 163.12 13.26 Favored 'General case' 0 N--CA 1.436 -1.153 0 N-CA-C 109.701 -0.481 . . . . 0.0 109.701 178.8 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . 0.411 ' HB3' ' HB3' ' A' ' 45' ' ' LYS . 36.5 m-20 -68.53 -24.07 64.6 Favored 'General case' 0 C--N 1.31 -1.113 0 CA-C-O 121.645 0.736 . . . . 0.0 110.547 -179.644 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 12.0 m-80 -97.4 8.45 44.56 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.725 -0.67 . . . . 0.0 109.956 -178.984 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . 0.534 ' O ' ' HB2' ' A' ' 44' ' ' LEU . 4.5 m170 -85.91 140.57 30.25 Favored 'General case' 0 CA--C 1.502 -0.887 0 CA-C-N 115.982 -0.554 . . . . 0.0 109.568 179.426 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 81.9 p -117.83 155.34 50.98 Favored Pre-proline 0 C--N 1.306 -1.317 0 C-N-CA 120.945 -0.302 . . . . 0.0 111.343 179.237 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -59.94 -40.97 57.47 Favored 'Trans proline' 0 C--N 1.347 0.453 0 C-N-CA 122.756 2.304 . . . . 0.0 111.625 179.517 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . 0.488 ' HG3' ' N ' ' A' ' 79' ' ' GLU . 35.2 pttt -67.04 -37.21 83.7 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.204 0.525 . . . . 0.0 110.813 -178.775 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . 0.488 ' N ' ' HG3' ' A' ' 78' ' ' LYS . 23.6 mm-40 -72.3 -41.82 66.19 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-O 121.007 0.432 . . . . 0.0 111.051 -179.128 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.447 HD22 ' CG ' ' A' ' 75' ' ' HIS . 4.6 mt -77.21 -9.1 58.57 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.068 0.461 . . . . 0.0 111.123 -178.885 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 82.42 44.05 7.62 Favored Glycine 0 C--O 1.237 0.323 0 C-N-CA 120.739 -0.743 . . . . 0.0 113.004 178.121 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 55.3 mtt -103.62 162.71 12.83 Favored 'General case' 0 C--N 1.317 -0.843 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 178.414 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -143.45 -165.43 2.09 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 121.06 0.457 . . . . 0.0 111.017 178.934 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.457 ' HA ' ' HB ' ' A' ' 22' ' ' ILE . 9.0 pt-20 -68.55 117.41 10.26 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-O 121.737 0.779 . . . . 0.0 112.743 -177.454 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 11.3 tt0 82.07 14.46 0.51 Allowed 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 125.435 1.494 . . . . 0.0 110.944 175.851 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -62.44 166.57 5.01 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-N 115.54 -0.755 . . . . 0.0 110.445 176.423 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . 0.468 ' HA ' ' O ' ' A' ' 25' ' ' LYS . 10.4 p -126.9 146.02 33.51 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.072 0 CA-C-O 121.451 0.643 . . . . 0.0 111.897 -175.925 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 3.6 mp -116.05 153.76 17.63 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.752 0 N-CA-C 108.764 -0.828 . . . . 0.0 108.764 177.507 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 13.5 tp10 -106.15 137.9 43.28 Favored 'General case' 0 C--N 1.319 -0.723 0 O-C-N 122.073 -0.392 . . . . 0.0 110.83 -176.822 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . 0.549 ' HA ' ' O ' ' A' ' 63' ' ' ARG . 95.2 t -127.31 131.8 70.13 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-O 121.251 0.548 . . . . 0.0 111.553 178.85 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 63.9 m-85 -116.13 174.95 5.77 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.101 -0.5 . . . . 0.0 109.829 179.461 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 10.2 tp60 -103.06 128.17 50.04 Favored 'General case' 0 C--N 1.312 -1.038 0 N-CA-C 110.058 -0.349 . . . . 0.0 110.058 178.047 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' GLU . . . . . 0.428 ' HB3' ' CG ' ' A' ' 63' ' ' ARG . 11.6 pt-20 . . . . . 0 C--N 1.33 -0.241 0 CA-C-O 121.151 0.5 . . . . 0.0 110.9 177.904 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 26.3 pt . . . . . 0 N--CA 1.44 -0.975 0 N-CA-C 109.233 -0.655 . . . . 0.0 109.233 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 16.2 mtmt -113.66 142.81 45.56 Favored 'General case' 0 C--N 1.293 -1.869 0 N-CA-C 109.384 -0.599 . . . . 0.0 109.384 -178.174 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.6 mp -137.83 159.72 41.22 Favored 'General case' 0 C--N 1.302 -1.491 0 CA-C-O 121.216 0.531 . . . . 0.0 110.851 174.605 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.52 ' HG3' ' CD2' ' A' ' 35' ' ' HIS . 3.1 tmmt? -131.63 143.87 50.63 Favored 'General case' 0 N--CA 1.433 -1.299 0 CA-C-O 121.259 0.552 . . . . 0.0 110.638 -179.592 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . 0.525 HG12 ' CD1' ' A' ' 51' ' ' TYR . 0.9 OUTLIER -112.06 141.06 28.72 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.429 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.182 178.672 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.418 HD13 ' NZ ' ' A' ' 25' ' ' LYS . 41.6 mm -106.46 115.84 48.92 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.133 0 N-CA-C 107.641 -1.244 . . . . 0.0 107.641 175.214 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . 0.421 ' HA2' ' HB ' ' A' ' 90' ' ' VAL . . . -86.14 169.47 41.99 Favored Glycine 0 N--CA 1.416 -2.651 0 C-N-CA 120.302 -0.951 . . . . 0.0 111.689 -177.008 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.25 -22.15 66.84 Favored 'General case' 0 C--N 1.299 -1.604 0 CA-C-O 121.634 0.73 . . . . 0.0 110.579 178.671 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -102.25 14.63 31.45 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.506 -0.77 . . . . 0.0 109.44 -179.338 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 46.2 m 69.99 19.71 6.8 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 115.574 -0.739 . . . . 0.0 111.005 179.812 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 11.1 t -76.71 114.55 15.58 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.172 178.86 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.458 ' HA ' ' O ' ' A' ' 26' ' ' VAL . 24.1 mt-10 -90.01 113.44 25.12 Favored 'General case' 0 CA--C 1.502 -0.896 0 CA-C-O 121.159 0.504 . . . . 0.0 110.696 177.614 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 30.1 mm -102.59 130.07 53.14 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.909 0 N-CA-C 108.152 -1.055 . . . . 0.0 108.152 176.378 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . 0.52 ' CD2' ' HG3' ' A' ' 25' ' ' LYS . 11.0 m170 -117.55 116.25 26.73 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 -177.148 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -129.28 170.08 14.06 Favored 'General case' 0 C--N 1.304 -1.397 0 CA-C-O 121.18 0.514 . . . . 0.0 111.452 -175.254 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 61.1 mmtt -121.44 121.64 38.0 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 -178.798 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 33.0 m -139.84 156.13 25.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-O 120.93 0.395 . . . . 0.0 110.439 179.545 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.538 ' O ' HG23 ' A' ' 42' ' ' THR . 79.2 tttt -86.55 163.13 17.65 Favored 'General case' 0 C--N 1.314 -0.94 0 O-C-N 121.964 -0.46 . . . . 0.0 110.794 -178.732 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' MET . . . . . 0.481 ' O ' ' HG2' ' A' ' 78' ' ' LYS . 0.0 OUTLIER -71.89 -37.93 70.07 Favored 'General case' 0 CA--C 1.519 -0.238 0 N-CA-C 112.234 0.457 . . . . 0.0 112.234 -177.026 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 14.9 t -92.71 15.11 15.23 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-O 121.343 0.592 . . . . 0.0 111.608 -177.027 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' THR . . . . . 0.538 HG23 ' O ' ' A' ' 39' ' ' LYS . 2.3 t -96.48 169.74 9.7 Favored 'General case' 0 C--N 1.32 -0.684 0 O-C-N 121.485 -0.76 . . . . 0.0 110.224 -179.267 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 29.8 m170 -85.81 142.24 29.07 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-O 121.4 0.619 . . . . 0.0 111.163 179.535 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.603 ' O ' ' HG3' ' A' ' 48' ' ' LYS . 0.2 OUTLIER -69.21 -17.16 63.75 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.559 -0.746 . . . . 0.0 109.686 -179.115 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.646 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -53.88 -45.65 71.13 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-N 115.728 -0.669 . . . . 0.0 112.602 -177.9 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . 0.517 ' O ' ' HB2' ' A' ' 50' ' ' SER . 0.1 OUTLIER -69.89 -25.02 63.49 Favored 'General case' 0 C--O 1.219 -0.536 0 CA-C-O 121.297 0.57 . . . . 0.0 110.795 -178.266 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.477 ' HB3' HD13 ' A' ' 44' ' ' LEU . 7.8 tt -73.4 -47.29 43.14 Favored 'General case' 0 C--N 1.312 -1.062 0 CA-C-N 115.927 -0.579 . . . . 0.0 109.776 177.282 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.603 ' HG3' ' O ' ' A' ' 44' ' ' LEU . 26.7 mtpt -57.81 -47.59 82.16 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.605 -179.277 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.646 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 5.0 pt-20 -69.97 -34.52 73.5 Favored 'General case' 0 C--N 1.313 -0.981 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.446 -179.058 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' SER . . . . . 0.517 ' HB2' ' O ' ' A' ' 46' ' ' LYS . 7.9 t -65.63 -43.88 88.17 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.351 -177.682 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . 0.525 ' CD1' HG12 ' A' ' 26' ' ' VAL . 1.7 p90 -76.51 -33.7 58.62 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 119.727 -0.789 . . . . 0.0 110.531 -178.593 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . 0.485 ' SG ' HD11 ' A' ' 62' ' ' LEU . 98.6 m -62.54 -44.54 96.1 Favored 'General case' 0 C--O 1.239 0.545 0 CA-C-O 121.252 0.549 . . . . 0.0 110.657 179.327 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 14.0 pt20 -69.28 -33.78 73.73 Favored 'General case' 0 N--CA 1.442 -0.832 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.508 -179.228 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 2.1 mmp_? -57.47 -40.05 77.72 Favored 'General case' 0 C--N 1.349 0.569 0 CA-C-O 121.179 0.514 . . . . 0.0 111.377 177.625 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.4 HE21 ' HB2' ' A' ' 55' ' ' GLN . 3.3 mt-30 -78.1 -20.96 51.17 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.236 0.541 . . . . 0.0 110.964 -179.819 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 82.86 29.1 35.83 Favored Glycine 0 N--CA 1.445 -0.72 0 C-N-CA 120.896 -0.668 . . . . 0.0 112.138 -179.542 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 34.6 m -128.39 150.85 75.44 Favored Pre-proline 0 C--N 1.325 -0.467 0 N-CA-C 110.211 -0.292 . . . . 0.0 110.211 -179.826 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . 0.576 ' HG2' ' OG ' ' A' ' 61' ' ' SER . 31.1 Cg_endo -70.61 152.84 65.18 Favored 'Trans proline' 0 N--CA 1.455 -0.755 0 C-N-CA 122.212 1.941 . . . . 0.0 112.212 179.349 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.402 ' HG2' ' SG ' ' A' ' 52' ' ' CYS . 81.2 mtp -68.65 -10.19 54.59 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 121.092 0.472 . . . . 0.0 111.729 -176.532 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . 0.491 ' OD1' ' HB2' ' A' ' 58' ' ' PRO . 2.1 p-10 -91.16 -11.99 36.78 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-O 121.137 0.494 . . . . 0.0 111.114 -179.991 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.576 ' OG ' ' HG2' ' A' ' 58' ' ' PRO . 74.9 m -83.21 -23.6 32.76 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-O 121.088 0.47 . . . . 0.0 111.87 -178.481 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.485 HD11 ' SG ' ' A' ' 52' ' ' CYS . 1.1 pp -124.65 171.79 9.77 Favored 'General case' 0 C--N 1.305 -1.369 0 N-CA-C 113.117 0.784 . . . . 0.0 113.117 -175.796 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.454 ' O ' ' HA ' ' A' ' 90' ' ' VAL . 51.3 mtm180 -121.11 113.88 20.65 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.584 -0.735 . . . . 0.0 110.851 -177.375 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -98.21 116.41 30.36 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-O 121.194 0.521 . . . . 0.0 111.513 179.943 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.461 ' C ' HD21 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -147.06 166.51 26.65 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 121.186 0.517 . . . . 0.0 110.597 178.956 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 83.0 t80 -147.38 136.13 22.02 Favored 'General case' 0 C--N 1.31 -1.141 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 177.672 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 51.58 26.8 3.51 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 124.31 1.044 . . . . 0.0 112.028 -179.869 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 84.37 22.57 53.88 Favored Glycine 0 N--CA 1.448 -0.535 0 C-N-CA 120.808 -0.71 . . . . 0.0 112.611 -179.145 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 2.5 pt20 -128.82 134.27 48.29 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 179.57 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 15.4 ptt180 -68.2 146.98 52.88 Favored 'General case' 0 C--N 1.306 -1.309 0 CA-C-O 121.368 0.604 . . . . 0.0 111.038 178.443 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.427 HG12 ' HA ' ' A' ' 65' ' ' LEU . 21.8 mm -94.65 117.54 38.63 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.13 0 CA-C-O 121.147 0.498 . . . . 0.0 110.041 179.11 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -95.78 160.99 14.21 Favored 'General case' 0 N--CA 1.435 -1.195 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 179.71 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . 0.414 ' CA ' ' HB3' ' A' ' 45' ' ' LYS . 55.1 m-20 -65.33 -22.99 66.89 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-O 121.665 0.745 . . . . 0.0 110.646 -179.511 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 12.4 m-80 -97.07 4.55 51.31 Favored 'General case' 0 C--N 1.311 -1.08 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.132 -178.08 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . 0.602 ' O ' ' HB2' ' A' ' 44' ' ' LEU . 4.8 m170 -83.68 146.7 28.09 Favored 'General case' 0 CA--C 1.508 -0.65 0 N-CA-C 109.43 -0.581 . . . . 0.0 109.43 178.874 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 59.7 p -120.24 155.11 56.26 Favored Pre-proline 0 C--N 1.311 -1.069 0 C-N-CA 120.867 -0.333 . . . . 0.0 111.012 178.3 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -59.22 -40.21 71.24 Favored 'Trans proline' 0 N--CA 1.461 -0.438 0 C-N-CA 122.607 2.205 . . . . 0.0 111.693 179.557 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . 0.481 ' HG2' ' O ' ' A' ' 40' ' ' MET . 0.0 OUTLIER -69.47 -36.2 76.34 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.852 0.358 . . . . 0.0 111.617 -178.042 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -74.93 -35.28 62.18 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.882 0.372 . . . . 0.0 111.246 -179.055 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.435 HD21 ' CG ' ' A' ' 75' ' ' HIS . 5.5 mt -80.55 -0.76 39.09 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.245 0.545 . . . . 0.0 110.819 179.728 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 76.36 45.76 13.85 Favored Glycine 0 CA--C 1.509 -0.317 0 CA-C-N 116.062 -0.517 . . . . 0.0 112.794 177.6 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 59.6 mtt -106.37 164.65 11.86 Favored 'General case' 0 C--N 1.311 -1.082 0 O-C-N 122.522 -0.399 . . . . 0.0 110.255 179.422 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . 0.418 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 10.0 pt-20 -141.16 -166.24 2.13 Favored 'General case' 0 C--N 1.316 -0.885 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 177.584 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.446 ' O ' ' HB2' ' A' ' 85' ' ' GLU . 6.9 pt-20 -72.93 141.52 47.83 Favored 'General case' 0 N--CA 1.444 -0.774 0 C-N-CA 120.363 -0.535 . . . . 0.0 109.801 177.747 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . 0.446 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 66.5 mm-40 72.87 4.92 5.1 Favored 'General case' 0 C--N 1.32 -0.682 0 C-N-CA 123.722 0.809 . . . . 0.0 111.848 -179.109 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . 0.418 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 2.3 t70 -60.8 155.41 19.49 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 121.139 0.495 . . . . 0.0 110.179 176.862 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . 0.464 ' HA ' ' O ' ' A' ' 25' ' ' LYS . 8.8 p -125.94 141.78 44.61 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.497 0 CA-C-O 121.406 0.622 . . . . 0.0 111.265 -177.011 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 3.7 mp -110.24 152.52 12.23 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.884 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 179.029 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . 0.428 ' O ' HD13 ' A' ' 65' ' ' LEU . 3.0 tt0 -103.32 130.9 50.71 Favored 'General case' 0 C--N 1.309 -1.153 0 CA-C-O 121.296 0.57 . . . . 0.0 111.127 -175.507 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . 0.454 ' HA ' ' O ' ' A' ' 63' ' ' ARG . 60.6 t -126.73 132.94 69.6 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.948 0 CA-C-O 121.588 0.708 . . . . 0.0 111.242 179.959 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 76.3 m-85 -116.78 -178.22 3.38 Favored 'General case' 0 C--N 1.309 -1.182 0 CA-C-N 115.639 -0.71 . . . . 0.0 109.724 177.639 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 9.3 tp60 -109.66 145.63 36.18 Favored 'General case' 0 C--N 1.313 -0.982 0 N-CA-C 109.779 -0.452 . . . . 0.0 109.779 179.676 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 . . . . . 0 C--N 1.327 -0.37 0 CA-C-O 121.346 0.593 . . . . 0.0 110.296 175.57 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 24.0 pt . . . . . 0 N--CA 1.446 -0.627 0 CA-C-O 121.372 0.605 . . . . 0.0 109.714 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 11.6 mtmt -114.61 144.46 43.36 Favored 'General case' 0 C--N 1.294 -1.805 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 -178.74 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.9 mp -139.05 161.3 37.72 Favored 'General case' 0 C--N 1.301 -1.52 0 CA-C-O 121.339 0.59 . . . . 0.0 110.945 175.051 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.439 ' O ' ' HA ' ' A' ' 87' ' ' VAL . 5.6 tmmm? -130.22 142.37 50.57 Favored 'General case' 0 N--CA 1.438 -1.043 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.377 -179.43 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . 0.514 ' O ' ' HA ' ' A' ' 33' ' ' GLU . 0.9 OUTLIER -113.14 142.35 25.85 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.411 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.392 179.844 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 45.0 mm -103.82 113.36 40.49 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.251 0 N-CA-C 107.381 -1.34 . . . . 0.0 107.381 175.147 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -74.64 -177.56 38.74 Favored Glycine 0 N--CA 1.432 -1.598 0 C-N-CA 120.755 -0.736 . . . . 0.0 113.105 -175.649 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . 0.792 ' NE2' ' H ' ' A' ' 29' ' ' GLN . 0.0 OUTLIER -70.0 -26.21 63.97 Favored 'General case' 0 C--N 1.305 -1.367 0 N-CA-C 108.532 -0.914 . . . . 0.0 108.532 -178.672 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 37.0 t70 -102.83 12.51 36.1 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 114.868 -1.06 . . . . 0.0 108.47 177.09 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 49.9 m 71.15 20.66 5.07 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 114.974 -1.012 . . . . 0.0 110.905 -179.141 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 8.2 t -67.7 120.56 14.27 Favored 'General case' 0 N--CA 1.447 -0.597 0 N-CA-C 108.779 -0.823 . . . . 0.0 108.779 177.711 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.514 ' HA ' ' O ' ' A' ' 26' ' ' VAL . 46.5 mt-10 -89.15 108.97 19.9 Favored 'General case' 0 C--N 1.313 -0.986 0 CA-C-O 121.338 0.59 . . . . 0.0 111.217 -178.138 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 38.9 mm -98.54 136.85 27.89 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.562 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 177.68 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 11.7 m170 -117.34 133.31 56.12 Favored 'General case' 0 C--N 1.316 -0.854 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 -178.388 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 1.7 p90 -147.2 170.35 17.42 Favored 'General case' 0 C--N 1.309 -1.178 0 CA-C-O 121.376 0.608 . . . . 0.0 111.607 -178.35 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 15.1 ptpt -130.7 119.91 23.08 Favored 'General case' 0 C--N 1.314 -0.975 0 CA-C-N 115.584 -0.734 . . . . 0.0 111.027 -178.543 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 24.4 m -139.84 159.57 27.0 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 116.23 -0.441 . . . . 0.0 109.968 -179.26 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 25.9 mtpp -77.11 176.17 8.96 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-O 121.342 0.592 . . . . 0.0 111.18 179.347 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.5 -35.79 19.39 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.874 178.323 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 13.8 t -93.8 10.52 32.78 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 121.292 0.567 . . . . 0.0 111.607 -176.181 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 7.2 t -94.74 173.65 7.5 Favored 'General case' 0 C--N 1.32 -0.698 0 O-C-N 121.779 -0.575 . . . . 0.0 110.201 -179.617 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 46.0 m170 -90.4 147.72 23.26 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 121.637 0.732 . . . . 0.0 111.611 -179.101 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.502 ' O ' ' HG2' ' A' ' 48' ' ' LYS . 1.3 mm? -70.23 -13.22 62.08 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.426 -0.806 . . . . 0.0 110.707 178.754 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.487 ' HB3' ' HB2' ' A' ' 73' ' ' ASP . 0.0 OUTLIER -54.26 -43.23 70.77 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.986 -178.899 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -71.19 -33.35 69.88 Favored 'General case' 0 C--O 1.2 -1.536 0 CA-C-O 121.069 0.461 . . . . 0.0 110.443 178.918 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.4 HD12 HD11 ' A' ' 44' ' ' LEU . 9.4 tt -69.14 -50.96 43.16 Favored 'General case' 0 C--N 1.309 -1.187 0 CA-C-O 121.105 0.479 . . . . 0.0 110.793 -178.855 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.502 ' HG2' ' O ' ' A' ' 44' ' ' LEU . 4.5 ptmm? -62.17 -40.62 96.61 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.542 -178.966 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.7 -32.86 68.26 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.11 0.481 . . . . 0.0 110.468 177.986 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' SER . . . . . 0.633 ' O ' ' HG2' ' A' ' 54' ' ' ARG . 5.3 m -68.81 -40.98 79.24 Favored 'General case' 0 N--CA 1.45 -0.445 0 N-CA-C 112.52 0.563 . . . . 0.0 112.52 -177.822 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . 0.463 ' CD1' HG12 ' A' ' 26' ' ' VAL . 2.0 p90 -76.45 -33.06 58.76 Favored 'General case' 0 C--N 1.317 -0.809 0 C-N-CA 119.005 -1.078 . . . . 0.0 110.203 179.352 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . 0.608 ' SG ' HD12 ' A' ' 62' ' ' LEU . 92.0 m -61.37 -45.65 93.47 Favored 'General case' 0 CA--C 1.511 -0.521 0 CA-C-O 121.221 0.534 . . . . 0.0 110.19 178.597 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -65.44 -35.67 81.61 Favored 'General case' 0 N--CA 1.442 -0.845 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.536 -179.663 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.633 ' HG2' ' O ' ' A' ' 50' ' ' SER . 41.9 mmt-85 -57.36 -39.1 75.26 Favored 'General case' 0 C--N 1.348 0.524 0 CA-C-O 121.123 0.487 . . . . 0.0 111.388 177.327 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.44 HE21 ' HB2' ' A' ' 55' ' ' GLN . 3.0 mt-30 -78.53 -21.78 48.3 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-O 120.958 0.408 . . . . 0.0 110.783 179.859 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 82.9 29.74 33.85 Favored Glycine 0 N--CA 1.442 -0.931 0 C-N-CA 120.434 -0.888 . . . . 0.0 111.727 179.348 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 35.9 m -130.43 148.26 69.2 Favored Pre-proline 0 C--N 1.323 -0.584 0 O-C-N 122.454 -0.439 . . . . 0.0 110.645 -178.969 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 29.1 Cg_endo -65.78 150.73 85.79 Favored 'Trans proline' 0 N--CA 1.458 -0.602 0 C-N-CA 122.27 1.98 . . . . 0.0 111.72 177.971 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 73.6 mtp -67.49 -7.79 28.51 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-N 116.113 -0.494 . . . . 0.0 112.236 -176.661 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 24.2 p30 -90.41 -12.19 38.22 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 121.387 0.613 . . . . 0.0 111.162 -179.194 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 68.1 m -84.94 -20.32 30.82 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.775 -179.906 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.608 HD12 ' SG ' ' A' ' 52' ' ' CYS . 1.4 pp -136.66 157.44 46.75 Favored 'General case' 0 C--N 1.31 -1.115 0 CA-C-O 121.71 0.767 . . . . 0.0 113.027 -176.545 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.409 ' HG3' ' HB2' ' A' ' 91' ' ' TYR . 1.2 ptp180 -115.68 138.1 51.43 Favored 'General case' 0 C--N 1.314 -0.953 0 CA-C-N 115.049 -0.978 . . . . 0.0 112.376 179.224 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . 0.427 ' CZ ' ' HE2' ' A' ' 48' ' ' LYS . 0.1 OUTLIER -114.14 120.84 41.88 Favored 'General case' 0 C--N 1.313 -0.979 0 CA-C-N 114.983 -1.008 . . . . 0.0 110.541 -176.968 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.464 HD22 ' C ' ' A' ' 65' ' ' LEU . 0.0 OUTLIER -142.94 164.76 29.21 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.33 0.586 . . . . 0.0 111.043 179.298 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 92.3 t80 -147.05 135.33 21.69 Favored 'General case' 0 C--N 1.314 -0.952 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 178.918 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 6.6 pt-20 49.33 26.3 1.54 Allowed 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 124.406 1.082 . . . . 0.0 112.549 -179.17 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 87.57 21.76 46.42 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.913 -0.661 . . . . 0.0 112.934 -179.082 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 2.7 pt20 -129.93 136.78 49.87 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 109.365 -0.606 . . . . 0.0 109.365 -179.808 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 3.1 ptt180 -68.67 147.5 51.78 Favored 'General case' 0 C--N 1.308 -1.231 0 CA-C-O 121.585 0.707 . . . . 0.0 111.02 177.671 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 21.8 mm -97.52 118.55 44.19 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.227 0 N-CA-C 109.708 -0.478 . . . . 0.0 109.708 179.014 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -103.28 167.05 10.06 Favored 'General case' 0 N--CA 1.442 -0.864 0 CA-C-O 120.881 0.372 . . . . 0.0 110.211 -178.854 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . 0.487 ' HB2' ' HB3' ' A' ' 45' ' ' LYS . 8.6 p-10 -66.6 -22.06 66.13 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.779 -178.236 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 9.2 m-80 -98.93 1.78 45.91 Favored 'General case' 0 CA--C 1.51 -0.568 0 CA-C-O 121.238 0.542 . . . . 0.0 110.205 -178.553 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . 0.448 ' CG ' HD21 ' A' ' 80' ' ' LEU . 3.2 m170 -81.06 141.72 34.06 Favored 'General case' 0 C--N 1.318 -0.799 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 179.714 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 70.2 p -116.64 153.58 49.1 Favored Pre-proline 0 C--N 1.307 -1.245 0 C-N-CA 121.072 -0.251 . . . . 0.0 110.675 179.242 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_exo -61.36 -37.75 69.95 Favored 'Trans proline' 0 N--CA 1.459 -0.549 0 C-N-CA 122.463 2.109 . . . . 0.0 111.557 179.796 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . 0.51 ' HG3' ' N ' ' A' ' 79' ' ' GLU . 33.1 pttt -68.83 -38.65 79.97 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.92 -178.713 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . 0.51 ' N ' ' HG3' ' A' ' 78' ' ' LYS . 11.8 mm-40 -72.74 -38.29 67.44 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-O 120.953 0.406 . . . . 0.0 111.098 -178.808 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.448 HD21 ' CG ' ' A' ' 75' ' ' HIS . 5.2 mt -76.46 -6.79 53.29 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-O 121.485 0.66 . . . . 0.0 110.468 179.39 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 79.44 43.08 10.74 Favored Glycine 0 N--CA 1.452 -0.258 0 CA-C-N 115.905 -0.588 . . . . 0.0 112.954 177.201 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 60.6 mtt -102.82 165.6 10.96 Favored 'General case' 0 C--N 1.314 -0.937 0 N-CA-C 109.835 -0.431 . . . . 0.0 109.835 179.126 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -142.66 -171.45 3.43 Favored 'General case' 0 C--N 1.314 -0.952 0 N-CA-C 109.37 -0.604 . . . . 0.0 109.37 177.663 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -71.24 139.01 49.91 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-O 121.435 0.636 . . . . 0.0 111.145 -178.845 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 17.7 tp10 74.51 5.72 4.53 Favored 'General case' 0 C--N 1.321 -0.659 0 C-N-CA 125.012 1.325 . . . . 0.0 111.761 179.229 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -66.22 165.91 12.95 Favored 'General case' 0 C--O 1.238 0.475 0 CA-C-O 121.05 0.452 . . . . 0.0 110.763 176.941 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . 0.439 ' HA ' ' O ' ' A' ' 25' ' ' LYS . 14.9 p -127.55 145.18 35.37 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.876 0 CA-C-O 121.443 0.64 . . . . 0.0 112.054 -175.299 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 3.6 mp -115.56 152.86 17.17 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 177.527 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 -107.19 138.19 43.84 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.038 0.447 . . . . 0.0 110.601 -175.981 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 84.9 t -129.74 137.38 56.85 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.75 0 CA-C-O 121.299 0.571 . . . . 0.0 111.351 -179.3 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . 0.409 ' HB2' ' HG3' ' A' ' 63' ' ' ARG . 96.5 m-85 -123.77 167.09 14.49 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.09 178.802 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 7.0 tp60 -95.39 139.01 32.29 Favored 'General case' 0 C--N 1.31 -1.113 0 N-CA-C 109.841 -0.429 . . . . 0.0 109.841 -179.654 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 . . . . . 0 C--N 1.324 -0.518 0 CA-C-O 121.366 0.603 . . . . 0.0 110.281 176.911 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 26.3 pt . . . . . 0 N--CA 1.447 -0.61 0 CA-C-O 121.463 0.649 . . . . 0.0 110.593 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 3.7 mtmt -120.1 141.95 49.34 Favored 'General case' 0 C--N 1.299 -1.599 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 -179.271 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.4 mp -136.02 162.51 32.68 Favored 'General case' 0 C--N 1.305 -1.361 0 CA-C-O 121.283 0.563 . . . . 0.0 111.02 177.218 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.416 ' HE2' ' HB3' ' A' ' 25' ' ' LYS . 4.9 tmmm? -131.4 142.54 50.06 Favored 'General case' 0 N--CA 1.437 -1.092 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.386 -179.114 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . 0.489 ' O ' ' HA ' ' A' ' 33' ' ' GLU . 0.9 OUTLIER -113.13 142.05 26.83 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.447 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.232 179.892 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.459 ' O ' ' HB ' ' A' ' 90' ' ' VAL . 43.7 mm -104.32 115.54 46.44 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.952 0 N-CA-C 107.373 -1.343 . . . . 0.0 107.373 175.373 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -78.85 179.09 52.97 Favored Glycine 0 N--CA 1.431 -1.669 0 C-N-CA 120.795 -0.717 . . . . 0.0 113.138 -175.683 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . 0.795 ' H ' ' NE2' ' A' ' 29' ' ' GLN . 0.0 OUTLIER -74.7 -22.26 58.94 Favored 'General case' 0 N--CA 1.436 -1.167 0 CA-C-O 121.996 0.903 . . . . 0.0 108.73 -178.105 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -102.62 12.57 36.19 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.032 -0.985 . . . . 0.0 108.525 176.171 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 37.1 t 73.36 18.09 3.76 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 115.174 -0.921 . . . . 0.0 110.418 -179.541 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 7.9 t -70.44 116.57 10.92 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 179.058 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.489 ' HA ' ' O ' ' A' ' 26' ' ' VAL . 37.0 mt-10 -87.76 110.59 20.57 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-O 121.144 0.497 . . . . 0.0 110.484 179.979 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 32.1 mm -98.57 139.04 21.4 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.573 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 178.235 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 10.1 m170 -119.37 131.73 55.73 Favored 'General case' 0 C--N 1.315 -0.905 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 -178.962 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 1.4 p90 -146.88 173.42 12.42 Favored 'General case' 0 C--N 1.309 -1.167 0 CA-C-O 121.15 0.5 . . . . 0.0 110.862 -178.463 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 17.6 ptpt -134.29 120.65 20.22 Favored 'General case' 0 C--N 1.314 -0.951 0 CA-C-O 121.191 0.519 . . . . 0.0 111.137 -179.144 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 26.3 m -137.97 162.47 31.26 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 N-CA-C 109.406 -0.59 . . . . 0.0 109.406 -179.743 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.512 ' O ' HG23 ' A' ' 42' ' ' THR . 40.6 tttp -86.79 163.26 17.36 Favored 'General case' 0 C--N 1.313 -0.988 0 O-C-N 121.519 -0.738 . . . . 0.0 110.947 -179.596 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.82 -41.72 91.49 Favored 'General case' 0 CA--C 1.517 -0.298 0 N-CA-C 112.79 0.663 . . . . 0.0 112.79 -177.808 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 11.9 t -96.11 13.14 28.22 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-O 121.068 0.461 . . . . 0.0 112.113 -174.988 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' THR . . . . . 0.512 HG23 ' O ' ' A' ' 39' ' ' LYS . 2.0 t -91.03 161.88 14.94 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 179.666 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . 0.41 ' O ' ' HG2' ' A' ' 46' ' ' LYS . 42.5 m170 -75.06 138.86 42.44 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-O 121.589 0.709 . . . . 0.0 111.572 -179.979 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.604 ' O ' ' HG3' ' A' ' 48' ' ' LYS . 0.2 OUTLIER -67.94 -15.4 63.59 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.219 -0.901 . . . . 0.0 109.972 -179.02 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.663 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -53.35 -45.97 69.36 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.844 -0.616 . . . . 0.0 112.433 -177.952 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . 0.427 ' N ' ' HD3' ' A' ' 45' ' ' LYS . 21.8 ptmt -65.82 -29.37 69.83 Favored 'General case' 0 C--O 1.218 -0.562 0 CA-C-O 121.345 0.593 . . . . 0.0 110.579 -178.528 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.539 ' HB3' HD12 ' A' ' 44' ' ' LEU . 7.7 tt -72.97 -46.47 52.16 Favored 'General case' 0 C--N 1.311 -1.076 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.925 -179.596 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.604 ' HG3' ' O ' ' A' ' 44' ' ' LEU . 26.8 mtpt -58.29 -48.79 79.37 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-O 121.512 0.672 . . . . 0.0 110.185 -179.142 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.663 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 7.0 pt-20 -71.16 -31.32 67.53 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.976 -178.793 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' SER . . . . . 0.43 ' O ' ' HG2' ' A' ' 54' ' ' ARG . 38.0 t -65.44 -45.69 82.84 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.979 0.419 . . . . 0.0 111.283 -179.811 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . 0.476 ' CD1' HG11 ' A' ' 26' ' ' VAL . 2.1 p90 -76.47 -32.64 58.49 Favored 'General case' 0 N--CA 1.443 -0.786 0 C-N-CA 119.86 -0.736 . . . . 0.0 110.539 -177.378 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . 0.475 ' SG ' ' HG2' ' A' ' 59' ' ' MET . 99.7 m -64.15 -44.15 92.99 Favored 'General case' 0 CA--C 1.509 -0.634 0 CA-C-O 121.105 0.479 . . . . 0.0 110.547 179.436 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 13.5 pt20 -67.73 -33.46 74.92 Favored 'General case' 0 N--CA 1.443 -0.779 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.274 -179.668 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.43 ' HG2' ' O ' ' A' ' 50' ' ' SER . 13.7 mmt180 -57.5 -38.16 74.17 Favored 'General case' 0 C--N 1.348 0.524 0 CA-C-O 121.018 0.437 . . . . 0.0 111.042 177.055 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.438 HE21 ' HB2' ' A' ' 55' ' ' GLN . 3.7 mt-30 -82.19 -22.47 35.96 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.968 -179.746 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 82.94 29.18 35.26 Favored Glycine 0 N--CA 1.443 -0.849 0 C-N-CA 120.548 -0.834 . . . . 0.0 111.886 -179.868 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 33.9 m -125.56 150.9 69.46 Favored Pre-proline 0 C--N 1.325 -0.467 0 O-C-N 122.45 -0.441 . . . . 0.0 110.649 -178.661 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . 0.485 ' HG2' ' OG ' ' A' ' 61' ' ' SER . 43.4 Cg_endo -71.01 149.9 59.74 Favored 'Trans proline' 0 N--CA 1.453 -0.871 0 C-N-CA 122.295 1.997 . . . . 0.0 111.856 177.277 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.475 ' HG2' ' SG ' ' A' ' 52' ' ' CYS . 80.6 mtp -70.1 -7.55 42.38 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.779 -177.279 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 31.3 p30 -89.12 -11.98 42.39 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.472 0.653 . . . . 0.0 110.968 179.272 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.485 ' OG ' ' HG2' ' A' ' 58' ' ' PRO . 70.3 m -90.81 -19.05 23.87 Favored 'General case' 0 N--CA 1.439 -0.986 0 N-CA-C 112.459 0.54 . . . . 0.0 112.459 -178.122 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.447 HD13 ' SG ' ' A' ' 52' ' ' CYS . 1.4 pp -128.09 167.89 16.13 Favored 'General case' 0 C--N 1.313 -1.0 0 N-CA-C 113.139 0.792 . . . . 0.0 113.139 -177.674 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.501 ' O ' ' HA ' ' A' ' 90' ' ' VAL . 35.6 mtm180 -118.66 118.29 31.26 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.261 -0.881 . . . . 0.0 110.669 -177.566 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -101.56 112.41 24.95 Favored 'General case' 0 C--N 1.312 -1.037 0 CA-C-O 121.134 0.492 . . . . 0.0 110.723 178.704 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.474 ' C ' HD22 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -141.52 164.62 29.73 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-O 121.528 0.68 . . . . 0.0 111.461 -179.377 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 88.3 t80 -144.77 133.81 22.68 Favored 'General case' 0 C--N 1.308 -1.198 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 177.733 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 49.36 29.59 2.85 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 124.264 1.025 . . . . 0.0 112.288 -178.884 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 87.26 16.28 60.94 Favored Glycine 0 N--CA 1.446 -0.681 0 C-N-CA 120.969 -0.634 . . . . 0.0 113.599 179.593 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 2.7 pt20 -125.86 135.73 52.28 Favored 'General case' 0 C--N 1.32 -0.698 0 O-C-N 122.254 -0.556 . . . . 0.0 109.623 -178.907 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -70.48 148.64 48.05 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-O 121.667 0.746 . . . . 0.0 110.379 177.792 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 23.4 mm -96.47 122.42 47.95 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.917 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.049 -179.278 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -95.31 166.07 12.07 Favored 'General case' 0 N--CA 1.436 -1.158 0 N-CA-C 109.697 -0.482 . . . . 0.0 109.697 -179.786 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . 0.41 ' CA ' ' HB3' ' A' ' 45' ' ' LYS . 11.8 p-10 -71.18 -21.04 62.21 Favored 'General case' 0 C--N 1.31 -1.121 0 CA-C-O 121.4 0.619 . . . . 0.0 110.773 -179.598 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 13.2 m-80 -98.73 4.0 47.71 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-O 121.175 0.512 . . . . 0.0 110.152 179.437 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . 0.59 ' O ' ' HB2' ' A' ' 44' ' ' LEU . 3.2 m170 -83.16 146.52 28.59 Favored 'General case' 0 CA--C 1.503 -0.862 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 -179.875 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.481 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 69.0 p -122.25 155.89 61.1 Favored Pre-proline 0 C--N 1.306 -1.308 0 C-N-CA 121.041 -0.264 . . . . 0.0 110.976 178.53 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -60.79 -41.67 44.26 Favored 'Trans proline' 0 N--CA 1.459 -0.533 0 C-N-CA 122.418 2.079 . . . . 0.0 111.01 179.619 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . 0.521 ' HG3' ' N ' ' A' ' 79' ' ' GLU . 44.6 pttt -65.28 -41.56 94.04 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.106 -178.618 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . 0.521 ' N ' ' HG3' ' A' ' 78' ' ' LYS . 60.2 mm-40 -71.2 -36.14 71.81 Favored 'General case' 0 N--CA 1.445 -0.725 0 CA-C-O 120.999 0.428 . . . . 0.0 111.176 -177.661 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.481 ' HG ' ' O ' ' A' ' 76' ' ' THR . 5.9 mt -79.22 -6.05 55.71 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.202 0.525 . . . . 0.0 110.908 179.922 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 83.14 42.37 8.07 Favored Glycine 0 N--CA 1.454 -0.16 0 C-N-CA 121.032 -0.604 . . . . 0.0 113.027 177.855 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 61.1 mtt -103.59 165.89 10.76 Favored 'General case' 0 C--N 1.315 -0.914 0 O-C-N 122.314 -0.521 . . . . 0.0 109.885 178.775 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -137.22 -172.12 3.12 Favored 'General case' 0 C--N 1.312 -1.046 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 178.455 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -76.93 141.88 40.3 Favored 'General case' 0 N--CA 1.444 -0.743 0 C-N-CA 119.52 -0.872 . . . . 0.0 110.56 179.6 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 77.8 3.22 2.96 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 124.779 1.232 . . . . 0.0 110.71 -178.93 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -63.05 164.74 7.91 Favored 'General case' 0 C--O 1.239 0.551 0 CA-C-O 121.249 0.547 . . . . 0.0 111.035 177.874 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . 0.412 ' HA ' ' O ' ' A' ' 25' ' ' LYS . 7.9 p -128.34 145.01 36.08 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.067 0 CA-C-O 121.288 0.566 . . . . 0.0 111.338 -176.996 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 3.7 mp -113.88 153.7 15.38 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.825 0 N-CA-C 109.095 -0.705 . . . . 0.0 109.095 177.86 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -104.0 135.95 44.55 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-O 120.918 0.39 . . . . 0.0 110.545 -175.643 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . 0.501 ' HA ' ' O ' ' A' ' 63' ' ' ARG . 57.9 t -129.84 134.0 63.8 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.854 0 CA-C-O 121.391 0.615 . . . . 0.0 110.904 178.356 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 83.3 m-85 -122.78 176.0 6.22 Favored 'General case' 0 C--N 1.313 -0.994 0 CA-C-N 115.962 -0.563 . . . . 0.0 109.492 178.819 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 6.7 tp60 -101.08 146.77 27.02 Favored 'General case' 0 C--N 1.305 -1.366 0 N-CA-C 109.705 -0.48 . . . . 0.0 109.705 178.87 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 . . . . . 0 C--N 1.321 -0.637 0 CA-C-O 121.452 0.644 . . . . 0.0 110.454 175.695 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . 0.509 ' HB ' ' HA ' ' A' ' 84' ' ' GLU . 19.9 pt . . . . . 0 N--CA 1.443 -0.821 0 CA-C-O 121.301 0.572 . . . . 0.0 110.566 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.487 ' HD3' ' N ' ' A' ' 23' ' ' LYS . 0.0 OUTLIER -121.51 143.44 49.27 Favored 'General case' 0 C--N 1.308 -1.201 0 N-CA-C 108.706 -0.85 . . . . 0.0 108.706 -179.489 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.4 mp -138.0 166.62 23.64 Favored 'General case' 0 C--N 1.306 -1.294 0 CA-C-O 121.256 0.551 . . . . 0.0 111.195 177.606 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 4.8 tmmm? -134.0 144.08 48.52 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.518 -179.917 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . 0.608 ' O ' ' HA ' ' A' ' 33' ' ' GLU . 0.9 OUTLIER -115.41 141.54 32.01 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.159 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.707 -179.932 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.415 HD12 ' HG2' ' A' ' 33' ' ' GLU . 35.4 mm -111.26 99.57 8.97 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.728 0 N-CA-C 108.234 -1.024 . . . . 0.0 108.234 175.827 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . 0.672 ' HA3' ' OG ' ' A' ' 32' ' ' SER . . . -71.63 172.46 45.63 Favored Glycine 0 N--CA 1.426 -2.014 0 C-N-CA 119.626 -1.274 . . . . 0.0 114.007 179.722 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.04 -18.26 65.23 Favored 'General case' 0 C--N 1.307 -1.245 0 CA-C-N 114.607 -0.797 . . . . 0.0 110.99 179.539 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -100.19 10.5 41.16 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.465 -0.788 . . . . 0.0 109.375 178.589 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 50.2 m 71.61 23.31 3.81 Favored 'General case' 0 C--N 1.342 0.275 0 CA-C-O 121.913 0.864 . . . . 0.0 109.113 -175.244 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' SER . . . . . 0.672 ' OG ' ' HA3' ' A' ' 28' ' ' GLY . 2.2 p -70.77 92.52 0.89 Allowed 'General case' 0 N--CA 1.42 -1.933 0 CA-C-N 114.983 -1.008 . . . . 0.0 111.403 -179.339 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.608 ' HA ' ' O ' ' A' ' 26' ' ' VAL . 31.4 mt-10 -81.52 102.08 10.35 Favored 'General case' 0 CA--C 1.505 -0.759 0 CA-C-O 121.211 0.529 . . . . 0.0 110.579 178.71 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 29.5 mm -99.73 138.97 22.45 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.718 0 N-CA-C 109.283 -0.636 . . . . 0.0 109.283 179.317 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 12.0 m170 -116.43 132.9 56.55 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 178.991 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -147.26 167.89 23.12 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-O 121.179 0.514 . . . . 0.0 111.555 -177.456 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 91.7 mttt -124.11 125.12 43.94 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.902 -0.59 . . . . 0.0 109.805 -178.963 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 24.1 m -144.72 152.77 14.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 121.048 0.451 . . . . 0.0 110.443 -179.852 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 36.5 mtpt -77.65 174.93 10.39 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-O 121.665 0.745 . . . . 0.0 111.401 177.436 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -87.02 -32.67 19.89 Favored 'General case' 0 C--N 1.31 -1.122 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.371 179.24 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 9.8 t -94.68 14.63 20.52 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.324 -177.293 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 6.4 t -105.42 167.36 9.8 Favored 'General case' 0 C--N 1.316 -0.865 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 179.903 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . 0.43 ' O ' ' HG2' ' A' ' 46' ' ' LYS . 46.4 m170 -81.9 142.41 32.51 Favored 'General case' 0 C--N 1.312 -1.022 0 CA-C-O 121.675 0.75 . . . . 0.0 111.84 -179.309 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.646 ' O ' ' HG3' ' A' ' 48' ' ' LYS . 0.2 OUTLIER -64.88 -17.68 64.52 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 114.998 -1.001 . . . . 0.0 109.893 179.296 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.738 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -51.9 -47.81 64.44 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.967 -179.043 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . 0.43 ' HG2' ' O ' ' A' ' 43' ' ' HIS . 22.5 ptmt -58.97 -34.29 71.63 Favored 'General case' 0 C--O 1.207 -1.147 0 CA-C-O 121.077 0.465 . . . . 0.0 110.385 -179.274 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.465 ' HB3' HD11 ' A' ' 44' ' ' LEU . 8.2 tt -70.6 -47.98 57.44 Favored 'General case' 0 C--N 1.301 -1.531 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.124 -179.997 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.646 ' HG3' ' O ' ' A' ' 44' ' ' LEU . 20.8 mtpt -59.98 -49.93 75.73 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.509 -178.041 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.738 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 10.4 pt-20 -67.67 -33.89 75.83 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.441 -179.25 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' SER . . . . . 0.591 ' O ' ' HG2' ' A' ' 54' ' ' ARG . 7.5 m -66.39 -45.66 79.27 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.845 -179.659 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . 0.455 ' CE2' ' HA ' ' A' ' 48' ' ' LYS . 2.1 p90 -76.35 -32.69 58.79 Favored 'General case' 0 N--CA 1.445 -0.677 0 C-N-CA 119.667 -0.813 . . . . 0.0 110.672 -177.775 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . 0.521 ' SG ' ' HG2' ' A' ' 59' ' ' MET . 69.2 m -61.98 -44.75 96.09 Favored 'General case' 0 C--O 1.238 0.466 0 CA-C-O 121.0 0.428 . . . . 0.0 110.793 179.083 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 11.6 pt20 -67.99 -33.39 74.53 Favored 'General case' 0 N--CA 1.447 -0.601 0 C-N-CA 120.66 -0.416 . . . . 0.0 110.533 -179.922 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.591 ' HG2' ' O ' ' A' ' 50' ' ' SER . 17.8 mmt85 -57.67 -38.04 74.44 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-O 121.313 0.578 . . . . 0.0 110.832 177.531 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.428 HE21 ' HB2' ' A' ' 55' ' ' GLN . 3.4 mt-30 -81.29 -21.31 39.4 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.954 179.914 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 82.86 29.99 33.31 Favored Glycine 0 N--CA 1.446 -0.688 0 C-N-CA 120.834 -0.698 . . . . 0.0 112.325 179.224 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 35.0 m -132.17 147.63 66.55 Favored Pre-proline 0 C--N 1.324 -0.504 0 O-C-N 122.508 -0.407 . . . . 0.0 110.786 -179.042 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . 0.59 ' HG2' ' OG ' ' A' ' 61' ' ' SER . 18.8 Cg_endo -63.35 150.35 88.79 Favored 'Trans proline' 0 N--CA 1.456 -0.683 0 C-N-CA 122.33 2.02 . . . . 0.0 111.955 177.601 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.521 ' HG2' ' SG ' ' A' ' 52' ' ' CYS . 69.8 mtp -70.01 -9.16 54.33 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.77 -176.338 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.9 p-10 -92.19 -8.52 45.26 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 121.23 0.538 . . . . 0.0 110.886 -179.607 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.59 ' OG ' ' HG2' ' A' ' 58' ' ' PRO . 67.3 m -84.66 -23.36 29.49 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 121.002 0.429 . . . . 0.0 111.836 179.516 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.43 HD11 ' SG ' ' A' ' 52' ' ' CYS . 1.2 pp -125.57 169.14 12.76 Favored 'General case' 0 C--N 1.307 -1.247 0 N-CA-C 113.313 0.856 . . . . 0.0 113.313 -175.091 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.466 ' O ' ' HA ' ' A' ' 90' ' ' VAL . 52.5 mtm180 -116.16 112.42 21.65 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.176 -0.92 . . . . 0.0 110.722 -178.156 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . 0.412 ' HB3' ' OH ' ' A' ' 51' ' ' TYR . 0.1 OUTLIER -96.91 115.12 26.88 Favored 'General case' 0 C--N 1.31 -1.131 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.522 178.466 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.462 ' C ' HD22 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -143.54 162.12 36.68 Favored 'General case' 0 N--CA 1.443 -0.792 0 CA-C-O 121.745 0.783 . . . . 0.0 111.834 -179.65 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 92.5 t80 -145.79 136.95 24.75 Favored 'General case' 0 C--N 1.309 -1.168 0 N-CA-C 108.785 -0.82 . . . . 0.0 108.785 178.564 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 48.54 29.04 1.94 Allowed 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 124.391 1.076 . . . . 0.0 112.231 -178.417 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 83.57 23.17 54.49 Favored Glycine 0 N--CA 1.447 -0.589 0 C-N-CA 120.935 -0.65 . . . . 0.0 113.26 -179.646 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 3.0 pt20 -130.47 137.41 49.77 Favored 'General case' 0 C--N 1.32 -0.711 0 O-C-N 122.212 -0.581 . . . . 0.0 109.462 179.826 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -73.07 146.62 45.69 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-O 121.704 0.764 . . . . 0.0 110.172 178.154 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 22.6 mm -92.63 119.56 40.45 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.855 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.308 -178.391 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -94.88 161.03 14.32 Favored 'General case' 0 N--CA 1.434 -1.232 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 178.841 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 66.3 m-20 -67.87 -21.18 65.18 Favored 'General case' 0 C--N 1.314 -0.964 0 CA-C-O 121.303 0.573 . . . . 0.0 111.506 -177.918 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 6.1 m-80 -100.44 6.78 44.44 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-O 121.268 0.556 . . . . 0.0 110.1 -179.437 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . 0.571 ' O ' ' HB2' ' A' ' 44' ' ' LEU . 2.2 m170 -83.27 145.84 28.88 Favored 'General case' 0 CA--C 1.5 -0.955 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 178.342 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 68.8 p -118.24 152.91 51.29 Favored Pre-proline 0 C--N 1.301 -1.53 0 C-N-CA 120.824 -0.351 . . . . 0.0 111.476 179.647 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_exo -57.3 -41.03 77.52 Favored 'Trans proline' 0 C--N 1.349 0.584 0 C-N-CA 122.597 2.198 . . . . 0.0 111.431 178.508 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . 0.538 ' HG3' ' N ' ' A' ' 79' ' ' GLU . 48.1 pttt -64.58 -40.92 96.41 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.877 -178.918 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . 0.538 ' N ' ' HG3' ' A' ' 78' ' ' LYS . 55.6 mm-40 -73.55 -35.73 65.55 Favored 'General case' 0 N--CA 1.439 -0.99 0 CA-C-O 120.951 0.405 . . . . 0.0 111.463 -177.592 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.462 HD23 ' CG ' ' A' ' 75' ' ' HIS . 5.5 mt -80.69 -0.93 40.44 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.119 0.485 . . . . 0.0 111.253 -179.35 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 78.26 37.78 27.35 Favored Glycine 0 CA--C 1.51 -0.256 0 C-N-CA 120.872 -0.68 . . . . 0.0 112.963 177.174 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 61.0 mtt -100.18 165.26 11.58 Favored 'General case' 0 C--N 1.311 -1.082 0 N-CA-C 109.844 -0.428 . . . . 0.0 109.844 179.35 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -148.2 -171.32 3.81 Favored 'General case' 0 C--N 1.311 -1.084 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 178.151 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.509 ' HA ' ' HB ' ' A' ' 22' ' ' ILE . 15.8 pt-20 -71.19 138.39 49.5 Favored 'General case' 0 N--CA 1.443 -0.778 0 C-N-CA 120.223 -0.591 . . . . 0.0 110.928 -179.89 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 79.7 -2.29 2.1 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 124.801 1.24 . . . . 0.0 111.433 178.861 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -59.33 162.5 4.65 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-O 121.395 0.617 . . . . 0.0 111.284 179.109 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 7.1 p -129.48 143.38 41.32 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.948 0 CA-C-O 121.285 0.564 . . . . 0.0 111.33 -177.001 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 3.7 mp -114.47 153.9 15.91 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 179.642 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 11.0 tp10 -107.41 138.56 43.39 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 120.802 0.334 . . . . 0.0 110.102 -177.226 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . 0.559 ' HB ' ' HA2' ' A' ' 28' ' ' GLY . 97.1 t -130.62 134.05 62.62 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.974 0 CA-C-O 121.47 0.653 . . . . 0.0 110.922 178.863 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 89.0 m-85 -119.27 -177.36 3.33 Favored 'General case' 0 C--N 1.306 -1.284 0 CA-C-N 115.886 -0.597 . . . . 0.0 109.465 179.799 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 8.1 tp60 -108.31 148.26 30.3 Favored 'General case' 0 C--N 1.307 -1.263 0 O-C-N 121.934 -0.478 . . . . 0.0 110.38 -179.281 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 . . . . . 0 C--N 1.329 -0.309 0 CA-C-O 121.702 0.763 . . . . 0.0 110.322 174.658 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . 0.482 ' HB ' ' HA ' ' A' ' 84' ' ' GLU . 27.7 pt . . . . . 0 N--CA 1.44 -0.973 0 CA-C-O 121.471 0.653 . . . . 0.0 110.131 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 41.1 mtmt -120.95 142.5 49.69 Favored 'General case' 0 C--N 1.296 -1.745 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 179.899 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.6 mp -135.76 160.83 37.32 Favored 'General case' 0 C--N 1.301 -1.539 0 CA-C-O 121.278 0.561 . . . . 0.0 110.755 176.708 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.424 ' O ' ' HA ' ' A' ' 87' ' ' VAL . 5.1 tmmm? -130.17 142.09 50.61 Favored 'General case' 0 C--N 1.309 -1.156 0 CA-C-O 121.37 0.605 . . . . 0.0 110.315 -178.728 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . 0.509 ' O ' ' HA ' ' A' ' 33' ' ' GLU . 0.9 OUTLIER -112.87 142.82 24.03 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.544 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.353 -179.142 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 44.4 mm -106.97 115.61 48.86 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.138 0 N-CA-C 107.463 -1.31 . . . . 0.0 107.463 174.737 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -78.13 178.31 52.66 Favored Glycine 0 N--CA 1.423 -2.202 0 C-N-CA 120.796 -0.716 . . . . 0.0 113.257 -175.054 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . 0.807 ' H ' ' NE2' ' A' ' 29' ' ' GLN . 0.0 OUTLIER -72.72 -27.63 62.17 Favored 'General case' 0 C--N 1.3 -1.581 0 CA-C-O 122.141 0.972 . . . . 0.0 108.442 -179.02 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -102.73 16.28 26.95 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 114.705 -1.134 . . . . 0.0 108.343 178.375 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 21.3 m 73.46 15.86 4.13 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 115.267 -0.879 . . . . 0.0 111.402 179.003 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 21.6 t -68.04 110.41 3.92 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.05 179.304 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.509 ' HA ' ' O ' ' A' ' 26' ' ' VAL . 4.3 mp0 -86.65 108.48 18.65 Favored 'General case' 0 N--CA 1.445 -0.714 0 CA-C-O 121.3 0.571 . . . . 0.0 110.828 179.9 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 28.7 mm -98.59 141.28 16.61 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.212 0 N-CA-C 109.365 -0.606 . . . . 0.0 109.365 179.582 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 11.4 m170 -120.02 129.31 54.2 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 -179.898 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 1.7 p90 -147.17 162.56 38.62 Favored 'General case' 0 C--N 1.313 -0.984 0 CA-C-O 121.351 0.596 . . . . 0.0 111.625 -177.676 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 19.2 ptpt -118.69 127.61 53.73 Favored 'General case' 0 N--CA 1.445 -0.704 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.853 179.41 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 34.6 m -142.17 162.34 19.46 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 178.098 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.577 ' O ' HG23 ' A' ' 42' ' ' THR . 70.9 tttt -94.46 166.56 12.0 Favored 'General case' 0 C--N 1.305 -1.33 0 O-C-N 121.587 -0.695 . . . . 0.0 110.649 -179.426 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -76.1 -35.06 59.48 Favored 'General case' 0 C--N 1.328 -0.362 0 O-C-N 121.914 -0.491 . . . . 0.0 111.923 -177.436 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 15.1 t -90.05 16.91 7.52 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 120.996 0.426 . . . . 0.0 111.606 -177.961 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' THR . . . . . 0.577 HG23 ' O ' ' A' ' 39' ' ' LYS . 2.0 t -106.86 170.63 7.83 Favored 'General case' 0 C--N 1.321 -0.67 0 O-C-N 121.938 -0.476 . . . . 0.0 110.174 -178.624 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 44.3 m170 -85.41 147.35 26.54 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.557 0.694 . . . . 0.0 111.522 -179.75 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.535 ' HB2' ' O ' ' A' ' 75' ' ' HIS . 0.2 OUTLIER -73.77 -13.26 60.92 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.309 -179.345 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.735 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -55.75 -43.37 76.6 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.986 -178.966 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 12.0 ptmt -68.34 -29.15 67.81 Favored 'General case' 0 C--O 1.213 -0.861 0 CA-C-O 121.127 0.489 . . . . 0.0 110.596 -178.929 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.484 ' HB3' HD12 ' A' ' 44' ' ' LEU . 9.1 tt -73.23 -49.03 30.1 Favored 'General case' 0 C--N 1.305 -1.357 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.153 -179.866 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.523 ' HA ' ' CD2' ' A' ' 51' ' ' TYR . 7.7 ptmm? -63.65 -41.63 98.2 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.726 -177.563 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.735 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 8.4 pt-20 -69.71 -33.76 72.95 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 121.0 0.428 . . . . 0.0 110.426 176.992 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 4.7 m -67.83 -41.76 82.49 Favored 'General case' 0 C--O 1.236 0.354 0 N-CA-C 112.512 0.56 . . . . 0.0 112.512 -178.312 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . 0.523 ' CD2' ' HA ' ' A' ' 48' ' ' LYS . 2.7 p90 -76.78 -32.38 57.65 Favored 'General case' 0 N--CA 1.444 -0.734 0 C-N-CA 119.436 -0.905 . . . . 0.0 110.229 -179.096 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . 0.541 ' SG ' HD13 ' A' ' 62' ' ' LEU . 98.6 m -62.34 -45.08 94.8 Favored 'General case' 0 CA--C 1.51 -0.559 0 CA-C-O 120.967 0.413 . . . . 0.0 110.646 178.857 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 10.6 pt20 -66.36 -34.67 78.48 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.159 -179.727 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.433 ' HA ' ' NE ' ' A' ' 54' ' ' ARG . 3.9 mmp_? -59.23 -39.56 83.11 Favored 'General case' 0 CA--C 1.514 -0.432 0 CA-C-O 121.023 0.44 . . . . 0.0 111.329 177.707 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.425 HE21 ' HB2' ' A' ' 55' ' ' GLN . 3.3 mt-30 -77.46 -21.28 53.17 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-O 121.137 0.494 . . . . 0.0 110.715 179.371 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 82.75 30.85 31.22 Favored Glycine 0 N--CA 1.444 -0.813 0 C-N-CA 120.937 -0.649 . . . . 0.0 112.217 179.25 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 35.6 m -133.65 148.31 68.06 Favored Pre-proline 0 C--N 1.326 -0.439 0 O-C-N 122.42 -0.459 . . . . 0.0 110.803 -179.045 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . 0.558 ' HG2' ' OG ' ' A' ' 61' ' ' SER . 18.0 Cg_endo -62.45 153.43 71.05 Favored 'Trans proline' 0 N--CA 1.461 -0.422 0 C-N-CA 122.585 2.19 . . . . 0.0 111.866 177.205 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.465 ' HG2' ' SG ' ' A' ' 52' ' ' CYS . 74.1 mtp -72.69 -8.72 56.76 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.134 0.493 . . . . 0.0 111.529 -176.356 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.9 p-10 -91.63 -8.75 46.32 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-O 121.268 0.556 . . . . 0.0 110.561 179.551 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.558 ' OG ' ' HG2' ' A' ' 58' ' ' PRO . 75.6 m -87.25 -18.03 31.2 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-O 121.095 0.474 . . . . 0.0 111.862 -179.742 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.541 HD13 ' SG ' ' A' ' 52' ' ' CYS . 1.3 pp -131.19 169.69 15.59 Favored 'General case' 0 C--N 1.31 -1.114 0 N-CA-C 113.067 0.765 . . . . 0.0 113.067 -176.999 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.434 ' O ' ' HA ' ' A' ' 90' ' ' VAL . 35.8 mtm180 -119.72 121.15 38.56 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.416 -177.748 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . 0.427 ' HB3' ' OH ' ' A' ' 51' ' ' TYR . 0.2 OUTLIER -105.1 117.96 35.33 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-O 121.206 0.527 . . . . 0.0 111.462 179.475 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.451 ' C ' HD21 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -147.85 164.42 33.74 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 121.208 0.528 . . . . 0.0 110.471 179.606 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 77.9 t80 -144.69 135.84 25.14 Favored 'General case' 0 C--N 1.313 -0.994 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 178.134 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 50.88 26.37 2.61 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 124.117 0.967 . . . . 0.0 112.327 -179.899 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 85.04 23.27 49.73 Favored Glycine 0 N--CA 1.445 -0.726 0 C-N-CA 120.871 -0.68 . . . . 0.0 112.902 -179.38 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . 0.405 ' OE1' HD21 ' A' ' 80' ' ' LEU . 2.8 pt20 -129.92 134.39 47.45 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 178.953 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 10.8 ptt180 -65.56 148.68 51.34 Favored 'General case' 0 C--N 1.31 -1.136 0 CA-C-O 121.586 0.708 . . . . 0.0 111.113 177.824 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.438 HG12 ' HA ' ' A' ' 65' ' ' LEU . 21.0 mm -98.92 115.56 39.73 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.301 0 N-CA-C 109.629 -0.508 . . . . 0.0 109.629 177.724 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -96.34 165.99 11.93 Favored 'General case' 0 N--CA 1.437 -1.091 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 -179.237 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . 0.412 ' CA ' ' HB3' ' A' ' 45' ' ' LYS . 37.1 m-20 -69.32 -25.44 64.22 Favored 'General case' 0 C--N 1.31 -1.124 0 CA-C-O 121.518 0.675 . . . . 0.0 110.982 -178.268 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 8.5 m-80 -96.5 4.66 51.93 Favored 'General case' 0 C--N 1.311 -1.076 0 CA-C-O 121.491 0.662 . . . . 0.0 109.708 -178.026 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . 0.535 ' O ' ' HB2' ' A' ' 44' ' ' LEU . 4.5 m170 -83.77 144.75 29.11 Favored 'General case' 0 CA--C 1.503 -0.855 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 178.849 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.5 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 77.6 p -117.85 155.29 51.06 Favored Pre-proline 0 C--N 1.302 -1.499 0 N-CA-C 110.276 -0.268 . . . . 0.0 110.276 178.516 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -67.49 -30.57 35.63 Favored 'Trans proline' 0 N--CA 1.454 -0.822 0 C-N-CA 121.95 1.767 . . . . 0.0 111.043 -179.896 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . 0.462 ' HG3' ' N ' ' A' ' 79' ' ' GLU . 33.2 pttt -70.73 -38.47 73.57 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.952 0.406 . . . . 0.0 110.551 179.59 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . 0.462 ' N ' ' HG3' ' A' ' 78' ' ' LYS . 5.0 mm-40 -74.14 -37.64 64.0 Favored 'General case' 0 N--CA 1.447 -0.623 0 CA-C-O 121.015 0.436 . . . . 0.0 111.269 -179.572 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.5 ' HG ' ' O ' ' A' ' 76' ' ' THR . 5.9 mt -77.29 -5.04 47.96 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.278 0.561 . . . . 0.0 110.872 -179.862 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 78.34 42.96 13.7 Favored Glycine 0 C--O 1.227 -0.34 0 C-N-CA 121.129 -0.558 . . . . 0.0 113.217 176.733 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 61.4 mtt -101.65 165.68 11.1 Favored 'General case' 0 C--N 1.315 -0.932 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 179.51 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -142.6 -170.72 3.27 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 110.073 -0.343 . . . . 0.0 110.073 177.104 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.482 ' HA ' ' HB ' ' A' ' 22' ' ' ILE . 14.4 pt-20 -68.7 135.94 52.11 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.97 0.414 . . . . 0.0 111.003 -179.421 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 79.07 4.41 2.33 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 124.361 1.064 . . . . 0.0 111.158 177.574 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 17.6 t0 -60.64 159.26 11.02 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-O 121.422 0.629 . . . . 0.0 110.982 178.515 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . 0.424 ' HA ' ' O ' ' A' ' 25' ' ' LYS . 7.4 p -127.05 141.48 46.14 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.243 0 CA-C-O 121.386 0.612 . . . . 0.0 111.417 -177.387 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 3.6 mp -111.33 155.91 12.61 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.743 0 CA-C-N 116.203 -0.453 . . . . 0.0 109.82 -179.379 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 6.3 tp10 -105.34 135.3 46.97 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.929 0.395 . . . . 0.0 110.227 -177.25 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . 0.434 ' HA ' ' O ' ' A' ' 63' ' ' ARG . 60.4 t -128.87 134.75 63.72 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.912 0 CA-C-O 121.119 0.485 . . . . 0.0 110.809 178.148 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 87.9 m-85 -119.05 173.9 6.63 Favored 'General case' 0 C--N 1.32 -0.713 0 N-CA-C 108.947 -0.761 . . . . 0.0 108.947 178.115 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 7.1 tp60 -102.44 146.85 27.5 Favored 'General case' 0 C--N 1.314 -0.947 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 178.633 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 23.0 pt-20 . . . . . 0 C--N 1.328 -0.362 0 CA-C-O 121.165 0.507 . . . . 0.0 111.191 176.267 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 24.5 pt . . . . . 0 N--CA 1.442 -0.837 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 1.8 mppt? -118.44 142.84 47.16 Favored 'General case' 0 C--N 1.296 -1.74 0 N-CA-C 109.017 -0.735 . . . . 0.0 109.017 -179.508 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.5 mp -135.3 162.83 31.46 Favored 'General case' 0 C--N 1.301 -1.508 0 CA-C-O 121.197 0.523 . . . . 0.0 110.572 176.67 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.423 ' O ' ' HA ' ' A' ' 87' ' ' VAL . 5.3 tmmm? -132.5 142.55 49.26 Favored 'General case' 0 N--CA 1.434 -1.274 0 CA-C-O 121.436 0.636 . . . . 0.0 110.775 -178.775 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . 0.493 HG13 ' CD1' ' A' ' 51' ' ' TYR . 0.9 OUTLIER -115.98 141.89 31.57 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.324 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.036 -179.954 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.439 ' O ' ' HB ' ' A' ' 90' ' ' VAL . 48.3 mm -104.6 118.27 51.62 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.109 0 N-CA-C 107.425 -1.324 . . . . 0.0 107.425 174.626 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . 0.451 ' HA2' ' HB ' ' A' ' 90' ' ' VAL . . . -91.53 162.22 27.86 Favored Glycine 0 N--CA 1.423 -2.215 0 C-N-CA 120.145 -1.026 . . . . 0.0 111.32 -177.064 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.83 -24.45 62.01 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-O 121.531 0.681 . . . . 0.0 111.351 177.701 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 36.4 t70 -89.1 9.1 26.65 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-O 121.401 0.62 . . . . 0.0 110.177 178.598 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 8.6 t 70.06 16.7 7.48 Favored 'General case' 0 C--N 1.342 0.279 0 CA-C-O 122.177 0.989 . . . . 0.0 109.301 -177.458 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 5.0 t -77.13 111.56 12.86 Favored 'General case' 0 N--CA 1.444 -0.754 0 CA-C-N 114.997 -1.001 . . . . 0.0 110.195 -179.821 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.419 ' HA ' ' O ' ' A' ' 26' ' ' VAL . 41.3 mt-10 -87.15 112.08 21.59 Favored 'General case' 0 CA--C 1.507 -0.705 0 N-CA-C 109.803 -0.443 . . . . 0.0 109.803 177.861 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 32.1 mm -101.6 136.86 31.54 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.659 0 N-CA-C 109.489 -0.56 . . . . 0.0 109.489 179.681 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 11.7 m170 -117.28 134.71 54.49 Favored 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 179.397 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -147.13 159.47 43.58 Favored 'General case' 0 C--N 1.309 -1.184 0 CA-C-O 121.22 0.533 . . . . 0.0 111.332 -177.765 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -116.41 117.21 29.32 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.743 -178.712 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 32.6 m -137.74 158.39 33.83 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 N-CA-C 109.884 -0.413 . . . . 0.0 109.884 179.787 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 24.2 mtpp -81.85 175.92 10.02 Favored 'General case' 0 CA--C 1.503 -0.837 0 CA-C-O 121.497 0.665 . . . . 0.0 111.205 178.382 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -83.05 -32.39 26.86 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-N 115.712 -0.676 . . . . 0.0 111.118 178.843 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 14.8 t -97.13 15.21 23.25 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.03 0.443 . . . . 0.0 112.002 -177.351 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 4.2 t -98.71 163.99 12.41 Favored 'General case' 0 C--N 1.316 -0.852 0 O-C-N 121.87 -0.518 . . . . 0.0 110.052 -178.908 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 27.6 m170 -77.34 142.68 39.24 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.458 0.647 . . . . 0.0 111.421 179.114 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.601 ' O ' ' HG3' ' A' ' 48' ' ' LYS . 0.2 OUTLIER -70.81 -15.96 62.7 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 115.391 -0.822 . . . . 0.0 109.41 -179.878 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.65 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -55.22 -45.43 75.96 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.868 -0.605 . . . . 0.0 112.576 -177.506 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 21.9 ptmt -66.46 -28.99 69.02 Favored 'General case' 0 C--O 1.22 -0.494 0 CA-C-O 121.283 0.563 . . . . 0.0 110.407 -178.699 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.494 ' HB3' HD11 ' A' ' 44' ' ' LEU . 8.1 tt -70.16 -47.72 60.41 Favored 'General case' 0 C--N 1.312 -1.052 0 CA-C-N 115.721 -0.672 . . . . 0.0 109.668 178.726 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.601 ' HG3' ' O ' ' A' ' 44' ' ' LEU . 20.9 mtpt -57.31 -48.12 79.77 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-O 121.512 0.673 . . . . 0.0 110.434 -179.329 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.65 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 6.3 pt-20 -71.61 -32.63 68.21 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.859 -178.386 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' SER . . . . . 0.411 ' O ' ' HG2' ' A' ' 53' ' ' GLN . 28.5 t -63.87 -46.44 84.92 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-O 121.173 0.511 . . . . 0.0 110.944 -179.687 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . 0.493 ' CD1' HG13 ' A' ' 26' ' ' VAL . 1.9 p90 -76.46 -32.55 58.46 Favored 'General case' 0 N--CA 1.44 -0.931 0 C-N-CA 119.976 -0.689 . . . . 0.0 110.564 -177.783 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . 0.509 ' SG ' HD11 ' A' ' 62' ' ' LEU . 74.7 m -63.63 -43.37 97.03 Favored 'General case' 0 CA--C 1.511 -0.537 0 CA-C-O 121.159 0.504 . . . . 0.0 110.704 179.226 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . 0.411 ' HG2' ' O ' ' A' ' 50' ' ' SER . 13.7 pt20 -67.5 -34.77 77.82 Favored 'General case' 0 N--CA 1.443 -0.786 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.271 -179.875 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.513 ' HA ' ' NE ' ' A' ' 54' ' ' ARG . 4.0 mmp_? -58.08 -38.53 76.55 Favored 'General case' 0 C--N 1.347 0.47 0 CA-C-O 121.075 0.464 . . . . 0.0 111.444 177.496 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.438 HE21 ' HB2' ' A' ' 55' ' ' GLN . 3.0 mt-30 -79.91 -21.13 44.3 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 121.218 0.533 . . . . 0.0 110.956 179.519 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 83.64 29.31 32.81 Favored Glycine 0 N--CA 1.448 -0.553 0 C-N-CA 121.005 -0.617 . . . . 0.0 112.24 178.313 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 28.8 m -130.62 151.59 78.98 Favored Pre-proline 0 C--N 1.323 -0.56 0 O-C-N 122.238 -0.566 . . . . 0.0 111.074 -177.824 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . 0.545 ' HG2' ' OG ' ' A' ' 61' ' ' SER . 19.2 Cg_endo -64.5 155.11 68.16 Favored 'Trans proline' 0 N--CA 1.455 -0.773 0 C-N-CA 122.301 2.001 . . . . 0.0 111.481 176.405 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 82.4 mtp -74.69 -8.77 57.41 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-O 121.146 0.498 . . . . 0.0 111.458 -176.101 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 29.9 p30 -91.58 -10.43 40.56 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 121.328 0.585 . . . . 0.0 110.749 -179.445 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.545 ' OG ' ' HG2' ' A' ' 58' ' ' PRO . 71.4 m -83.47 -24.8 31.64 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 121.175 0.512 . . . . 0.0 111.649 -179.106 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.509 HD11 ' SG ' ' A' ' 52' ' ' CYS . 1.4 pp -124.99 170.14 11.43 Favored 'General case' 0 C--N 1.302 -1.473 0 N-CA-C 112.685 0.624 . . . . 0.0 112.685 -175.629 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.529 ' O ' ' HA ' ' A' ' 90' ' ' VAL . 42.2 mtm180 -119.14 120.02 35.89 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.811 -0.632 . . . . 0.0 110.66 -178.223 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -102.61 114.76 29.25 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-O 121.124 0.488 . . . . 0.0 110.993 178.264 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.444 ' C ' HD23 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -143.72 162.91 34.77 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-O 121.39 0.614 . . . . 0.0 111.059 -179.854 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 85.9 t80 -144.61 134.15 23.35 Favored 'General case' 0 C--N 1.31 -1.137 0 CA-C-N 116.01 -0.541 . . . . 0.0 109.614 179.168 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 49.31 26.85 1.69 Allowed 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 124.282 1.033 . . . . 0.0 112.562 179.964 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 87.25 22.81 42.99 Favored Glycine 0 N--CA 1.446 -0.653 0 C-N-CA 121.049 -0.596 . . . . 0.0 113.471 -179.683 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -130.06 138.2 50.62 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 179.198 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -72.34 146.75 46.89 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-O 121.28 0.562 . . . . 0.0 110.031 178.065 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 23.6 mm -94.94 122.27 46.24 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.255 0 CA-C-O 121.174 0.511 . . . . 0.0 110.546 -179.016 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -96.67 160.75 14.21 Favored 'General case' 0 N--CA 1.44 -0.949 0 N-CA-C 109.468 -0.567 . . . . 0.0 109.468 179.561 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . 0.437 ' CA ' ' HB3' ' A' ' 45' ' ' LYS . 11.6 p-10 -68.94 -21.9 64.17 Favored 'General case' 0 C--N 1.311 -1.08 0 CA-C-O 121.377 0.608 . . . . 0.0 111.04 -179.323 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 4.9 m-80 -96.8 1.86 51.23 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-O 121.209 0.528 . . . . 0.0 109.63 -179.721 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . 0.557 ' O ' ' HB2' ' A' ' 44' ' ' LEU . 2.8 m170 -81.29 146.32 30.46 Favored 'General case' 0 CA--C 1.501 -0.915 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 -179.234 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.458 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 72.7 p -118.48 153.83 52.08 Favored Pre-proline 0 C--N 1.302 -1.465 0 C-N-CA 121.038 -0.265 . . . . 0.0 110.699 178.383 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 22.1 Cg_endo -62.1 -37.92 60.21 Favored 'Trans proline' 0 N--CA 1.455 -0.783 0 C-N-CA 122.197 1.931 . . . . 0.0 111.395 -179.387 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . 0.535 ' HG3' ' N ' ' A' ' 79' ' ' GLU . 36.2 pttt -66.11 -41.52 90.46 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.917 0.389 . . . . 0.0 110.797 -179.652 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . 0.535 ' N ' ' HG3' ' A' ' 78' ' ' LYS . 49.7 mm-40 -70.33 -35.9 73.92 Favored 'General case' 0 CA--C 1.515 -0.398 0 CA-C-O 121.023 0.44 . . . . 0.0 111.305 -178.63 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.515 HD22 ' CG ' ' A' ' 75' ' ' HIS . 5.2 mt -78.15 -8.02 57.77 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 120.514 -0.474 . . . . 0.0 110.712 179.843 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 84.07 38.98 9.61 Favored Glycine 0 C--N 1.321 -0.265 0 C-N-CA 120.965 -0.636 . . . . 0.0 112.777 177.905 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 61.6 mtt -100.87 162.34 12.97 Favored 'General case' 0 C--N 1.314 -0.946 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 179.193 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . 0.427 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 4.9 pt-20 -143.4 -171.83 3.58 Favored 'General case' 0 C--N 1.306 -1.303 0 N-CA-C 109.914 -0.402 . . . . 0.0 109.914 179.953 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -69.85 136.59 50.89 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.103 0.478 . . . . 0.0 111.235 -178.777 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 75.55 5.21 4.04 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.712 1.205 . . . . 0.0 111.285 179.306 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . 0.427 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 1.9 t0 -62.78 162.48 10.85 Favored 'General case' 0 C--O 1.238 0.495 0 CA-C-O 121.347 0.594 . . . . 0.0 111.065 177.719 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . 0.423 ' HA ' ' O ' ' A' ' 25' ' ' LYS . 11.4 p -128.51 144.07 39.09 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.911 0 CA-C-O 121.383 0.611 . . . . 0.0 111.734 -176.82 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 3.6 mp -115.5 153.66 17.02 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.758 0 N-CA-C 108.728 -0.842 . . . . 0.0 108.728 178.518 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -107.85 139.44 42.44 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 121.195 0.521 . . . . 0.0 110.915 -176.836 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . 0.529 ' HA ' ' O ' ' A' ' 63' ' ' ARG . 63.3 t -128.77 133.47 66.25 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.023 0 CA-C-O 121.412 0.625 . . . . 0.0 110.949 179.844 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 86.7 m-85 -118.63 179.67 4.06 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-N 115.972 -0.558 . . . . 0.0 109.79 179.183 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 7.5 tp60 -109.47 131.84 54.69 Favored 'General case' 0 C--N 1.316 -0.871 0 O-C-N 122.267 -0.271 . . . . 0.0 110.763 179.207 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' GLU . . . . . 0.404 ' OE1' ' HG2' ' A' ' 63' ' ' ARG . 7.4 pt-20 . . . . . 0 CA--C 1.533 0.316 0 CA-C-O 120.753 0.311 . . . . 0.0 110.691 177.899 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . 0.467 ' HB ' ' HA ' ' A' ' 84' ' ' GLU . 25.9 pt . . . . . 0 N--CA 1.441 -0.921 0 CA-C-O 121.465 0.65 . . . . 0.0 109.79 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.477 ' HE3' ' HG3' ' A' ' 85' ' ' GLU . 0.0 OUTLIER -117.43 149.03 41.24 Favored 'General case' 0 C--N 1.293 -1.872 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 -179.156 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -142.04 158.41 43.79 Favored 'General case' 0 C--N 1.3 -1.581 0 CA-C-O 121.406 0.622 . . . . 0.0 111.477 175.201 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 5.3 tmmm? -128.73 141.97 51.15 Favored 'General case' 0 N--CA 1.436 -1.158 0 CA-C-N 115.604 -0.725 . . . . 0.0 110.225 179.945 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . 0.537 ' O ' ' HA ' ' A' ' 33' ' ' GLU . 0.9 OUTLIER -112.92 142.35 25.59 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.442 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.293 -179.372 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.473 ' O ' ' HB ' ' A' ' 90' ' ' VAL . 44.6 mm -103.92 115.22 45.45 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.359 0 N-CA-C 106.83 -1.544 . . . . 0.0 106.83 173.562 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . 0.424 ' HA2' ' HB ' ' A' ' 90' ' ' VAL . . . -86.26 161.64 34.41 Favored Glycine 0 N--CA 1.422 -2.256 0 C-N-CA 120.022 -1.085 . . . . 0.0 111.185 -175.971 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.17 -24.08 62.77 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-O 121.417 0.627 . . . . 0.0 111.081 176.556 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -96.9 20.1 11.63 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 121.504 0.669 . . . . 0.0 109.658 178.774 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 43.2 m 64.28 17.61 10.83 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-O 121.84 0.829 . . . . 0.0 110.53 -179.101 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 10.6 t -76.8 108.78 10.06 Favored 'General case' 0 N--CA 1.444 -0.734 0 CA-C-N 115.152 -0.931 . . . . 0.0 110.222 -179.372 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.537 ' HA ' ' O ' ' A' ' 26' ' ' VAL . 41.9 mt-10 -87.15 109.79 19.69 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 121.363 0.602 . . . . 0.0 109.943 178.38 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 33.5 mm -100.9 139.11 23.02 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.431 0 CA-C-N 116.037 -0.529 . . . . 0.0 109.596 -178.756 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 12.2 m170 -117.34 132.4 56.6 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 109.395 -0.595 . . . . 0.0 109.395 179.851 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 1.3 p90 -147.61 163.9 35.16 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-O 121.216 0.532 . . . . 0.0 111.603 -178.668 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 88.1 mttt -119.66 119.47 33.8 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.66 -179.123 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 35.7 m -138.81 157.93 29.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-O 120.911 0.386 . . . . 0.0 110.276 178.904 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 47.5 mtpt -83.12 178.14 8.25 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-O 121.45 0.643 . . . . 0.0 111.426 179.073 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -87.26 -31.17 20.4 Favored 'General case' 0 C--N 1.313 -1.01 0 CA-C-O 121.371 0.605 . . . . 0.0 110.144 178.04 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 9.0 t -98.78 19.71 14.36 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.312 -177.268 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 10.0 t -105.54 176.01 5.31 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 178.678 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 53.0 m170 -91.76 147.34 23.06 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-O 121.432 0.634 . . . . 0.0 111.387 -179.426 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.603 ' HB2' ' O ' ' A' ' 75' ' ' HIS . 0.2 OUTLIER -74.58 -12.61 60.5 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 115.53 -0.759 . . . . 0.0 109.226 179.113 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.766 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -57.15 -45.11 83.88 Favored 'General case' 0 N--CA 1.442 -0.825 0 CA-C-N 115.563 -0.744 . . . . 0.0 111.899 -178.55 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . 0.42 ' HG3' ' N ' ' A' ' 47' ' ' LEU . 19.4 ptpt -65.85 -32.1 73.43 Favored 'General case' 0 CA--C 1.508 -0.651 0 CA-C-O 121.695 0.759 . . . . 0.0 109.883 -178.888 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.45 ' HB3' HD12 ' A' ' 44' ' ' LEU . 8.2 tt -71.05 -51.55 24.65 Favored 'General case' 0 N--CA 1.428 -1.553 0 CA-C-N 115.197 -0.911 . . . . 0.0 110.738 -176.724 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.453 ' HA ' ' CD2' ' A' ' 51' ' ' TYR . 6.4 ptmm? -61.19 -41.01 96.04 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.721 -178.017 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.766 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 8.8 pt-20 -72.46 -30.92 65.0 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-O 121.029 0.443 . . . . 0.0 110.703 178.012 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' SER . . . . . 0.562 ' O ' ' HG2' ' A' ' 54' ' ' ARG . 32.7 t -68.71 -44.73 73.31 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.945 0.402 . . . . 0.0 111.677 -178.632 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . 0.453 ' CD2' ' HA ' ' A' ' 48' ' ' LYS . 2.3 p90 -75.06 -32.82 61.61 Favored 'General case' 0 N--CA 1.446 -0.657 0 C-N-CA 119.512 -0.875 . . . . 0.0 110.176 -178.09 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . 0.498 ' SG ' HD11 ' A' ' 62' ' ' LEU . 83.5 m -59.8 -43.94 94.2 Favored 'General case' 0 C--O 1.238 0.454 0 CA-C-O 120.938 0.399 . . . . 0.0 110.703 177.985 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 11.9 pt20 -69.94 -33.69 72.47 Favored 'General case' 0 N--CA 1.447 -0.622 0 C-N-CA 120.769 -0.373 . . . . 0.0 110.617 -179.213 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.562 ' HG2' ' O ' ' A' ' 50' ' ' SER . 9.3 mmp_? -54.78 -40.99 69.99 Favored 'General case' 0 C--N 1.351 0.634 0 CA-C-O 121.403 0.62 . . . . 0.0 110.607 176.192 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.427 HE21 ' HB2' ' A' ' 55' ' ' GLN . 2.9 mt-30 -78.45 -21.48 49.05 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.747 179.6 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 81.74 27.48 46.4 Favored Glycine 0 N--CA 1.443 -0.887 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.223 179.276 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 33.9 m -127.18 148.1 64.62 Favored Pre-proline 0 C--N 1.321 -0.666 0 O-C-N 122.505 -0.409 . . . . 0.0 110.283 -179.145 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . 0.459 ' HG2' ' OG ' ' A' ' 61' ' ' SER . 26.0 Cg_endo -64.87 150.52 88.01 Favored 'Trans proline' 0 N--CA 1.457 -0.647 0 C-N-CA 122.278 1.985 . . . . 0.0 111.999 178.632 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.414 ' HG2' ' SG ' ' A' ' 52' ' ' CYS . 66.2 mtp -69.06 -9.11 50.97 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.231 0.538 . . . . 0.0 111.721 -176.905 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 28.8 p30 -88.82 -12.88 40.72 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-O 121.214 0.53 . . . . 0.0 111.33 -178.751 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.459 ' OG ' ' HG2' ' A' ' 58' ' ' PRO . 55.6 m -88.06 -19.08 27.59 Favored 'General case' 0 C--N 1.316 -0.878 0 N-CA-C 112.654 0.613 . . . . 0.0 112.654 -177.738 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.498 HD11 ' SG ' ' A' ' 52' ' ' CYS . 1.5 pp -132.4 159.96 37.74 Favored 'General case' 0 C--N 1.315 -0.934 0 N-CA-C 113.413 0.894 . . . . 0.0 113.413 -177.386 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.485 ' O ' ' HA ' ' A' ' 90' ' ' VAL . 50.0 mtm-85 -107.86 124.87 50.73 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 114.903 -1.044 . . . . 0.0 111.741 -177.997 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -106.09 117.26 33.56 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.545 178.329 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.466 ' C ' HD23 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -143.01 160.85 39.57 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-O 121.362 0.601 . . . . 0.0 111.161 179.951 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 90.7 t80 -141.35 134.26 28.96 Favored 'General case' 0 C--N 1.31 -1.118 0 N-CA-C 109.033 -0.729 . . . . 0.0 109.033 178.775 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 6.4 pt-20 50.04 26.75 2.19 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 124.124 0.97 . . . . 0.0 112.33 -179.16 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 85.02 25.03 42.22 Favored Glycine 0 N--CA 1.447 -0.627 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.948 -178.833 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . 0.439 ' OE1' HD21 ' A' ' 80' ' ' LEU . 3.3 pt20 -130.86 136.71 48.9 Favored 'General case' 0 C--N 1.322 -0.619 0 O-C-N 122.074 -0.663 . . . . 0.0 109.888 179.279 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . 0.428 ' HD3' ' N ' ' A' ' 70' ' ' ARG . 0.0 OUTLIER -66.72 146.88 53.98 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-O 121.336 0.588 . . . . 0.0 110.557 178.067 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.429 HG12 ' HA ' ' A' ' 65' ' ' LEU . 20.9 mm -101.45 118.05 47.64 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.133 0 CA-C-O 120.89 0.376 . . . . 0.0 110.264 -179.535 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -99.65 167.34 10.63 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-O 120.882 0.373 . . . . 0.0 110.365 -179.517 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . 0.49 ' CA ' ' HB3' ' A' ' 45' ' ' LYS . 7.8 p-10 -67.92 -22.1 65.09 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-O 121.194 0.521 . . . . 0.0 111.391 -179.618 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 8.0 m-80 -98.56 1.09 46.15 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-O 121.338 0.589 . . . . 0.0 110.076 -178.324 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . 0.603 ' O ' ' HB2' ' A' ' 44' ' ' LEU . 2.1 m170 -80.8 142.71 33.46 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 -179.512 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.45 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 81.0 p -116.96 153.25 49.44 Favored Pre-proline 0 C--N 1.306 -1.302 0 CA-C-N 116.79 -0.186 . . . . 0.0 111.29 -179.949 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_exo -58.2 -39.68 82.89 Favored 'Trans proline' 0 C--N 1.347 0.484 0 C-N-CA 122.492 2.128 . . . . 0.0 111.586 178.809 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . 0.516 ' HG3' ' N ' ' A' ' 79' ' ' GLU . 32.7 pttt -67.39 -39.61 85.62 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.082 -178.379 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . 0.516 ' N ' ' HG3' ' A' ' 78' ' ' LYS . 45.9 mm-40 -73.31 -35.66 66.11 Favored 'General case' 0 CA--C 1.511 -0.553 0 CA-C-O 121.166 0.508 . . . . 0.0 110.936 -179.206 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.491 HD22 ' CG ' ' A' ' 75' ' ' HIS . 5.4 mt -81.1 -3.93 53.6 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.074 0.464 . . . . 0.0 110.96 -179.456 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 75.45 48.1 11.32 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.972 -0.632 . . . . 0.0 112.813 177.738 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 63.5 mtt -105.64 161.13 14.65 Favored 'General case' 0 C--N 1.315 -0.929 0 N-CA-C 110.023 -0.362 . . . . 0.0 110.023 178.83 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 14.2 pt-20 -143.04 -173.03 3.8 Favored 'General case' 0 C--N 1.317 -0.841 0 N-CA-C 109.917 -0.401 . . . . 0.0 109.917 179.134 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.467 ' HA ' ' HB ' ' A' ' 22' ' ' ILE . 11.6 pt-20 -68.33 126.46 29.66 Favored 'General case' 0 N--CA 1.447 -0.584 0 CA-C-O 121.466 0.65 . . . . 0.0 111.68 -179.188 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . 0.477 ' HG3' ' HE3' ' A' ' 23' ' ' LYS . 33.5 mt-10 77.54 8.39 2.66 Favored 'General case' 0 C--N 1.322 -0.625 0 C-N-CA 124.723 1.209 . . . . 0.0 112.738 177.19 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -63.42 167.15 5.69 Favored 'General case' 0 C--O 1.239 0.539 0 CA-C-O 121.082 0.468 . . . . 0.0 110.302 174.754 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 15.0 p -125.9 143.93 37.73 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.036 0 CA-C-O 121.516 0.674 . . . . 0.0 111.752 -176.153 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 2.3 mt -111.86 152.96 13.63 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 N-CA-C 108.836 -0.801 . . . . 0.0 108.836 177.646 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . 0.405 ' O ' HD11 ' A' ' 65' ' ' LEU . 9.5 tp10 -106.64 137.44 44.65 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-O 120.924 0.392 . . . . 0.0 110.58 -177.38 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . 0.485 ' HA ' ' O ' ' A' ' 63' ' ' ARG . 90.2 t -129.02 133.4 66.08 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-O 121.317 0.58 . . . . 0.0 111.454 178.667 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 82.1 m-85 -118.92 178.41 4.5 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.375 179.429 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 9.5 tp60 -105.15 135.95 45.54 Favored 'General case' 0 C--N 1.31 -1.124 0 O-C-N 122.241 -0.287 . . . . 0.0 110.623 -179.281 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 . . . . . 0 C--N 1.33 -0.28 0 CA-C-O 121.262 0.553 . . . . 0.0 110.403 176.358 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 24.0 pt . . . . . 0 N--CA 1.445 -0.678 0 N-CA-C 109.395 -0.594 . . . . 0.0 109.395 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 45.3 mtmt -115.75 142.54 46.61 Favored 'General case' 0 C--N 1.294 -1.827 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 -179.509 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.4 mp -136.21 162.59 32.55 Favored 'General case' 0 C--N 1.302 -1.473 0 CA-C-O 121.098 0.475 . . . . 0.0 110.445 175.257 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.445 ' HE2' ' HB3' ' A' ' 25' ' ' LYS . 5.3 tmmm? -133.62 143.59 48.72 Favored 'General case' 0 C--N 1.308 -1.211 0 CA-C-O 121.403 0.621 . . . . 0.0 110.592 -178.786 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . 0.485 HG12 ' CD1' ' A' ' 51' ' ' TYR . 0.9 OUTLIER -115.0 143.33 24.98 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.454 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.046 -179.896 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.426 ' O ' ' HB ' ' A' ' 90' ' ' VAL . 45.4 mm -107.61 116.57 51.42 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.022 0 N-CA-C 107.683 -1.228 . . . . 0.0 107.683 175.392 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . 0.431 ' HA2' ' HB ' ' A' ' 90' ' ' VAL . . . -84.65 175.44 50.68 Favored Glycine 0 N--CA 1.419 -2.488 0 C-N-CA 120.158 -1.02 . . . . 0.0 111.834 -177.312 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.57 -22.18 63.55 Favored 'General case' 0 C--N 1.302 -1.476 0 CA-C-O 121.626 0.727 . . . . 0.0 110.324 179.906 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -100.57 13.73 33.71 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.693 -0.685 . . . . 0.0 109.219 178.523 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 19.3 m 71.49 15.59 6.11 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 115.376 -0.829 . . . . 0.0 111.319 179.265 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 10.9 t -72.35 114.59 10.63 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 109.697 -0.482 . . . . 0.0 109.697 179.199 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.443 ' HA ' ' O ' ' A' ' 26' ' ' VAL . 34.5 mt-10 -87.55 108.62 19.14 Favored 'General case' 0 CA--C 1.509 -0.61 0 CA-C-O 121.164 0.507 . . . . 0.0 110.42 179.187 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 38.9 mm -97.88 137.69 24.76 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.589 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 179.206 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 12.4 m170 -115.97 136.56 52.92 Favored 'General case' 0 C--N 1.315 -0.918 0 N-CA-C 109.3 -0.63 . . . . 0.0 109.3 -179.045 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -147.28 155.66 42.24 Favored 'General case' 0 C--N 1.308 -1.196 0 CA-C-O 121.309 0.576 . . . . 0.0 111.275 -178.501 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 93.4 mttt -113.67 113.37 24.92 Favored 'General case' 0 C--N 1.31 -1.13 0 CA-C-N 115.723 -0.672 . . . . 0.0 109.999 -179.177 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 28.2 m -134.91 158.18 41.28 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.768 0 CA-C-O 120.87 0.367 . . . . 0.0 110.069 -179.792 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.538 ' O ' HG22 ' A' ' 42' ' ' THR . 80.8 tttt -90.33 165.13 14.05 Favored 'General case' 0 C--N 1.311 -1.066 0 O-C-N 121.822 -0.549 . . . . 0.0 110.683 -179.021 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -70.14 -37.02 75.16 Favored 'General case' 0 N--CA 1.463 0.224 0 O-C-N 121.969 -0.457 . . . . 0.0 111.854 -177.771 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 14.5 t -97.13 19.09 13.51 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-O 120.939 0.4 . . . . 0.0 111.93 -176.471 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' THR . . . . . 0.538 HG22 ' O ' ' A' ' 39' ' ' LYS . 3.4 t -100.24 167.64 10.3 Favored 'General case' 0 C--N 1.323 -0.561 0 O-C-N 121.797 -0.564 . . . . 0.0 109.72 178.855 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 37.3 m170 -82.16 141.77 32.78 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 121.576 0.703 . . . . 0.0 111.459 179.903 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.595 ' HB2' ' O ' ' A' ' 75' ' ' HIS . 0.2 OUTLIER -70.84 -13.88 62.2 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.459 -0.791 . . . . 0.0 109.731 -179.741 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.729 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -54.59 -43.65 72.34 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 115.787 -0.642 . . . . 0.0 112.009 -179.31 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . 0.432 ' N ' ' HD3' ' A' ' 45' ' ' LYS . 21.9 ptmt -69.23 -28.4 66.31 Favored 'General case' 0 C--O 1.201 -1.451 0 CA-C-O 120.911 0.386 . . . . 0.0 110.462 -179.158 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.51 ' HB3' HD12 ' A' ' 44' ' ' LEU . 8.4 tt -74.36 -49.34 23.14 Favored 'General case' 0 C--N 1.302 -1.459 0 CA-C-O 120.994 0.426 . . . . 0.0 110.631 -178.855 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.449 ' HZ2' ' CG ' ' A' ' 73' ' ' ASP . 6.8 ptmm? -62.6 -43.17 99.47 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.328 -0.397 . . . . 0.0 111.404 -177.555 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.729 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 8.1 pt-20 -70.8 -33.47 70.76 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-O 121.021 0.439 . . . . 0.0 110.626 178.139 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' SER . . . . . 0.652 ' O ' ' HG2' ' A' ' 54' ' ' ARG . 10.5 m -67.81 -41.87 82.42 Favored 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 -178.122 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . 0.485 ' CD1' HG12 ' A' ' 26' ' ' VAL . 3.4 p90 -76.68 -33.09 58.27 Favored 'General case' 0 C--N 1.32 -0.707 0 C-N-CA 119.129 -1.029 . . . . 0.0 110.392 -178.532 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . 0.571 ' SG ' HD12 ' A' ' 62' ' ' LEU . 90.6 m -62.42 -44.89 95.34 Favored 'General case' 0 CA--C 1.509 -0.625 0 CA-C-O 121.296 0.57 . . . . 0.0 110.465 179.419 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . 0.411 ' HG2' ' O ' ' A' ' 50' ' ' SER . 13.8 pt20 -67.23 -33.83 76.19 Favored 'General case' 0 N--CA 1.44 -0.953 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.743 -179.392 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.652 ' HG2' ' O ' ' A' ' 50' ' ' SER . 40.4 mmt180 -56.59 -44.4 81.04 Favored 'General case' 0 C--N 1.351 0.638 0 CA-C-O 121.368 0.604 . . . . 0.0 110.434 177.002 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.424 HE21 ' HB2' ' A' ' 55' ' ' GLN . 4.0 mt-30 -73.38 -20.82 60.66 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.736 -0.666 . . . . 0.0 111.462 -179.555 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 79.66 33.37 34.5 Favored Glycine 0 N--CA 1.448 -0.547 0 C-N-CA 120.675 -0.774 . . . . 0.0 111.765 -179.758 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 29.1 m -132.93 151.28 77.72 Favored Pre-proline 0 C--O 1.24 0.565 0 O-C-N 122.532 -0.393 . . . . 0.0 110.518 -179.298 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . 0.441 ' HG2' ' OG ' ' A' ' 61' ' ' SER . 40.9 Cg_endo -69.62 148.93 67.08 Favored 'Trans proline' 0 N--CA 1.459 -0.555 0 C-N-CA 122.506 2.138 . . . . 0.0 112.307 179.065 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.52 ' HG2' ' SG ' ' A' ' 52' ' ' CYS . 72.8 mtp -71.22 -11.28 60.84 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.602 -0.726 . . . . 0.0 111.637 -177.382 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 24.7 p30 -88.02 -12.2 45.09 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-O 121.311 0.577 . . . . 0.0 111.461 -179.191 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.441 ' OG ' ' HG2' ' A' ' 58' ' ' PRO . 66.4 m -90.49 -20.85 22.23 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-O 120.928 0.394 . . . . 0.0 111.951 -179.585 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.571 HD12 ' SG ' ' A' ' 52' ' ' CYS . 2.0 pp -123.32 164.99 17.75 Favored 'General case' 0 C--N 1.313 -0.986 0 N-CA-C 113.031 0.752 . . . . 0.0 113.031 -177.796 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.529 ' O ' ' HA ' ' A' ' 90' ' ' VAL . 5.8 mtp180 -114.47 123.13 48.64 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.538 -0.755 . . . . 0.0 110.585 -178.691 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . 0.465 ' HB3' ' OH ' ' A' ' 51' ' ' TYR . 0.2 OUTLIER -104.27 113.48 27.06 Favored 'General case' 0 C--N 1.307 -1.278 0 CA-C-O 120.986 0.422 . . . . 0.0 110.145 176.53 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.44 ' C ' HD21 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -142.79 165.13 28.21 Favored 'General case' 0 N--CA 1.438 -1.068 0 CA-C-O 121.634 0.73 . . . . 0.0 111.88 -179.144 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 92.3 t80 -145.44 134.76 23.0 Favored 'General case' 0 C--N 1.305 -1.361 0 N-CA-C 108.542 -0.91 . . . . 0.0 108.542 178.537 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 50.24 26.7 2.3 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 124.359 1.064 . . . . 0.0 112.204 -177.927 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 86.79 17.5 59.72 Favored Glycine 0 CA--C 1.519 0.287 0 C-N-CA 120.781 -0.723 . . . . 0.0 113.314 -178.803 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . 0.41 ' O ' ' HB2' ' A' ' 65' ' ' LEU . 2.9 pt20 -124.39 134.65 53.06 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 -179.74 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -70.25 146.7 50.47 Favored 'General case' 0 C--N 1.312 -1.032 0 CA-C-O 121.376 0.608 . . . . 0.0 110.301 178.017 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 22.7 mm -94.36 122.76 46.11 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.55 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.283 -178.557 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -98.79 166.75 11.16 Favored 'General case' 0 N--CA 1.439 -0.978 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 -179.499 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . 0.449 ' CG ' ' HZ2' ' A' ' 48' ' ' LYS . 6.2 m-20 -67.55 -26.0 66.09 Favored 'General case' 0 C--N 1.313 -1.001 0 CA-C-O 121.265 0.555 . . . . 0.0 111.259 -178.421 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 8.1 m-80 -97.23 4.99 50.79 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-O 121.327 0.584 . . . . 0.0 110.097 -177.799 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . 0.595 ' O ' ' HB2' ' A' ' 44' ' ' LEU . 2.5 m170 -83.68 145.94 28.51 Favored 'General case' 0 CA--C 1.507 -0.71 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 179.232 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.4 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 43.7 p -122.81 158.76 56.12 Favored Pre-proline 0 C--N 1.31 -1.119 0 C-N-CA 121.012 -0.275 . . . . 0.0 110.742 179.003 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_exo -60.81 -40.54 53.09 Favored 'Trans proline' 0 N--CA 1.457 -0.627 0 C-N-CA 122.538 2.159 . . . . 0.0 111.604 179.054 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . 0.519 ' HG3' ' N ' ' A' ' 79' ' ' GLU . 20.7 pttt -68.99 -36.75 78.18 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.947 0.404 . . . . 0.0 110.992 -177.935 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . 0.519 ' N ' ' HG3' ' A' ' 78' ' ' LYS . 52.5 mm-40 -69.84 -40.56 75.74 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-O 120.921 0.391 . . . . 0.0 110.636 -179.243 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.422 HD23 ' CG ' ' A' ' 75' ' ' HIS . 5.4 mt -79.74 -6.71 57.78 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.25 0.548 . . . . 0.0 110.864 -178.985 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 80.45 45.14 8.17 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.967 -0.635 . . . . 0.0 113.01 177.794 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 59.5 mtt -102.7 163.33 12.28 Favored 'General case' 0 C--N 1.317 -0.806 0 N-CA-C 109.755 -0.461 . . . . 0.0 109.755 178.388 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -136.93 -172.45 3.19 Favored 'General case' 0 C--N 1.312 -1.045 0 CA-C-O 120.884 0.373 . . . . 0.0 110.01 179.113 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -70.43 141.47 52.1 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 177.738 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 73.78 1.93 4.07 Favored 'General case' 0 CA--C 1.552 1.05 0 C-N-CA 123.826 0.851 . . . . 0.0 111.283 179.868 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -63.91 161.77 15.03 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-O 121.269 0.557 . . . . 0.0 110.97 179.123 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . 0.419 ' HA ' ' O ' ' A' ' 25' ' ' LYS . 8.6 p -127.64 142.88 42.43 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.079 0 CA-C-O 121.418 0.627 . . . . 0.0 111.505 -176.302 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 3.7 mp -112.57 152.93 14.27 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.855 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 178.667 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . 0.402 ' O ' HD13 ' A' ' 65' ' ' LEU . 7.2 tp10 -105.43 137.49 43.17 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-O 120.969 0.414 . . . . 0.0 110.484 -175.785 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . 0.529 ' HA ' ' O ' ' A' ' 63' ' ' ARG . 78.4 t -128.75 135.7 61.64 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.887 0 CA-C-O 121.259 0.552 . . . . 0.0 110.793 179.16 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 91.8 m-85 -122.71 177.84 5.28 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.201 179.155 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 9.6 tp60 -108.44 121.32 44.7 Favored 'General case' 0 C--N 1.312 -1.051 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 179.553 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' GLU . . . . . 0.463 ' HB3' ' CG ' ' A' ' 63' ' ' ARG . 9.3 pt-20 . . . . . 0 C--O 1.236 0.349 0 CA-C-O 121.022 0.439 . . . . 0.0 111.068 179.991 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 23.0 pt . . . . . 0 N--CA 1.444 -0.744 0 CA-C-O 121.39 0.614 . . . . 0.0 110.446 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.404 ' HE3' ' HB2' ' A' ' 23' ' ' LYS . 40.8 mtmt -119.11 142.07 48.23 Favored 'General case' 0 C--N 1.304 -1.406 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 -179.367 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.5 mp -136.04 164.11 28.77 Favored 'General case' 0 C--N 1.304 -1.411 0 CA-C-O 121.268 0.556 . . . . 0.0 110.811 176.097 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 5.6 tmmm? -136.45 145.06 44.79 Favored 'General case' 0 C--N 1.311 -1.107 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.448 -179.271 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . 0.542 ' O ' ' HA ' ' A' ' 33' ' ' GLU . 0.9 OUTLIER -115.73 142.44 28.93 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.291 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.968 -179.768 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.423 ' CD1' ' HG2' ' A' ' 33' ' ' GLU . 45.4 mm -109.17 98.15 6.66 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.874 0 N-CA-C 108.498 -0.927 . . . . 0.0 108.498 175.884 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . 0.514 ' HA2' ' HB ' ' A' ' 90' ' ' VAL . . . -67.12 166.04 41.66 Favored Glycine 0 N--CA 1.436 -1.339 0 C-N-CA 120.45 -0.881 . . . . 0.0 112.764 178.321 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.43 -16.9 40.47 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 121.129 0.49 . . . . 0.0 112.311 179.209 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -102.76 18.1 22.25 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 121.487 0.66 . . . . 0.0 109.69 178.754 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 7.3 m 69.72 17.21 7.79 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.376 -179.134 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 12.8 t -73.46 108.48 6.35 Favored 'General case' 0 N--CA 1.444 -0.766 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.698 -178.458 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.542 ' HA ' ' O ' ' A' ' 26' ' ' VAL . 40.6 mt-10 -87.09 104.29 16.19 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-O 121.111 0.481 . . . . 0.0 110.479 178.287 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 40.2 mm -97.21 136.86 26.55 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.426 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 178.103 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 12.8 m170 -114.78 134.48 55.08 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 -178.148 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 1.1 p90 -147.15 158.37 43.92 Favored 'General case' 0 C--N 1.309 -1.193 0 CA-C-O 121.397 0.618 . . . . 0.0 111.061 -178.919 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 7.3 ptpt -120.1 120.74 37.13 Favored 'General case' 0 C--N 1.307 -1.26 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.289 -178.913 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 33.4 m -139.87 162.0 25.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-O 121.352 0.596 . . . . 0.0 110.962 -178.514 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.58 ' O ' HG23 ' A' ' 42' ' ' THR . 19.1 mmmt -80.8 156.03 26.35 Favored 'General case' 0 C--N 1.312 -1.025 0 CA-C-O 121.027 0.442 . . . . 0.0 110.851 177.488 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' MET . . . . . 0.449 ' O ' ' HG2' ' A' ' 78' ' ' LYS . 0.0 OUTLIER -70.55 -35.51 73.15 Favored 'General case' 0 CA--C 1.506 -0.746 0 CA-C-O 121.404 0.621 . . . . 0.0 109.903 177.521 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 12.9 t -91.98 18.48 7.85 Favored 'General case' 0 N--CA 1.438 -1.035 0 CA-C-N 115.724 -0.671 . . . . 0.0 112.284 -176.396 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' THR . . . . . 0.58 HG23 ' O ' ' A' ' 39' ' ' LYS . 3.7 t -105.51 169.93 8.18 Favored 'General case' 0 C--N 1.323 -0.579 0 O-C-N 121.876 -0.515 . . . . 0.0 110.157 -179.705 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 40.2 m170 -81.65 141.65 33.46 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 121.561 0.696 . . . . 0.0 111.487 179.79 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.586 ' HB2' ' O ' ' A' ' 75' ' ' HIS . 0.2 OUTLIER -70.96 -12.14 61.37 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 115.303 -0.862 . . . . 0.0 109.596 179.702 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.806 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -55.65 -50.24 70.75 Favored 'General case' 0 N--CA 1.441 -0.884 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.802 -179.186 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . 0.499 ' O ' ' HB2' ' A' ' 50' ' ' SER . 20.7 ptmt -63.31 -29.14 70.51 Favored 'General case' 0 C--O 1.218 -0.576 0 CA-C-O 121.318 0.58 . . . . 0.0 110.688 -177.928 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.491 ' HB3' HD13 ' A' ' 44' ' ' LEU . 8.4 tt -72.63 -50.86 22.36 Favored 'General case' 0 C--N 1.307 -1.265 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.766 -179.072 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.474 ' HA ' ' CD2' ' A' ' 51' ' ' TYR . 7.2 ptmm? -62.97 -41.28 99.49 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.923 0.392 . . . . 0.0 111.764 -177.537 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.806 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 7.0 pt-20 -72.25 -30.06 64.51 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-O 121.104 0.478 . . . . 0.0 110.528 177.828 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' SER . . . . . 0.666 ' O ' ' HG2' ' A' ' 54' ' ' ARG . 15.7 t -68.58 -45.69 71.37 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.414 -179.151 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . 0.474 ' CD2' ' HA ' ' A' ' 48' ' ' LYS . 2.7 p90 -74.74 -32.93 62.25 Favored 'General case' 0 N--CA 1.448 -0.538 0 C-N-CA 119.772 -0.771 . . . . 0.0 110.48 -177.266 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . 0.481 ' SG ' ' HG2' ' A' ' 59' ' ' MET . 98.6 m -60.93 -44.27 97.47 Favored 'General case' 0 C--O 1.239 0.541 0 CA-C-O 120.879 0.371 . . . . 0.0 110.822 179.048 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 10.6 pt20 -70.52 -31.57 68.7 Favored 'General case' 0 N--CA 1.444 -0.742 0 C-N-CA 120.368 -0.533 . . . . 0.0 110.966 -179.274 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.666 ' HG2' ' O ' ' A' ' 50' ' ' SER . 34.0 mmt180 -57.41 -36.3 71.15 Favored 'General case' 0 C--N 1.351 0.64 0 CA-C-O 121.237 0.541 . . . . 0.0 110.496 176.616 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.425 HE21 ' HB2' ' A' ' 55' ' ' GLN . 2.9 mt-30 -83.61 -20.82 33.01 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.844 179.797 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 80.88 33.09 30.92 Favored Glycine 0 N--CA 1.446 -0.666 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.47 178.933 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 35.1 m -132.33 148.65 70.53 Favored Pre-proline 0 C--N 1.322 -0.594 0 O-C-N 122.481 -0.423 . . . . 0.0 110.46 -179.8 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . 0.462 ' HG2' ' OG ' ' A' ' 61' ' ' SER . 28.8 Cg_endo -65.18 149.29 88.99 Favored 'Trans proline' 0 N--CA 1.458 -0.582 0 C-N-CA 122.31 2.007 . . . . 0.0 111.705 178.136 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.481 ' HG2' ' SG ' ' A' ' 52' ' ' CYS . 66.8 mtp -71.55 -9.32 58.04 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.524 -176.312 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 33.2 p30 -87.75 -10.25 51.61 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-O 121.404 0.621 . . . . 0.0 111.029 -178.959 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.462 ' OG ' ' HG2' ' A' ' 58' ' ' PRO . 74.3 m -90.11 -24.66 21.04 Favored 'General case' 0 N--CA 1.434 -1.245 0 CA-C-N 115.936 -0.575 . . . . 0.0 112.1 -177.579 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.465 HD12 ' SG ' ' A' ' 52' ' ' CYS . 1.5 pp -123.53 167.41 13.94 Favored 'General case' 0 C--N 1.307 -1.276 0 N-CA-C 112.538 0.57 . . . . 0.0 112.538 -177.483 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.479 ' O ' ' HA ' ' A' ' 90' ' ' VAL . 74.2 mtm180 -119.18 119.27 33.65 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.095 -176.949 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -100.9 116.08 31.92 Favored 'General case' 0 C--N 1.31 -1.113 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.847 178.587 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.454 ' C ' HD23 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -144.29 164.2 31.45 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.342 0.591 . . . . 0.0 110.918 -179.925 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 87.7 t80 -145.92 134.09 21.63 Favored 'General case' 0 C--N 1.309 -1.187 0 N-CA-C 109.219 -0.66 . . . . 0.0 109.219 178.388 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 49.69 27.13 2.07 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 124.291 1.036 . . . . 0.0 112.563 -179.825 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 90.15 16.91 55.01 Favored Glycine 0 CA--C 1.521 0.411 0 C-N-CA 121.033 -0.603 . . . . 0.0 113.391 179.255 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 2.7 pt20 -127.97 133.92 49.24 Favored 'General case' 0 C--N 1.317 -0.842 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 -179.986 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -72.36 146.85 46.79 Favored 'General case' 0 C--N 1.309 -1.193 0 CA-C-O 121.588 0.709 . . . . 0.0 110.705 178.807 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 20.7 mm -93.81 117.28 37.02 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.482 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.3 -178.611 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -97.73 162.78 13.11 Favored 'General case' 0 N--CA 1.436 -1.141 0 N-CA-C 109.872 -0.418 . . . . 0.0 109.872 -179.761 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . 0.486 ' O ' ' HB3' ' A' ' 45' ' ' LYS . 7.4 p-10 -65.82 -22.46 66.56 Favored 'General case' 0 C--N 1.312 -1.039 0 CA-C-O 121.168 0.509 . . . . 0.0 111.7 -179.347 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 10.7 m-80 -96.03 2.86 53.65 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-O 121.382 0.61 . . . . 0.0 110.135 179.53 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . 0.586 ' O ' ' HB2' ' A' ' 44' ' ' LEU . 3.4 m170 -83.83 146.56 28.04 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 109.597 -0.519 . . . . 0.0 109.597 178.565 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.499 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 72.4 p -122.54 156.18 61.56 Favored Pre-proline 0 C--N 1.31 -1.147 0 O-C-N 122.307 -0.246 . . . . 0.0 111.062 178.555 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 25.0 Cg_exo -62.07 -37.45 64.01 Favored 'Trans proline' 0 C--N 1.351 0.676 0 C-N-CA 122.319 2.013 . . . . 0.0 110.999 179.243 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . 0.449 ' HG2' ' O ' ' A' ' 40' ' ' MET . 14.6 ptmt -67.26 -40.84 86.28 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.577 -179.165 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 47.4 mm-40 -75.33 -35.45 61.19 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 120.936 0.398 . . . . 0.0 111.355 -178.356 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.513 HD21 ' CG ' ' A' ' 75' ' ' HIS . 5.9 mt -79.27 -4.0 48.63 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-O 121.074 0.464 . . . . 0.0 110.688 179.762 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 74.04 47.85 17.51 Favored Glycine 0 N--CA 1.445 -0.759 0 C-N-CA 120.815 -0.707 . . . . 0.0 112.622 178.229 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 64.4 mtt -103.6 165.5 10.99 Favored 'General case' 0 C--N 1.313 -0.982 0 N-CA-C 109.516 -0.55 . . . . 0.0 109.516 178.204 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . 0.459 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 12.9 pt-20 -139.62 -172.88 3.47 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-O 120.842 0.354 . . . . 0.0 110.465 178.838 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -72.7 137.84 46.23 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-O 121.234 0.54 . . . . 0.0 111.152 -179.216 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 26.0 tt0 77.34 3.43 3.16 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.791 1.237 . . . . 0.0 111.052 179.495 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . 0.459 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 0.5 OUTLIER -60.62 162.45 6.5 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 121.366 0.603 . . . . 0.0 111.212 178.135 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 13.5 p -128.18 146.63 33.4 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.176 0 CA-C-O 121.207 0.527 . . . . 0.0 110.675 -177.677 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 3.8 mp -114.75 152.16 16.41 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.99 0 N-CA-C 108.844 -0.799 . . . . 0.0 108.844 178.536 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -104.9 138.77 40.63 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 109.931 -0.396 . . . . 0.0 109.931 -176.52 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . 0.514 ' HB ' ' HA2' ' A' ' 28' ' ' GLY . 85.5 t -128.91 134.72 63.75 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.834 0 CA-C-O 121.439 0.638 . . . . 0.0 111.302 179.312 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 75.1 m-85 -118.22 -179.73 3.86 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.93 -0.577 . . . . 0.0 109.578 179.08 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 8.5 tp60 -107.13 142.4 36.88 Favored 'General case' 0 C--N 1.313 -0.992 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 177.364 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' GLU . . . . . 0.449 ' OE2' ' HG2' ' A' ' 63' ' ' ARG . 11.1 pt-20 . . . . . 0 C--N 1.326 -0.414 0 CA-C-O 121.325 0.583 . . . . 0.0 111.117 176.497 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 23.8 ptt? . . . . . 0 N--CA 1.474 0.756 0 CA-C-O 120.572 0.225 . . . . 0.0 111.258 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 8.7 m -64.6 -16.03 62.05 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-O 121.602 0.715 . . . . 0.0 110.703 178.273 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 14.5 p-10 -89.75 38.6 0.92 Allowed 'General case' 0 C--N 1.318 -0.765 0 CA-C-O 121.856 0.836 . . . . 0.0 109.654 179.073 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 8.8 pt20 -90.49 14.53 12.82 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.226 -0.897 . . . . 0.0 111.358 -176.206 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -87.97 155.61 19.75 Favored 'General case' 0 C--N 1.3 -1.561 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.17 179.683 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -162.2 174.42 12.92 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-O 120.957 0.408 . . . . 0.0 110.196 -177.938 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.76 156.91 62.54 Favored Pre-proline 0 C--N 1.311 -1.101 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.158 177.56 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -66.0 108.3 1.28 Allowed 'Trans proline' 0 N--CA 1.463 -0.276 0 C-N-CA 122.341 2.027 . . . . 0.0 112.801 -177.862 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 64.2 m -137.45 36.88 2.48 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-O 121.276 0.56 . . . . 0.0 109.632 178.34 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 24.3 p -55.92 147.05 20.4 Favored 'General case' 0 C--O 1.241 0.643 0 CA-C-O 121.453 0.644 . . . . 0.0 112.051 -179.703 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -81.85 106.2 13.59 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.594 -179.31 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -84.65 -40.0 17.94 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-O 121.678 0.752 . . . . 0.0 109.791 178.116 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 2.6 pp -149.77 173.06 14.15 Favored 'General case' 0 N--CA 1.436 -1.165 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.339 -177.799 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -134.72 38.79 1.77 Allowed Glycine 0 N--CA 1.436 -1.325 0 N-CA-C 111.234 -0.746 . . . . 0.0 111.234 179.748 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -101.56 96.29 7.02 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-O 121.045 0.45 . . . . 0.0 109.864 -178.802 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.486 ' HZ3' ' HB2' ' A' ' 16' ' ' LYS . 0.1 OUTLIER -164.85 166.09 19.94 Favored 'General case' 0 C--N 1.312 -1.029 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 -179.046 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.542 ' HZ1' ' HB2' ' A' ' 17' ' ' LYS . 0.1 OUTLIER -93.49 156.09 16.96 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-O 121.057 0.456 . . . . 0.0 110.452 -179.69 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.59 ' HA ' ' CE2' ' A' ' 21' ' ' TYR . 4.7 pt-20 -87.22 176.6 7.49 Favored 'General case' 0 C--N 1.314 -0.935 0 CA-C-N 116.508 -0.315 . . . . 0.0 110.23 177.215 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -164.3 -92.95 0.09 OUTLIER Glycine 0 N--CA 1.433 -1.527 0 C-N-CA 119.715 -1.231 . . . . 0.0 112.77 -177.12 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -124.08 6.86 8.56 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-O 121.048 0.451 . . . . 0.0 110.649 -178.856 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.59 ' CE2' ' HA ' ' A' ' 18' ' ' GLU . 47.9 p90 -88.69 152.8 21.58 Favored 'General case' 0 N--CA 1.447 -0.624 0 CA-C-O 121.381 0.61 . . . . 0.0 111.682 -179.019 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 18.3 pt -113.42 171.52 3.83 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.2 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.356 -179.192 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.487 ' HG2' ' HG2' ' A' ' 37' ' ' LYS . 50.9 mtmt -111.1 146.31 37.03 Favored 'General case' 0 C--N 1.305 -1.335 0 N-CA-C 109.726 -0.472 . . . . 0.0 109.726 179.756 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.9 mp -139.4 159.44 42.15 Favored 'General case' 0 C--N 1.295 -1.774 0 CA-C-O 121.095 0.474 . . . . 0.0 110.381 173.233 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.446 ' HE2' ' HB3' ' A' ' 25' ' ' LYS . 5.0 tmmm? -129.9 142.67 50.62 Favored 'General case' 0 N--CA 1.437 -1.083 0 CA-C-O 121.325 0.583 . . . . 0.0 110.426 -179.349 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . 0.613 ' O ' ' HA ' ' A' ' 33' ' ' GLU . 0.9 OUTLIER -114.6 142.53 27.01 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.384 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.592 -179.163 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.406 HD12 ' HG2' ' A' ' 33' ' ' GLU . 47.4 mm -105.79 113.83 43.62 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.987 0 N-CA-C 107.243 -1.391 . . . . 0.0 107.243 174.691 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . 0.462 ' HA2' ' HB ' ' A' ' 90' ' ' VAL . . . -83.39 171.64 50.06 Favored Glycine 0 N--CA 1.425 -2.089 0 C-N-CA 119.998 -1.096 . . . . 0.0 111.804 -176.622 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.86 -23.61 65.28 Favored 'General case' 0 C--N 1.305 -1.363 0 CA-C-O 121.438 0.637 . . . . 0.0 111.03 178.108 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -103.34 15.32 29.42 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-O 121.578 0.704 . . . . 0.0 109.642 178.931 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 32.4 m 73.91 23.34 2.26 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-O 122.635 1.207 . . . . 0.0 108.192 -178.907 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.1 m -66.6 95.58 0.34 Allowed 'General case' 0 N--CA 1.428 -1.548 0 CA-C-N 113.285 -1.78 . . . . 0.0 111.106 -179.17 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.613 ' HA ' ' O ' ' A' ' 26' ' ' VAL . 38.6 mt-10 -83.71 106.89 15.78 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 121.533 0.682 . . . . 0.0 111.127 179.424 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.42 ' CG2' ' HG3' ' A' ' 54' ' ' ARG . 40.1 mm -103.62 140.42 21.83 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.431 0 CA-C-N 115.7 -0.682 . . . . 0.0 109.57 179.393 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 13.0 m170 -115.97 132.48 56.64 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 -179.625 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -147.24 159.33 43.77 Favored 'General case' 0 C--N 1.312 -1.031 0 CA-C-O 121.445 0.64 . . . . 0.0 112.003 -178.904 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.487 ' HG2' ' HG2' ' A' ' 23' ' ' LYS . 28.6 mtmt -120.92 119.11 31.65 Favored 'General case' 0 C--N 1.312 -1.053 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.363 -179.109 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 20.5 m -138.38 159.48 31.9 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-O 121.172 0.51 . . . . 0.0 110.947 -178.516 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.512 ' O ' HG22 ' A' ' 42' ' ' THR . 0.9 OUTLIER -74.85 154.56 38.2 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-O 121.058 0.456 . . . . 0.0 111.193 178.625 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -69.85 -37.31 76.11 Favored 'General case' 0 CA--C 1.507 -0.691 0 CA-C-O 121.22 0.533 . . . . 0.0 110.458 178.49 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 11.8 t -99.8 25.59 7.1 Favored 'General case' 0 N--CA 1.436 -1.169 0 CA-C-O 121.375 0.607 . . . . 0.0 112.424 -175.462 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' THR . . . . . 0.512 HG22 ' O ' ' A' ' 39' ' ' LYS . 6.1 t -108.17 168.26 9.43 Favored 'General case' 0 C--N 1.32 -0.713 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 176.995 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 14.8 m170 -78.26 140.35 38.87 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 121.734 0.778 . . . . 0.0 111.885 -179.125 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.638 ' HB2' ' O ' ' A' ' 75' ' ' HIS . 0.2 OUTLIER -64.98 -18.44 65.28 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.051 -0.977 . . . . 0.0 109.813 -179.911 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.709 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -51.25 -45.84 62.14 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.734 -179.212 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.441 ' HA ' ' CG ' ' A' ' 49' ' ' GLU . 21.4 ptmt -66.47 -31.82 72.81 Favored 'General case' 0 C--O 1.22 -0.498 0 CA-C-O 121.427 0.632 . . . . 0.0 110.933 -177.647 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.503 ' HB3' HD13 ' A' ' 44' ' ' LEU . 8.1 tt -67.97 -47.84 67.5 Favored 'General case' 0 C--N 1.308 -1.202 0 CA-C-O 121.6 0.714 . . . . 0.0 109.259 178.025 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.474 ' HA ' ' CE2' ' A' ' 51' ' ' TYR . 40.5 mtpt -60.63 -45.2 94.93 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.066 -0.97 . . . . 0.0 111.535 -178.763 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.709 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 3.7 pt-20 -71.03 -33.85 70.72 Favored 'General case' 0 C--N 1.312 -1.05 0 CA-C-O 120.958 0.408 . . . . 0.0 110.376 178.639 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' SER . . . . . 0.57 ' O ' ' HG2' ' A' ' 54' ' ' ARG . 21.9 t -64.19 -44.91 90.53 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-O 120.881 0.372 . . . . 0.0 111.257 -178.744 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.474 ' CE2' ' HA ' ' A' ' 48' ' ' LYS . 3.6 p90 -75.73 -32.39 60.0 Favored 'General case' 0 N--CA 1.443 -0.81 0 C-N-CA 119.639 -0.824 . . . . 0.0 110.659 -178.618 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . 0.602 ' SG ' ' HG2' ' A' ' 59' ' ' MET . 69.3 m -62.77 -43.55 98.5 Favored 'General case' 0 C--O 1.238 0.451 0 CA-C-O 120.868 0.366 . . . . 0.0 110.822 178.667 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 6.6 pt20 -66.49 -36.06 81.79 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 120.649 -0.421 . . . . 0.0 110.284 178.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.57 ' HG2' ' O ' ' A' ' 50' ' ' SER . 29.7 mmt180 -53.76 -45.77 70.73 Favored 'General case' 0 C--N 1.351 0.668 0 CA-C-O 121.233 0.54 . . . . 0.0 110.594 176.667 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.417 HE21 ' HB2' ' A' ' 55' ' ' GLN . 2.2 mt-30 -76.73 -23.43 53.05 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.881 -179.609 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 83.27 29.34 33.83 Favored Glycine 0 N--CA 1.445 -0.716 0 C-N-CA 120.565 -0.826 . . . . 0.0 112.086 178.464 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 26.6 m -128.49 153.45 79.3 Favored Pre-proline 0 C--N 1.327 -0.393 0 O-C-N 122.659 -0.318 . . . . 0.0 110.326 -178.725 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -69.01 149.14 71.31 Favored 'Trans proline' 0 C--O 1.239 0.571 0 C-N-CA 122.334 2.022 . . . . 0.0 112.188 178.226 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.602 ' HG2' ' SG ' ' A' ' 52' ' ' CYS . 75.3 mtp -71.46 -9.23 57.85 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.791 -0.64 . . . . 0.0 112.112 -176.06 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 21.0 p30 -89.72 -13.41 36.91 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-O 121.115 0.483 . . . . 0.0 111.529 -178.64 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.419 ' HB3' ' CG ' ' A' ' 94' ' ' GLN . 67.6 m -88.36 -16.1 33.88 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-O 121.164 0.507 . . . . 0.0 112.162 -179.204 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.523 HD13 ' SG ' ' A' ' 52' ' ' CYS . 1.5 pp -126.66 168.47 14.31 Favored 'General case' 0 C--N 1.309 -1.172 0 N-CA-C 112.817 0.673 . . . . 0.0 112.817 -178.457 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.553 ' O ' ' HA ' ' A' ' 90' ' ' VAL . 14.4 mtp180 -121.14 127.09 51.24 Favored 'General case' 0 CA--C 1.506 -0.73 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.658 -177.814 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -106.91 113.9 27.67 Favored 'General case' 0 C--N 1.305 -1.338 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.643 178.147 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.46 ' C ' HD23 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -141.23 162.12 36.24 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.361 0.6 . . . . 0.0 111.056 179.541 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 86.1 t80 -142.89 135.16 27.36 Favored 'General case' 0 C--N 1.311 -1.068 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 178.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 6.2 pt-20 48.96 29.32 2.32 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 124.23 1.012 . . . . 0.0 112.405 -179.729 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 81.77 27.65 45.63 Favored Glycine 0 N--CA 1.445 -0.709 0 C-N-CA 120.72 -0.752 . . . . 0.0 113.131 -179.273 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 3.5 pt20 -132.61 136.47 46.54 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 109.217 -0.661 . . . . 0.0 109.217 178.018 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.91 145.74 49.98 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-O 121.638 0.732 . . . . 0.0 110.672 178.292 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.458 HG12 ' HA ' ' A' ' 65' ' ' LEU . 16.8 mm -99.74 121.27 50.21 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.592 0 CA-C-O 121.161 0.505 . . . . 0.0 109.989 -179.632 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -95.86 164.58 12.68 Favored 'General case' 0 C--N 1.309 -1.153 0 N-CA-C 109.946 -0.391 . . . . 0.0 109.946 -179.382 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -65.49 -21.75 66.66 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-O 121.287 0.565 . . . . 0.0 110.584 179.411 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 6.5 m-80 -97.93 2.31 48.94 Favored 'General case' 0 CA--C 1.508 -0.653 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.162 -179.61 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . 0.638 ' O ' ' HB2' ' A' ' 44' ' ' LEU . 1.6 m170 -82.33 146.18 29.54 Favored 'General case' 0 CA--C 1.505 -0.786 0 C-N-CA 119.96 -0.696 . . . . 0.0 109.305 -179.832 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.479 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 82.1 p -120.7 155.53 56.97 Favored Pre-proline 0 C--N 1.308 -1.198 0 C-N-CA 120.961 -0.296 . . . . 0.0 111.27 179.514 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_exo -61.85 -38.71 57.23 Favored 'Trans proline' 0 C--N 1.348 0.516 0 C-N-CA 122.459 2.106 . . . . 0.0 111.161 179.335 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . 0.52 ' HG3' ' N ' ' A' ' 79' ' ' GLU . 47.0 pttt -67.22 -39.58 86.3 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.801 -178.835 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.52 ' N ' ' HG3' ' A' ' 78' ' ' LYS . 4.3 mm-40 -75.26 -33.57 61.3 Favored 'General case' 0 N--CA 1.44 -0.974 0 CA-C-O 120.947 0.404 . . . . 0.0 111.614 -177.31 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.479 ' HG ' ' O ' ' A' ' 76' ' ' THR . 6.5 mt -82.8 -1.32 51.43 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.214 0.53 . . . . 0.0 110.78 179.573 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 76.3 46.43 12.61 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 121.133 -0.556 . . . . 0.0 113.114 177.248 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 60.7 mtt -107.04 167.72 9.7 Favored 'General case' 0 C--N 1.313 -1.021 0 N-CA-C 109.627 -0.509 . . . . 0.0 109.627 178.569 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -148.42 -171.3 3.81 Favored 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 109.938 -0.393 . . . . 0.0 109.938 178.168 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -66.29 135.31 54.23 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.531 0.681 . . . . 0.0 111.659 -178.48 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 74.63 6.74 4.48 Favored 'General case' 0 C--N 1.324 -0.539 0 C-N-CA 124.816 1.246 . . . . 0.0 112.558 178.746 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -62.27 162.54 9.64 Favored 'General case' 0 C--O 1.238 0.491 0 CA-C-O 121.093 0.473 . . . . 0.0 110.081 175.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . 0.432 ' HA ' ' O ' ' A' ' 25' ' ' LYS . 7.3 p -127.56 142.19 44.3 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.264 0 CA-C-O 121.537 0.684 . . . . 0.0 111.925 -176.392 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 3.7 mp -114.4 153.62 15.89 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 179.699 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -104.67 135.53 45.9 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 121.046 0.451 . . . . 0.0 109.994 -176.401 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . 0.553 ' HA ' ' O ' ' A' ' 63' ' ' ARG . 96.7 t -128.57 134.74 64.03 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.904 0 CA-C-O 121.268 0.556 . . . . 0.0 110.825 179.039 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 80.7 m-85 -121.24 179.07 4.53 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-N 116.213 -0.449 . . . . 0.0 109.858 179.43 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 8.7 tp60 -108.22 128.23 54.53 Favored 'General case' 0 C--N 1.313 -1.005 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 179.54 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -117.84 21.42 12.9 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.316 0.579 . . . . 0.0 111.037 178.209 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . 0.419 ' CG ' ' HB3' ' A' ' 61' ' ' SER . 98.9 mt-30 -63.43 -159.42 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.515 175.375 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 8.8 t -144.37 138.35 27.74 Favored 'General case' 0 C--N 1.306 -1.287 0 O-C-N 121.195 -0.94 . . . . 0.0 110.871 -178.042 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -96.75 3.28 62.75 Favored Glycine 0 N--CA 1.44 -1.09 0 C-N-CA 120.701 -0.761 . . . . 0.0 111.349 178.558 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.436 -1.348 0 CA-C-O 118.943 -0.92 . . . . 0.0 111.222 -179.499 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 92.7 mmm . . . . . 0 N--CA 1.479 0.997 0 CA-C-O 121.42 0.628 . . . . 0.0 110.257 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 16.0 m -107.53 31.21 5.6 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.853 -176.867 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 13.2 m-20 72.23 33.82 1.48 Allowed 'General case' 0 N--CA 1.48 1.026 0 CA-C-O 121.652 0.739 . . . . 0.0 110.541 178.626 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -115.72 -19.09 10.65 Favored 'General case' 0 C--N 1.309 -1.166 0 CA-C-O 122.426 1.108 . . . . 0.0 108.372 -179.656 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -127.75 148.73 50.43 Favored 'General case' 0 N--CA 1.423 -1.802 0 CA-C-N 114.292 -1.322 . . . . 0.0 109.533 -175.71 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -165.89 179.66 5.76 Favored 'General case' 0 C--N 1.312 -1.044 0 CA-C-O 121.241 0.543 . . . . 0.0 111.21 -178.178 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.503 ' HZ2' ' HB3' ' A' ' 11' ' ' GLU . 0.0 OUTLIER -143.5 150.62 51.76 Favored Pre-proline 0 N--CA 1.442 -0.856 0 CA-C-N 115.636 -0.711 . . . . 0.0 109.696 178.277 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.466 ' HB2' HG23 ' A' ' 10' ' ' THR . 7.9 Cg_endo -49.83 132.22 31.21 Favored 'Trans proline' 0 CA--C 1.538 0.694 0 C-N-CA 123.29 2.66 . . . . 0.0 113.19 -178.649 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 50.1 m -60.74 -31.58 70.89 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.699 -178.859 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' THR . . . . . 0.466 HG23 ' HB2' ' A' ' 8' ' ' PRO . 12.8 t -53.01 -20.35 3.39 Favored 'General case' 0 CA--C 1.543 0.706 0 N-CA-C 112.059 0.392 . . . . 0.0 112.059 176.864 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . 0.503 ' HB3' ' HZ2' ' A' ' 7' ' ' LYS . 28.2 tt0 -81.08 131.0 35.28 Favored 'General case' 0 N--CA 1.448 -0.535 0 N-CA-C 108.415 -0.958 . . . . 0.0 108.415 175.854 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -50.94 -48.08 60.92 Favored 'General case' 0 N--CA 1.476 0.846 0 N-CA-C 116.039 1.866 . . . . 0.0 116.039 -170.613 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 71.2 mt -102.37 -173.53 2.36 Favored 'General case' 0 C--N 1.315 -0.915 0 O-C-N 121.221 -0.924 . . . . 0.0 111.365 -174.094 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 75.81 49.75 8.57 Favored Glycine 0 N--CA 1.441 -0.971 0 C-N-CA 120.606 -0.807 . . . . 0.0 111.424 -179.128 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 3.8 p-10 -85.23 149.96 25.13 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-O 121.124 0.487 . . . . 0.0 110.605 -179.06 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 3.4 mppt? -122.47 154.66 37.51 Favored 'General case' 0 C--N 1.316 -0.85 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 178.81 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -86.89 178.76 6.87 Favored 'General case' 0 C--N 1.312 -1.053 0 C-N-CA 120.428 -0.509 . . . . 0.0 111.602 179.415 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -108.79 166.41 10.83 Favored 'General case' 0 C--N 1.312 -1.056 0 CA-C-O 121.238 0.542 . . . . 0.0 112.094 -172.852 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 173.7 -47.63 0.15 Allowed Glycine 0 N--CA 1.448 -0.503 0 N-CA-C 111.072 -0.811 . . . . 0.0 111.072 -177.952 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -43.99 -29.46 0.59 Allowed 'General case' 0 N--CA 1.481 1.097 0 N-CA-C 113.632 0.975 . . . . 0.0 113.632 176.285 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.488 ' CE2' ' HD3' ' A' ' 37' ' ' LYS . 44.1 p90 -66.95 172.07 4.82 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-O 121.469 0.652 . . . . 0.0 111.255 179.851 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . 0.401 ' HB ' ' HA ' ' A' ' 84' ' ' GLU . 22.3 pt -124.42 172.18 12.3 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.814 0 CA-C-O 121.569 0.699 . . . . 0.0 110.25 177.833 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 14.2 mtmt -117.63 146.69 43.49 Favored 'General case' 0 C--N 1.298 -1.636 0 N-CA-C 109.058 -0.719 . . . . 0.0 109.058 -179.071 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.6 mp -141.35 161.48 37.79 Favored 'General case' 0 C--N 1.303 -1.434 0 CA-C-O 121.337 0.589 . . . . 0.0 111.473 174.957 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.414 ' HE2' ' HB3' ' A' ' 25' ' ' LYS . 5.5 tmmm? -133.34 142.88 48.65 Favored 'General case' 0 N--CA 1.436 -1.16 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.463 -178.993 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . 0.476 ' O ' ' HA ' ' A' ' 33' ' ' GLU . 0.9 OUTLIER -114.46 141.72 29.83 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.341 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.247 -179.701 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.44 ' O ' ' HB ' ' A' ' 90' ' ' VAL . 45.5 mm -105.11 117.74 51.31 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.971 0 N-CA-C 107.685 -1.228 . . . . 0.0 107.685 175.652 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -87.56 168.1 37.75 Favored Glycine 0 N--CA 1.421 -2.359 0 C-N-CA 120.372 -0.918 . . . . 0.0 111.845 -177.316 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.04 -22.59 66.96 Favored 'General case' 0 C--N 1.305 -1.348 0 CA-C-O 121.592 0.711 . . . . 0.0 110.704 178.832 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -97.99 12.18 35.07 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.663 -0.699 . . . . 0.0 109.555 179.672 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 15.1 m 71.54 16.56 5.86 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.337 -178.961 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 9.6 t -76.09 115.94 16.3 Favored 'General case' 0 N--CA 1.444 -0.737 0 CA-C-N 115.551 -0.749 . . . . 0.0 110.234 -179.731 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.476 ' HA ' ' O ' ' A' ' 26' ' ' VAL . 40.9 mt-10 -89.15 112.68 23.74 Favored 'General case' 0 CA--C 1.509 -0.598 0 CA-C-O 120.942 0.401 . . . . 0.0 110.415 178.678 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 30.6 mm -99.48 135.53 34.45 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.515 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 177.193 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 11.9 m170 -116.13 132.74 56.57 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 109.549 -0.537 . . . . 0.0 109.549 -178.52 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 1.4 p90 -147.22 166.77 26.0 Favored 'General case' 0 C--N 1.314 -0.972 0 CA-C-O 121.424 0.63 . . . . 0.0 111.6 -178.164 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.488 ' HD3' ' CE2' ' A' ' 21' ' ' TYR . 89.9 mttt -125.17 121.34 33.91 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.835 -178.79 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 28.1 m -139.15 156.97 28.08 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 CA-C-O 120.949 0.404 . . . . 0.0 110.165 179.455 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.529 ' O ' HG23 ' A' ' 42' ' ' THR . 80.4 tttt -84.21 167.25 16.85 Favored 'General case' 0 C--N 1.311 -1.072 0 O-C-N 121.98 -0.45 . . . . 0.0 110.654 179.832 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -73.39 -36.28 66.02 Favored 'General case' 0 N--CA 1.464 0.269 0 N-CA-C 112.907 0.706 . . . . 0.0 112.907 -176.931 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 11.3 t -96.18 15.72 20.16 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 112.02 0.378 . . . . 0.0 112.02 -177.182 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' THR . . . . . 0.529 HG23 ' O ' ' A' ' 39' ' ' LYS . 5.3 t -93.58 171.62 8.78 Favored 'General case' 0 C--N 1.319 -0.742 0 O-C-N 121.627 -0.67 . . . . 0.0 109.917 -179.604 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 51.6 m170 -88.39 141.23 28.71 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 121.381 0.61 . . . . 0.0 111.188 -179.535 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.623 ' HB2' ' O ' ' A' ' 75' ' ' HIS . 0.2 OUTLIER -69.49 -15.22 63.22 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.571 -0.74 . . . . 0.0 110.033 -179.815 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.777 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -54.75 -44.98 74.1 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-N 115.756 -0.656 . . . . 0.0 111.934 -179.225 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.458 ' N ' ' HD3' ' A' ' 45' ' ' LYS . 21.4 ptmt -69.49 -29.12 66.7 Favored 'General case' 0 C--O 1.218 -0.602 0 CA-C-O 121.286 0.565 . . . . 0.0 110.482 -178.233 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.462 ' HB3' HD12 ' A' ' 44' ' ' LEU . 8.0 tt -72.55 -49.83 29.89 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.498 -179.653 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.501 ' HG2' ' O ' ' A' ' 44' ' ' LEU . 8.3 ptmm? -61.76 -41.76 98.1 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.418 -178.306 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.777 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 8.2 pt-20 -72.16 -30.49 65.05 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-O 121.021 0.439 . . . . 0.0 110.716 177.841 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' SER . . . . . 0.562 ' O ' ' HG2' ' A' ' 53' ' ' GLN . 29.3 t -68.57 -43.7 76.01 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.431 -0.35 . . . . 0.0 111.5 -178.75 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.458 ' OH ' ' HB3' ' A' ' 64' ' ' PHE . 2.5 p90 -75.66 -32.46 60.19 Favored 'General case' 0 N--CA 1.446 -0.658 0 C-N-CA 119.531 -0.868 . . . . 0.0 110.206 -178.619 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . 0.491 ' SG ' HD12 ' A' ' 62' ' ' LEU . 98.9 m -65.14 -42.75 93.55 Favored 'General case' 0 CA--C 1.504 -0.807 0 CA-C-O 121.236 0.541 . . . . 0.0 110.601 179.765 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . 0.562 ' HG2' ' O ' ' A' ' 50' ' ' SER . 25.4 pt20 -67.37 -35.89 80.25 Favored 'General case' 0 N--CA 1.434 -1.271 0 CA-C-N 115.97 -0.559 . . . . 0.0 109.596 -179.728 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.411 ' HA ' ' NE ' ' A' ' 54' ' ' ARG . 1.0 OUTLIER -56.91 -39.35 74.28 Favored 'General case' 0 C--N 1.355 0.832 0 CA-C-O 121.315 0.578 . . . . 0.0 111.279 178.831 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.433 ' NE2' ' HA ' ' A' ' 52' ' ' CYS . 3.5 mt-30 -77.7 -20.91 52.81 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.888 179.964 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 80.86 33.63 29.57 Favored Glycine 0 N--CA 1.447 -0.615 0 C-N-CA 120.787 -0.721 . . . . 0.0 111.88 179.899 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 31.2 m -133.8 150.67 75.27 Favored Pre-proline 0 C--O 1.238 0.488 0 O-C-N 122.606 -0.349 . . . . 0.0 110.743 -178.685 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . 0.526 ' HG2' ' OG ' ' A' ' 61' ' ' SER . 29.9 Cg_endo -65.37 149.57 88.03 Favored 'Trans proline' 0 N--CA 1.455 -0.739 0 C-N-CA 122.558 2.172 . . . . 0.0 111.479 176.829 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.48 ' HG2' ' SG ' ' A' ' 52' ' ' CYS . 68.5 mtp -73.5 -8.38 55.69 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 121.246 0.546 . . . . 0.0 111.52 -176.686 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . 0.4 ' OD1' ' HB2' ' A' ' 58' ' ' PRO . 2.0 p-10 -90.82 -10.19 43.67 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-O 121.272 0.558 . . . . 0.0 111.046 -179.124 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.526 ' OG ' ' HG2' ' A' ' 58' ' ' PRO . 67.1 m -87.59 -19.22 28.12 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 121.08 0.467 . . . . 0.0 111.59 179.766 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.491 HD12 ' SG ' ' A' ' 52' ' ' CYS . 1.8 pp -127.66 170.31 12.83 Favored 'General case' 0 C--N 1.317 -0.829 0 N-CA-C 112.948 0.721 . . . . 0.0 112.948 -177.949 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.449 ' O ' ' HA ' ' A' ' 90' ' ' VAL . 44.2 mtm180 -120.18 119.4 33.14 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.606 -0.724 . . . . 0.0 110.824 -176.686 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.458 ' HB3' ' OH ' ' A' ' 51' ' ' TYR . 0.2 OUTLIER -102.33 116.11 31.96 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-O 121.085 0.469 . . . . 0.0 111.034 178.458 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.47 ' C ' HD23 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -143.3 162.52 35.45 Favored 'General case' 0 N--CA 1.444 -0.755 0 CA-C-O 121.395 0.616 . . . . 0.0 111.285 179.412 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . 0.409 ' CB ' HD12 ' A' ' 71' ' ' ILE . 90.2 t80 -143.64 134.48 25.29 Favored 'General case' 0 C--N 1.306 -1.287 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 179.432 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 6.4 pt-20 49.34 27.34 1.9 Allowed 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 124.006 0.923 . . . . 0.0 112.354 -179.071 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 87.19 19.94 54.02 Favored Glycine 0 N--CA 1.449 -0.463 0 C-N-CA 121.079 -0.582 . . . . 0.0 113.687 -179.541 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 3.3 pt20 -128.68 137.3 51.55 Favored 'General case' 0 C--N 1.319 -0.737 0 O-C-N 122.058 -0.672 . . . . 0.0 109.486 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -68.8 146.64 52.72 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-O 121.292 0.567 . . . . 0.0 110.225 178.241 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.409 HD12 ' CB ' ' A' ' 66' ' ' PHE . 24.5 mm -93.15 119.09 40.3 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.54 0 CA-C-O 120.931 0.396 . . . . 0.0 110.161 -179.613 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -96.96 163.54 12.91 Favored 'General case' 0 N--CA 1.437 -1.095 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 -179.505 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . 0.447 ' CA ' ' HB3' ' A' ' 45' ' ' LYS . 13.8 m-20 -65.02 -28.17 69.31 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-O 121.563 0.697 . . . . 0.0 110.769 -178.901 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 6.2 m-80 -95.36 4.13 53.7 Favored 'General case' 0 C--N 1.313 -0.981 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.994 -176.443 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . 0.623 ' O ' ' HB2' ' A' ' 44' ' ' LEU . 1.7 m170 -80.29 141.69 35.25 Favored 'General case' 0 CA--C 1.509 -0.629 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 179.974 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 69.7 p -116.57 154.11 49.1 Favored Pre-proline 0 C--N 1.308 -1.236 0 C-N-CA 120.829 -0.348 . . . . 0.0 111.286 178.942 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -58.64 -40.6 72.02 Favored 'Trans proline' 0 C--N 1.349 0.594 0 C-N-CA 122.624 2.216 . . . . 0.0 111.602 179.264 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . 0.48 ' HG3' ' N ' ' A' ' 79' ' ' GLU . 17.3 pttt -68.66 -35.52 77.36 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.05 0.452 . . . . 0.0 111.114 -178.146 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.48 ' N ' ' HG3' ' A' ' 78' ' ' LYS . 32.8 mm-40 -76.24 -32.74 59.04 Favored 'General case' 0 CA--C 1.508 -0.672 0 CA-C-O 120.854 0.359 . . . . 0.0 111.233 -179.29 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.473 HD23 ' CG ' ' A' ' 75' ' ' HIS . 5.5 mt -83.27 -2.76 56.43 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.417 0.627 . . . . 0.0 110.361 178.954 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 75.06 44.52 23.28 Favored Glycine 0 N--CA 1.449 -0.456 0 CA-C-N 115.852 -0.613 . . . . 0.0 112.552 177.696 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 63.0 mtt -101.65 162.02 13.21 Favored 'General case' 0 C--N 1.316 -0.874 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 178.745 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -139.85 -172.76 3.46 Favored 'General case' 0 C--N 1.309 -1.181 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 178.471 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.437 ' O ' ' HB2' ' A' ' 85' ' ' GLU . 10.0 pt-20 -73.34 136.23 44.41 Favored 'General case' 0 N--CA 1.443 -0.813 0 C-N-CA 119.843 -0.743 . . . . 0.0 110.836 179.443 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . 0.437 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 42.9 mt-10 76.04 5.06 3.8 Favored 'General case' 0 C--N 1.321 -0.644 0 C-N-CA 124.612 1.165 . . . . 0.0 111.557 -179.114 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 1.8 t0 -63.22 163.84 9.69 Favored 'General case' 0 C--O 1.238 0.488 0 CA-C-O 121.007 0.432 . . . . 0.0 110.309 176.435 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 9.1 p -126.92 143.14 41.37 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.267 0 CA-C-O 121.421 0.629 . . . . 0.0 111.713 -175.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 3.4 mp -113.2 152.19 14.96 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.746 0 N-CA-C 108.611 -0.885 . . . . 0.0 108.611 178.134 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -105.42 137.24 43.55 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-O 121.182 0.515 . . . . 0.0 110.754 -175.89 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . 0.449 ' HA ' ' O ' ' A' ' 63' ' ' ARG . 58.3 t -130.02 134.97 62.01 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.843 0 CA-C-O 121.398 0.618 . . . . 0.0 110.74 178.68 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 95.7 m-85 -123.33 -178.79 4.09 Favored 'General case' 0 C--N 1.307 -1.276 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 178.645 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 8.0 tp60 -104.65 152.75 22.09 Favored 'General case' 0 C--N 1.305 -1.344 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 179.332 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -141.7 20.78 2.17 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.424 0.63 . . . . 0.0 110.329 175.207 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 98.8 mt-30 -59.92 -164.56 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.79 0 CA-C-N 115.507 -0.77 . . . . 0.0 112.396 178.275 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 7.4 t -126.12 -32.25 2.76 Favored 'General case' 0 C--N 1.32 -0.697 0 O-C-N 121.711 -0.618 . . . . 0.0 111.151 -176.43 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -147.05 -168.79 14.08 Favored Glycine 0 N--CA 1.44 -1.09 0 C-N-CA 120.632 -0.794 . . . . 0.0 111.896 -179.794 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.438 -1.213 0 CA-C-O 118.875 -0.958 . . . . 0.0 111.442 -179.976 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.4 ptm . . . . . 0 N--CA 1.484 1.238 0 CA-C-O 120.877 0.37 . . . . 0.0 111.763 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 39.6 m -160.54 14.39 0.12 Allowed 'General case' 0 N--CA 1.479 1.015 0 CA-C-O 122.014 0.911 . . . . 0.0 109.413 -177.755 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -106.93 0.22 23.64 Favored 'General case' 0 C--N 1.31 -1.141 0 CA-C-N 114.921 -1.036 . . . . 0.0 109.915 -175.688 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -70.43 -16.75 62.98 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.267 -0.879 . . . . 0.0 110.45 178.91 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -114.53 147.05 39.98 Favored 'General case' 0 N--CA 1.438 -1.069 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.414 -179.634 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -141.4 128.28 20.55 Favored 'General case' 0 C--N 1.303 -1.444 0 N-CA-C 108.218 -1.03 . . . . 0.0 108.218 175.862 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 14.3 mmmm -123.99 154.01 67.78 Favored Pre-proline 0 C--N 1.303 -1.45 0 C-N-CA 120.752 -0.379 . . . . 0.0 110.503 -176.441 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -77.24 105.49 2.07 Favored 'Trans proline' 0 N--CA 1.446 -1.281 0 C-N-CA 122.057 1.838 . . . . 0.0 110.635 177.135 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 12.0 p -83.0 93.67 7.61 Favored 'General case' 0 N--CA 1.433 -1.278 0 CA-C-O 121.52 0.676 . . . . 0.0 110.835 -177.752 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 22.5 p -94.62 142.19 27.74 Favored 'General case' 0 N--CA 1.433 -1.297 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.376 179.642 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 24.5 tt0 -139.11 95.08 2.88 Favored 'General case' 0 C--N 1.31 -1.123 0 N-CA-C 108.594 -0.891 . . . . 0.0 108.594 178.7 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 33.2 m-20 -90.26 11.55 20.84 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.768 -173.563 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 50.4 mt -48.08 -54.55 12.79 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.94 177.208 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 80.44 -34.78 2.24 Favored Glycine 0 N--CA 1.453 -0.208 0 C-N-CA 121.178 -0.534 . . . . 0.0 112.694 178.63 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -76.51 103.9 6.75 Favored 'General case' 0 CA--C 1.502 -0.886 0 CA-C-O 121.223 0.535 . . . . 0.0 110.659 -179.674 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 66.9 mttm -149.43 144.16 26.17 Favored 'General case' 0 CA--C 1.499 -0.995 0 CA-C-N 115.626 -0.716 . . . . 0.0 110.939 -179.369 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 84.3 tttt -141.76 165.8 26.48 Favored 'General case' 0 N--CA 1.414 -2.258 0 N-CA-C 108.25 -1.019 . . . . 0.0 108.25 179.041 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 50.8 mt-10 -144.66 83.22 1.7 Allowed 'General case' 0 C--N 1.318 -0.793 0 CA-C-O 121.506 0.669 . . . . 0.0 110.675 -176.879 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -111.63 -83.68 1.36 Allowed Glycine 0 C--N 1.301 -1.412 0 C-N-CA 120.738 -0.744 . . . . 0.0 111.309 176.696 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -82.45 68.94 9.09 Favored 'General case' 0 C--N 1.312 -1.044 0 CA-C-O 121.405 0.622 . . . . 0.0 110.941 176.631 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 34.8 p90 -104.63 178.07 4.67 Favored 'General case' 0 C--N 1.308 -1.229 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.872 178.041 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 21.1 pt -123.99 172.23 11.76 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.93 0 CA-C-O 121.261 0.553 . . . . 0.0 110.391 -177.026 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -117.17 143.0 46.32 Favored 'General case' 0 C--N 1.303 -1.427 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 -179.68 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.4 mp -135.21 162.02 33.71 Favored 'General case' 0 C--N 1.309 -1.177 0 CA-C-O 121.202 0.525 . . . . 0.0 110.863 176.778 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.556 ' HG3' ' NE2' ' A' ' 35' ' ' HIS . 2.9 tmmt? -133.22 144.02 49.52 Favored 'General case' 0 N--CA 1.439 -1.002 0 CA-C-O 121.391 0.615 . . . . 0.0 111.186 -178.648 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . 0.527 HG12 ' CD1' ' A' ' 51' ' ' TYR . 1.0 OUTLIER -118.54 139.03 47.31 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.314 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.231 178.904 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.447 HD13 ' HZ1' ' A' ' 25' ' ' LYS . 40.1 mm -107.19 99.13 7.95 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.01 0 N-CA-C 108.525 -0.917 . . . . 0.0 108.525 175.039 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . 0.543 ' HA2' ' HB ' ' A' ' 90' ' ' VAL . . . -69.8 161.9 52.68 Favored Glycine 0 N--CA 1.42 -2.396 0 C-N-CA 120.27 -0.966 . . . . 0.0 112.943 178.382 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.407 ' HG2' ' NE2' ' A' ' 92' ' ' GLN . 0.0 OUTLIER -54.62 -28.55 47.54 Favored 'General case' 0 C--N 1.306 -1.293 0 C-N-CA 123.675 0.79 . . . . 0.0 112.01 176.914 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -88.49 14.88 8.82 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-O 121.249 0.547 . . . . 0.0 110.362 179.597 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 55.6 m 67.62 14.56 9.57 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-O 121.76 0.791 . . . . 0.0 110.353 -177.639 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 2.2 t -72.82 101.48 3.15 Favored 'General case' 0 N--CA 1.438 -1.07 0 CA-C-N 115.238 -0.892 . . . . 0.0 110.4 -179.664 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.426 ' HG2' ' CD1' ' A' ' 27' ' ' ILE . 23.9 mt-10 -79.7 103.61 9.72 Favored 'General case' 0 N--CA 1.444 -0.749 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 177.569 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 23.0 mm -97.33 130.97 45.21 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.587 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 -178.918 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . 0.556 ' NE2' ' HG3' ' A' ' 25' ' ' LYS . 12.1 m170 -115.95 123.77 48.87 Favored 'General case' 0 CA--C 1.505 -0.768 0 N-CA-C 109.646 -0.501 . . . . 0.0 109.646 -178.953 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 1.3 p90 -138.15 147.28 43.73 Favored 'General case' 0 C--N 1.301 -1.534 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.763 -177.156 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 96.2 mttt -109.7 117.92 35.17 Favored 'General case' 0 C--N 1.311 -1.068 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.022 -179.333 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 24.6 m -137.17 167.04 24.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.351 -178.433 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.413 ' HG2' ' N ' ' A' ' 40' ' ' MET . 81.7 tttt -90.76 160.03 16.01 Favored 'General case' 0 C--N 1.318 -0.8 0 O-C-N 121.782 -0.574 . . . . 0.0 110.695 -179.769 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' MET . . . . . 0.413 ' N ' ' HG2' ' A' ' 39' ' ' LYS . 0.0 OUTLIER -66.21 -37.85 86.56 Favored 'General case' 0 CA--C 1.517 -0.317 0 N-CA-C 112.594 0.591 . . . . 0.0 112.594 -177.466 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 11.0 t -98.84 17.87 18.44 Favored 'General case' 0 C--N 1.312 -1.032 0 CA-C-O 120.952 0.406 . . . . 0.0 111.741 -175.739 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 1.1 t -95.16 165.73 12.26 Favored 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 120.205 -0.598 . . . . 0.0 109.788 179.069 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 18.3 m170 -81.28 137.52 35.79 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-O 121.498 0.666 . . . . 0.0 112.029 -179.917 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.595 ' HB2' ' O ' ' A' ' 75' ' ' HIS . 0.4 OUTLIER -65.71 -14.39 61.19 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.034 -0.984 . . . . 0.0 110.968 179.784 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.75 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -51.01 -54.45 24.45 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.505 0.557 . . . . 0.0 112.505 -178.432 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.431 ' HD3' ' N ' ' A' ' 47' ' ' LEU . 0.1 OUTLIER -66.85 -25.27 66.34 Favored 'General case' 0 C--O 1.218 -0.573 0 CA-C-O 121.289 0.566 . . . . 0.0 111.491 -178.192 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.431 ' N ' ' HD3' ' A' ' 46' ' ' LYS . 8.2 tt -73.51 -51.34 17.4 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.708 178.93 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.5 ' HG2' ' O ' ' A' ' 44' ' ' LEU . 8.7 ptmm? -62.39 -40.27 95.95 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.904 0.383 . . . . 0.0 111.522 -177.566 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.75 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 11.5 pt-20 -72.57 -31.29 65.12 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-O 120.909 0.385 . . . . 0.0 110.632 177.838 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 38.1 t -65.86 -44.33 85.73 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-O 120.932 0.396 . . . . 0.0 111.226 -179.292 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.527 ' CD1' HG12 ' A' ' 26' ' ' VAL . 1.2 p90 -76.49 -33.17 58.66 Favored 'General case' 0 N--CA 1.443 -0.78 0 C-N-CA 119.676 -0.81 . . . . 0.0 110.266 -177.78 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 84.5 m -61.81 -44.75 96.24 Favored 'General case' 0 CA--C 1.512 -0.513 0 CA-C-O 121.174 0.512 . . . . 0.0 110.57 179.727 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 12.9 pt20 -69.63 -32.5 71.23 Favored 'General case' 0 N--CA 1.444 -0.727 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.552 -179.022 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.557 ' HA ' ' NE ' ' A' ' 54' ' ' ARG . 6.9 mmp_? -59.61 -29.41 67.97 Favored 'General case' 0 C--N 1.344 0.337 0 CA-C-O 121.13 0.491 . . . . 0.0 111.465 177.319 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.445 HE21 ' HB2' ' A' ' 55' ' ' GLN . 3.4 mt-30 -89.36 -21.09 23.27 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-O 121.04 0.448 . . . . 0.0 111.046 179.57 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 84.8 28.58 31.48 Favored Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 120.855 -0.688 . . . . 0.0 112.272 179.476 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 27.3 m -133.05 153.37 80.88 Favored Pre-proline 0 C--N 1.324 -0.542 0 O-C-N 122.375 -0.486 . . . . 0.0 110.948 -178.656 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . 0.408 ' HB2' ' OD1' ' A' ' 60' ' ' ASN . 59.1 Cg_endo -77.6 164.57 28.14 Favored 'Trans proline' 0 N--CA 1.457 -0.63 0 C-N-CA 122.631 2.221 . . . . 0.0 112.417 177.864 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 42.0 mtt -69.75 -8.67 49.99 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-N 116.184 -0.462 . . . . 0.0 112.111 -177.415 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . 0.408 ' OD1' ' HB2' ' A' ' 58' ' ' PRO . 1.4 p-10 -92.7 -11.74 33.26 Favored 'General case' 0 C--N 1.312 -1.037 0 CA-C-O 121.319 0.581 . . . . 0.0 111.023 -177.649 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 50.0 m -88.43 -22.67 23.6 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-O 121.275 0.56 . . . . 0.0 111.314 -179.114 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -135.27 165.09 26.23 Favored 'General case' 0 C--N 1.307 -1.257 0 CA-C-O 121.372 0.606 . . . . 0.0 112.401 -176.954 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.561 ' O ' ' HA ' ' A' ' 90' ' ' VAL . 9.8 mtp180 -116.27 118.88 33.99 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.256 -178.123 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.506 ' HB3' ' OH ' ' A' ' 51' ' ' TYR . 0.2 OUTLIER -96.72 112.36 24.14 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-O 121.064 0.459 . . . . 0.0 110.671 177.515 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.454 ' C ' HD21 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -143.12 164.7 29.44 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-O 121.614 0.721 . . . . 0.0 111.928 -179.258 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 91.8 t80 -145.41 135.14 23.46 Favored 'General case' 0 C--N 1.31 -1.116 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 179.056 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 49.19 27.81 1.95 Allowed 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 124.214 1.006 . . . . 0.0 112.292 -179.19 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 85.59 23.21 47.78 Favored Glycine 0 CA--C 1.523 0.591 0 C-N-CA 120.885 -0.674 . . . . 0.0 113.312 -178.817 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 3.0 pt20 -131.75 134.27 45.68 Favored 'General case' 0 C--N 1.321 -0.655 0 O-C-N 122.191 -0.594 . . . . 0.0 109.452 179.341 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . 0.408 ' CD ' ' H ' ' A' ' 70' ' ' ARG . 0.1 OUTLIER -73.58 145.03 45.78 Favored 'General case' 0 C--N 1.31 -1.131 0 CA-C-O 121.695 0.76 . . . . 0.0 110.497 178.113 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 23.0 mm -91.58 126.82 44.19 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.516 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.78 -176.671 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -102.15 165.49 11.12 Favored 'General case' 0 N--CA 1.44 -0.934 0 N-CA-C 109.891 -0.411 . . . . 0.0 109.891 179.906 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . 0.437 ' CG ' ' HZ2' ' A' ' 48' ' ' LYS . 3.7 m-20 -69.22 -21.66 63.93 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-O 121.288 0.566 . . . . 0.0 111.562 -178.951 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 12.0 m-80 -98.26 1.45 47.23 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-O 121.369 0.604 . . . . 0.0 109.863 -179.803 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . 0.595 ' O ' ' HB2' ' A' ' 44' ' ' LEU . 5.2 m170 -79.85 142.32 35.36 Favored 'General case' 0 CA--C 1.505 -0.765 0 CA-C-N 116.14 -0.482 . . . . 0.0 109.948 179.933 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.423 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 66.7 p -118.51 154.5 52.36 Favored Pre-proline 0 C--N 1.304 -1.391 0 CA-C-N 116.751 -0.204 . . . . 0.0 110.637 178.514 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 24.9 Cg_exo -62.33 -37.51 60.51 Favored 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 122.429 2.086 . . . . 0.0 110.917 179.457 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . 0.539 ' HG3' ' N ' ' A' ' 79' ' ' GLU . 41.3 pttt -65.56 -43.22 90.51 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.794 -179.501 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.539 ' N ' ' HG3' ' A' ' 78' ' ' LYS . 5.9 mm-40 -70.59 -40.32 73.33 Favored 'General case' 0 CA--C 1.509 -0.628 0 CA-C-O 120.902 0.382 . . . . 0.0 111.475 -177.919 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.435 HD23 ' CG ' ' A' ' 75' ' ' HIS . 5.2 mt -74.63 -10.47 59.57 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.328 0.585 . . . . 0.0 110.282 179.971 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 81.78 44.18 7.91 Favored Glycine 0 N--CA 1.45 -0.417 0 CA-C-N 115.887 -0.597 . . . . 0.0 113.246 176.698 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 57.2 mtt -100.99 166.31 10.88 Favored 'General case' 0 C--N 1.314 -0.94 0 N-CA-C 109.489 -0.559 . . . . 0.0 109.489 178.514 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . 0.424 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 12.8 pt-20 -135.31 -169.76 2.45 Favored 'General case' 0 C--N 1.311 -1.066 0 N-CA-C 109.662 -0.496 . . . . 0.0 109.662 177.162 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -73.64 143.29 46.35 Favored 'General case' 0 N--CA 1.445 -0.717 0 C-N-CA 120.306 -0.557 . . . . 0.0 110.156 179.183 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 70.25 8.91 6.84 Favored 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 123.437 0.695 . . . . 0.0 111.497 -179.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . 0.424 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 3.2 t0 -65.71 162.11 19.24 Favored 'General case' 0 C--O 1.24 0.562 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.155 175.893 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 11.6 p -127.54 142.81 42.59 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.443 0 CA-C-O 121.653 0.739 . . . . 0.0 111.48 -177.049 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 3.6 mp -112.63 149.82 15.02 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.213 0 N-CA-C 107.885 -1.154 . . . . 0.0 107.885 178.288 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 20.3 tp10 -106.84 141.38 38.17 Favored 'General case' 0 C--N 1.308 -1.205 0 CA-C-O 120.958 0.409 . . . . 0.0 110.39 -175.144 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . 0.561 ' HA ' ' O ' ' A' ' 63' ' ' ARG . 77.4 t -130.93 133.82 62.5 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.188 0 CA-C-O 120.986 0.422 . . . . 0.0 110.413 178.811 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 82.2 m-85 -117.86 173.29 6.84 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-O 120.753 0.311 . . . . 0.0 110.376 -178.566 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . 0.407 ' NE2' ' HG2' ' A' ' 29' ' ' GLN . 7.5 tp60 -103.41 133.39 48.55 Favored 'General case' 0 C--N 1.311 -1.074 0 CA-C-O 120.915 0.388 . . . . 0.0 110.966 -179.752 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -131.51 23.17 4.73 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 121.481 0.658 . . . . 0.0 110.201 176.137 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 99.4 mt-30 -61.44 -160.92 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.813 0 CA-C-N 115.339 -0.846 . . . . 0.0 112.167 176.641 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 9.9 t -158.31 163.6 37.21 Favored 'General case' 0 N--CA 1.439 -0.983 0 N-CA-C 109.743 -0.466 . . . . 0.0 109.743 -177.338 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -137.28 39.65 1.6 Allowed Glycine 0 N--CA 1.441 -1.007 0 C-N-CA 120.953 -0.642 . . . . 0.0 111.88 179.419 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.44 -1.073 0 CA-C-O 118.599 -1.112 . . . . 0.0 111.475 179.257 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 19.1 ttt . . . . . 0 N--CA 1.478 0.97 0 CA-C-O 121.127 0.489 . . . . 0.0 110.573 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 69.6 m -100.02 -35.42 9.71 Favored 'General case' 0 C--N 1.328 -0.364 0 O-C-N 121.675 -0.641 . . . . 0.0 111.216 -178.782 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 10.2 p-10 -86.95 29.86 0.79 Allowed 'General case' 0 C--N 1.319 -0.736 0 CA-C-O 121.135 0.493 . . . . 0.0 110.494 -178.753 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 9.9 pt20 -160.1 152.39 20.72 Favored 'General case' 0 N--CA 1.443 -0.823 0 CA-C-O 121.243 0.544 . . . . 0.0 110.818 -175.259 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -161.51 159.65 28.15 Favored 'General case' 0 C--N 1.309 -1.189 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 176.964 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -136.64 123.83 21.76 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-O 121.101 0.477 . . . . 0.0 110.245 -178.842 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -165.26 150.5 8.23 Favored Pre-proline 0 C--N 1.312 -1.059 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.316 -178.254 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -78.16 164.79 26.64 Favored 'Trans proline' 0 N--CA 1.452 -0.933 0 C-N-CA 122.365 2.043 . . . . 0.0 111.945 179.566 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 50.0 m 46.06 78.75 0.06 Allowed 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 123.326 0.65 . . . . 0.0 112.007 -177.343 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 15.0 t -91.54 -14.08 30.96 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-O 121.371 0.605 . . . . 0.0 110.595 179.796 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -86.06 172.25 10.76 Favored 'General case' 0 N--CA 1.446 -0.67 0 N-CA-C 109.638 -0.504 . . . . 0.0 109.638 177.714 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -119.52 125.61 49.28 Favored 'General case' 0 C--N 1.31 -1.137 0 O-C-N 122.132 -0.355 . . . . 0.0 110.152 -179.333 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 2.5 pp -141.52 158.89 43.27 Favored 'General case' 0 C--N 1.308 -1.231 0 CA-C-O 121.027 0.441 . . . . 0.0 110.889 179.172 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 139.51 56.06 0.04 OUTLIER Glycine 0 C--N 1.307 -1.06 0 C-N-CA 121.018 -0.611 . . . . 0.0 112.298 178.926 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -99.17 101.47 12.81 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 121.411 0.624 . . . . 0.0 111.525 179.728 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.442 ' N ' ' HD3' ' A' ' 16' ' ' LYS . 0.0 OUTLIER -105.93 146.68 29.7 Favored 'General case' 0 C--N 1.312 -1.047 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 177.728 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.42 ' N ' ' HD3' ' A' ' 17' ' ' LYS . 0.0 OUTLIER -66.0 169.38 6.88 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 120.822 -0.351 . . . . 0.0 110.462 179.937 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -97.02 -173.98 2.84 Favored 'General case' 0 C--N 1.314 -0.951 0 N-CA-C 109.614 -0.513 . . . . 0.0 109.614 -177.692 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 179.59 -98.98 0.12 Allowed Glycine 0 N--CA 1.437 -1.287 0 C-N-CA 119.416 -1.373 . . . . 0.0 112.75 -176.768 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.482 ' O ' ' HG3' ' A' ' 39' ' ' LYS . 65.5 mm-40 -95.29 14.33 22.69 Favored 'General case' 0 C--N 1.31 -1.13 0 CA-C-O 120.785 0.326 . . . . 0.0 111.242 -177.248 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.417 ' CE1' ' HB3' ' A' ' 37' ' ' LYS . 51.6 p90 -133.13 162.57 31.38 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 112.781 0.66 . . . . 0.0 112.781 -177.63 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 22.4 pt -107.95 173.96 1.68 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.221 -0.899 . . . . 0.0 110.607 -179.168 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.407 ' HE3' ' HB2' ' A' ' 23' ' ' LYS . 31.5 mtmt -117.83 139.0 51.71 Favored 'General case' 0 C--N 1.308 -1.203 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.328 -178.106 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.4 mp -134.94 163.74 29.17 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-O 121.163 0.506 . . . . 0.0 110.816 176.704 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.444 ' NZ ' HD13 ' A' ' 27' ' ' ILE . 2.3 tmmt? -132.94 144.88 50.44 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-O 121.164 0.507 . . . . 0.0 110.344 179.878 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . 0.439 ' O ' ' HA ' ' A' ' 33' ' ' GLU . 0.9 OUTLIER -114.83 142.3 28.16 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.286 0 CA-C-O 121.091 0.472 . . . . 0.0 111.351 179.121 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.444 HD13 ' NZ ' ' A' ' 25' ' ' LYS . 45.9 mm -104.89 112.69 39.55 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.213 0 N-CA-C 107.634 -1.247 . . . . 0.0 107.634 175.274 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -79.28 171.87 55.01 Favored Glycine 0 N--CA 1.424 -2.158 0 C-N-CA 120.447 -0.882 . . . . 0.0 112.565 -176.198 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.716 ' H ' ' NE2' ' A' ' 29' ' ' GLN . 0.0 OUTLIER -67.5 -23.01 65.42 Favored 'General case' 0 C--N 1.309 -1.183 0 CA-C-O 121.739 0.78 . . . . 0.0 109.573 179.082 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -97.83 12.42 34.01 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.315 -0.857 . . . . 0.0 109.362 177.465 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 49.5 m 70.24 15.81 7.42 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.809 -178.906 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 21.9 t -71.19 116.3 11.34 Favored 'General case' 0 N--CA 1.445 -0.677 0 CA-C-N 115.416 -0.811 . . . . 0.0 109.846 178.901 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.439 ' HA ' ' O ' ' A' ' 26' ' ' VAL . 32.4 mt-10 -89.4 108.69 19.78 Favored 'General case' 0 N--CA 1.445 -0.725 0 CA-C-O 121.226 0.536 . . . . 0.0 109.988 179.268 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 34.4 mm -97.79 138.79 21.59 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.371 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 179.4 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 13.3 m170 -116.95 129.6 56.15 Favored 'General case' 0 C--N 1.317 -0.829 0 N-CA-C 109.511 -0.551 . . . . 0.0 109.511 -178.387 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 1.9 p90 -147.02 158.02 43.8 Favored 'General case' 0 C--N 1.307 -1.25 0 CA-C-O 121.477 0.656 . . . . 0.0 110.603 -179.158 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.417 ' HB3' ' CE1' ' A' ' 21' ' ' TYR . 47.1 mtmt -126.17 116.31 21.14 Favored 'General case' 0 C--N 1.301 -1.502 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.652 -178.593 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 17.6 m -132.81 163.85 36.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.525 -176.74 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.482 ' HG3' ' O ' ' A' ' 20' ' ' GLU . 84.9 tttt -85.67 160.33 19.59 Favored 'General case' 0 C--N 1.316 -0.857 0 O-C-N 121.923 -0.486 . . . . 0.0 111.413 -178.279 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -70.39 -37.18 74.45 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.031 0.444 . . . . 0.0 112.154 -177.625 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 14.5 t -90.51 9.35 29.69 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.531 -177.79 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' THR . . . . . 0.465 HG23 ' O ' ' A' ' 39' ' ' LYS . 1.2 t -92.06 167.73 11.87 Favored 'General case' 0 C--N 1.322 -0.591 0 C-N-CA 120.03 -0.668 . . . . 0.0 110.298 -178.482 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . 0.452 ' HB3' ' HG2' ' A' ' 45' ' ' LYS . 31.9 m170 -87.93 141.65 28.41 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-O 121.51 0.671 . . . . 0.0 111.589 -179.26 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.512 ' HB2' ' O ' ' A' ' 75' ' ' HIS . 0.6 OUTLIER -65.68 -19.26 65.83 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.554 -0.748 . . . . 0.0 111.515 179.944 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.491 ' HA ' ' HD3' ' A' ' 48' ' ' LYS . 7.5 ptpt -50.82 -49.24 59.08 Favored 'General case' 0 N--CA 1.463 0.188 0 N-CA-C 112.018 0.377 . . . . 0.0 112.018 -179.167 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.6 -29.67 69.06 Favored 'General case' 0 C--O 1.207 -1.162 0 CA-C-O 120.893 0.378 . . . . 0.0 111.239 -178.847 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 8.3 tt -70.71 -47.83 57.76 Favored 'General case' 0 C--N 1.311 -1.106 0 CA-C-O 121.3 0.571 . . . . 0.0 109.608 178.29 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.491 ' HD3' ' HA ' ' A' ' 45' ' ' LYS . 30.9 mtpt -58.82 -45.9 88.88 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.204 -179.718 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.87 -30.56 65.54 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 121.282 0.563 . . . . 0.0 110.713 -179.383 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 5.6 m -68.67 -44.43 74.09 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-N 115.984 -0.553 . . . . 0.0 112.089 -179.754 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.446 ' CE2' ' HA ' ' A' ' 48' ' ' LYS . 3.0 p90 -74.59 -33.55 62.66 Favored 'General case' 0 C--N 1.324 -0.541 0 C-N-CA 119.551 -0.86 . . . . 0.0 110.178 -178.936 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . 0.563 ' SG ' HD13 ' A' ' 62' ' ' LEU . 84.2 m -59.22 -46.87 87.31 Favored 'General case' 0 C--O 1.238 0.454 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.09 178.658 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 7.1 pt20 -68.06 -32.68 73.19 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 120.526 -0.469 . . . . 0.0 110.95 -179.217 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.409 ' HA ' ' NE ' ' A' ' 54' ' ' ARG . 1.6 mmp_? -59.42 -34.58 72.66 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-O 121.062 0.458 . . . . 0.0 111.662 177.669 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 3.2 mt-30 -81.81 -20.4 39.18 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-O 121.372 0.606 . . . . 0.0 110.286 179.034 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 82.2 28.9 39.04 Favored Glycine 0 N--CA 1.443 -0.872 0 CA-C-N 115.823 -0.626 . . . . 0.0 112.02 -179.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 33.9 m -131.45 145.95 59.83 Favored Pre-proline 0 C--N 1.326 -0.443 0 O-C-N 122.548 -0.384 . . . . 0.0 110.74 -179.313 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . 0.435 ' HG2' ' OG ' ' A' ' 61' ' ' SER . 28.0 Cg_endo -65.05 150.49 87.88 Favored 'Trans proline' 0 C--O 1.24 0.599 0 C-N-CA 122.513 2.142 . . . . 0.0 112.228 178.505 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.518 ' HG2' ' SG ' ' A' ' 52' ' ' CYS . 77.8 mtp -66.16 -13.66 60.57 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.851 -177.849 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 30.7 p30 -84.39 -12.78 53.85 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 121.507 0.67 . . . . 0.0 110.929 -178.456 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.435 ' OG ' ' HG2' ' A' ' 58' ' ' PRO . 70.6 m -87.79 -20.42 26.15 Favored 'General case' 0 C--N 1.309 -1.176 0 N-CA-C 112.407 0.521 . . . . 0.0 112.407 -178.072 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.563 HD13 ' SG ' ' A' ' 52' ' ' CYS . 1.4 pp -127.05 171.98 10.9 Favored 'General case' 0 C--N 1.309 -1.187 0 N-CA-C 113.487 0.921 . . . . 0.0 113.487 -176.327 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.465 ' O ' ' HA ' ' A' ' 90' ' ' VAL . 46.6 mtm180 -122.88 122.45 38.66 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.25 -0.886 . . . . 0.0 110.55 -177.358 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -105.5 118.63 37.07 Favored 'General case' 0 C--N 1.313 -1.007 0 CA-C-O 121.173 0.511 . . . . 0.0 111.248 179.561 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.476 ' HA ' HG12 ' A' ' 71' ' ' ILE . 0.0 OUTLIER -146.26 164.58 31.87 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 121.41 0.624 . . . . 0.0 111.034 179.613 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 88.1 t80 -142.88 134.92 27.12 Favored 'General case' 0 C--N 1.31 -1.143 0 N-CA-C 108.978 -0.749 . . . . 0.0 108.978 179.455 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 49.95 26.94 2.19 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 123.96 0.904 . . . . 0.0 112.268 -178.968 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 85.1 21.5 55.02 Favored Glycine 0 CA--C 1.523 0.534 0 C-N-CA 120.99 -0.624 . . . . 0.0 113.57 -178.598 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 3.2 pt20 -128.23 134.91 49.07 Favored 'General case' 0 C--N 1.322 -0.622 0 O-C-N 122.245 -0.562 . . . . 0.0 109.548 179.69 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -64.52 145.01 56.78 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-O 121.677 0.751 . . . . 0.0 111.09 177.473 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.476 HG12 ' HA ' ' A' ' 65' ' ' LEU . 22.3 mm -97.15 118.11 42.99 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.29 0 CA-C-O 121.142 0.496 . . . . 0.0 110.117 179.634 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -89.67 162.55 15.54 Favored 'General case' 0 N--CA 1.437 -1.116 0 N-CA-C 109.457 -0.572 . . . . 0.0 109.457 -179.83 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . 0.418 ' HB3' ' HB3' ' A' ' 45' ' ' LYS . 67.4 m-20 -65.47 -25.43 67.49 Favored 'General case' 0 C--N 1.313 -0.993 0 CA-C-O 121.609 0.719 . . . . 0.0 110.318 179.093 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 7.4 m-80 -97.46 9.21 42.99 Favored 'General case' 0 C--N 1.312 -1.041 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.178 -179.254 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . 0.512 ' O ' ' HB2' ' A' ' 44' ' ' LEU . 2.2 m170 -84.54 141.2 30.9 Favored 'General case' 0 CA--C 1.504 -0.798 0 N-CA-C 109.398 -0.593 . . . . 0.0 109.398 179.234 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 70.7 p -118.65 154.64 52.65 Favored Pre-proline 0 C--N 1.306 -1.324 0 C-N-CA 121.099 -0.24 . . . . 0.0 110.435 -179.891 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_exo -59.99 -39.47 70.34 Favored 'Trans proline' 0 N--CA 1.457 -0.637 0 C-N-CA 122.37 2.047 . . . . 0.0 111.459 179.861 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . 0.504 ' HG3' ' N ' ' A' ' 79' ' ' GLU . 37.6 pttt -68.96 -38.53 79.45 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 120.974 0.416 . . . . 0.0 111.163 -178.463 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.504 ' N ' ' HG3' ' A' ' 78' ' ' LYS . 11.1 mm-40 -72.4 -34.07 67.61 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-O 120.994 0.426 . . . . 0.0 110.896 -178.266 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.439 HD22 ' CG ' ' A' ' 75' ' ' HIS . 5.8 mt -84.63 2.11 43.07 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.24 0.543 . . . . 0.0 111.021 179.624 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 73.84 41.2 42.5 Favored Glycine 0 C--O 1.237 0.335 0 C-N-CA 120.99 -0.624 . . . . 0.0 112.964 177.199 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 63.9 mtt -100.01 164.88 11.8 Favored 'General case' 0 C--N 1.313 -1.012 0 N-CA-C 109.233 -0.654 . . . . 0.0 109.233 178.857 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -144.23 -170.4 3.35 Favored 'General case' 0 C--N 1.31 -1.12 0 N-CA-C 110.096 -0.335 . . . . 0.0 110.096 178.606 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -64.44 141.53 58.74 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 120.707 0.289 . . . . 0.0 110.372 178.926 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 73.42 1.2 3.9 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 123.558 0.743 . . . . 0.0 112.211 176.814 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -61.89 160.87 11.35 Favored 'General case' 0 N--CA 1.476 0.871 0 CA-C-O 121.364 0.602 . . . . 0.0 111.521 -179.546 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . 0.409 ' HA ' ' O ' ' A' ' 25' ' ' LYS . 7.8 p -128.45 143.91 39.57 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.953 0 CA-C-O 121.429 0.633 . . . . 0.0 111.494 -177.09 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 3.7 mp -113.2 151.92 15.0 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.802 0 N-CA-C 109.245 -0.65 . . . . 0.0 109.245 179.144 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.418 ' O ' HD11 ' A' ' 65' ' ' LEU . 6.2 tp10 -104.69 137.06 43.07 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.947 0.403 . . . . 0.0 110.47 -176.531 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . 0.465 ' HA ' ' O ' ' A' ' 63' ' ' ARG . 95.2 t -128.54 132.45 67.9 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.852 0 CA-C-O 121.282 0.563 . . . . 0.0 111.482 179.088 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 77.1 m-85 -115.0 179.17 4.03 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 178.663 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 7.9 tp60 -106.65 144.61 33.06 Favored 'General case' 0 C--N 1.311 -1.096 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 178.614 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -131.88 17.44 4.68 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.103 0.478 . . . . 0.0 110.706 176.253 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . 0.418 HE21 ' HB3' ' A' ' 61' ' ' SER . 98.6 mt-30 -62.32 -167.92 0.02 OUTLIER 'General case' 0 C--O 1.238 0.494 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.805 177.179 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 14.8 t -170.14 -179.32 3.09 Favored 'General case' 0 N--CA 1.439 -0.986 0 O-C-N 121.406 -0.809 . . . . 0.0 110.184 -175.807 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -156.93 -36.7 0.02 OUTLIER Glycine 0 N--CA 1.441 -1.013 0 N-CA-C 110.831 -0.908 . . . . 0.0 110.831 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.431 -1.633 0 N-CA-C 110.68 -0.968 . . . . 0.0 110.68 179.303 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.6 ptm . . . . . 0 N--CA 1.484 1.232 0 CA-C-O 120.925 0.393 . . . . 0.0 111.388 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 22.7 t -72.61 -72.02 0.26 Allowed 'General case' 0 C--N 1.318 -0.796 0 O-C-N 122.254 -0.279 . . . . 0.0 111.586 -178.008 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -117.23 -25.68 7.01 Favored 'General case' 0 C--N 1.326 -0.422 0 O-C-N 121.769 -0.582 . . . . 0.0 112.275 -177.355 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . 0.507 ' C ' HE21 ' A' ' 4' ' ' GLN . 0.0 OUTLIER -96.07 177.41 5.75 Favored 'General case' 0 C--N 1.308 -1.233 0 CA-C-O 120.959 0.409 . . . . 0.0 111.979 -178.535 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -64.47 -176.48 0.24 Allowed 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 123.326 0.651 . . . . 0.0 112.288 -179.126 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -162.31 151.03 15.0 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.127 -178.283 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.441 ' HA ' ' HD3' ' A' ' 8' ' ' PRO . 75.5 mmtt -126.06 130.91 23.85 Favored Pre-proline 0 N--CA 1.445 -0.723 0 O-C-N 122.294 -0.254 . . . . 0.0 110.452 179.32 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.441 ' HD3' ' HA ' ' A' ' 7' ' ' LYS . 6.9 Cg_exo -71.11 -63.18 0.04 OUTLIER 'Trans proline' 0 N--CA 1.462 -0.328 0 C-N-CA 122.823 2.349 . . . . 0.0 111.514 178.334 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 40.1 m -139.5 -175.88 4.35 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 178.9 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 23.6 m -49.58 107.18 0.13 Allowed 'General case' 0 CA--C 1.529 0.172 0 CA-C-O 121.066 0.46 . . . . 0.0 110.884 177.419 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 12.8 tt0 -73.42 117.02 14.67 Favored 'General case' 0 N--CA 1.444 -0.738 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.107 -178.585 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -80.19 -72.78 0.39 Allowed 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 112.803 0.668 . . . . 0.0 112.803 -175.462 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.471 HD11 ' N ' ' A' ' 14' ' ' GLY . 4.0 pp -71.74 -29.0 64.04 Favored 'General case' 0 CA--C 1.51 -0.56 0 N-CA-C 112.537 0.569 . . . . 0.0 112.537 -177.023 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.471 ' N ' HD11 ' A' ' 13' ' ' LEU . . . -99.91 34.04 5.8 Favored Glycine 0 C--N 1.302 -1.359 0 C-N-CA 120.304 -0.95 . . . . 0.0 112.736 -179.561 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -78.42 140.16 38.69 Favored 'General case' 0 C--N 1.319 -0.749 0 O-C-N 122.309 -0.524 . . . . 0.0 111.538 -179.092 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 2.8 mptp? -120.72 172.61 7.75 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.083 0.468 . . . . 0.0 110.082 177.741 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 14.2 ptmm? -161.33 174.99 12.73 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-O 121.065 0.459 . . . . 0.0 110.178 177.821 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.536 ' HB2' ' CE1' ' A' ' 21' ' ' TYR . 0.1 OUTLIER -96.33 -172.26 2.49 Favored 'General case' 0 C--N 1.311 -1.078 0 N-CA-C 109.708 -0.478 . . . . 0.0 109.708 178.753 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 127.44 119.55 2.25 Favored Glycine 0 N--CA 1.446 -0.686 0 C-N-CA 120.619 -0.8 . . . . 0.0 112.466 179.417 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.442 ' O ' ' HG3' ' A' ' 39' ' ' LYS . 44.6 mt-10 68.28 48.17 0.92 Allowed 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 121.445 0.64 . . . . 0.0 110.708 178.27 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.536 ' CE1' ' HB2' ' A' ' 18' ' ' GLU . 30.9 p90 -126.03 161.33 27.81 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-O 121.534 0.683 . . . . 0.0 111.497 -178.332 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 18.5 pt -118.45 172.59 5.64 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.041 0 CA-C-N 115.419 -0.809 . . . . 0.0 110.427 -179.395 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 31.5 mtmt -116.98 142.37 47.03 Favored 'General case' 0 C--N 1.299 -1.618 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 -179.04 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.0 mp -136.79 164.71 27.63 Favored 'General case' 0 C--N 1.308 -1.198 0 CA-C-O 121.187 0.518 . . . . 0.0 110.713 175.218 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.408 ' HE2' ' HB3' ' A' ' 25' ' ' LYS . 5.3 tmmm? -136.79 143.18 43.05 Favored 'General case' 0 C--N 1.313 -1.003 0 CA-C-O 121.254 0.55 . . . . 0.0 110.544 -178.982 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . 0.495 ' O ' ' HA ' ' A' ' 33' ' ' GLU . 1.0 OUTLIER -114.62 142.16 28.42 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.251 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.651 -179.647 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.43 HD12 ' HG2' ' A' ' 33' ' ' GLU . 32.9 mm -111.05 97.59 5.94 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.007 0 N-CA-C 108.117 -1.068 . . . . 0.0 108.117 175.752 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . 0.552 ' HA2' ' HB ' ' A' ' 90' ' ' VAL . . . -65.86 167.74 33.76 Favored Glycine 0 N--CA 1.437 -1.286 0 C-N-CA 120.506 -0.854 . . . . 0.0 113.127 178.924 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.22 -18.8 28.8 Favored 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 112.586 0.587 . . . . 0.0 112.586 177.753 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -102.76 13.49 34.28 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-O 121.519 0.676 . . . . 0.0 109.932 179.861 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 49.7 m 73.68 21.38 2.81 Favored 'General case' 0 CA--C 1.509 -0.617 0 CA-C-O 122.629 1.204 . . . . 0.0 108.39 -178.508 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -67.68 96.14 0.53 Allowed 'General case' 0 N--CA 1.424 -1.745 0 CA-C-N 113.362 -1.744 . . . . 0.0 111.474 -178.641 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.495 ' HA ' ' O ' ' A' ' 26' ' ' VAL . 15.0 mt-10 -78.74 104.32 9.28 Favored 'General case' 0 CA--C 1.496 -1.107 0 CA-C-O 121.138 0.494 . . . . 0.0 110.69 177.447 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.445 HG22 ' HA ' ' A' ' 51' ' ' TYR . 33.1 mm -97.67 132.58 42.14 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.319 0 N-CA-C 108.159 -1.052 . . . . 0.0 108.159 175.457 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 12.4 m170 -116.92 121.95 42.91 Favored 'General case' 0 C--N 1.317 -0.823 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 -176.958 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 1.5 p90 -137.93 162.26 34.5 Favored 'General case' 0 C--N 1.308 -1.225 0 CA-C-O 121.379 0.609 . . . . 0.0 111.292 -177.38 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 15.5 mtpt -124.38 115.84 21.61 Favored 'General case' 0 C--N 1.313 -0.979 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.646 -178.793 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 32.8 m -134.03 166.48 28.75 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.435 0 CA-C-O 121.073 0.463 . . . . 0.0 110.735 -178.296 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.523 ' O ' HG23 ' A' ' 42' ' ' THR . 84.2 tttt -89.65 167.85 12.59 Favored 'General case' 0 C--N 1.313 -1.021 0 O-C-N 122.035 -0.416 . . . . 0.0 110.538 -178.541 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -79.11 -37.12 39.48 Favored 'General case' 0 N--CA 1.464 0.26 0 N-CA-C 112.626 0.602 . . . . 0.0 112.626 -178.131 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 13.5 t -93.84 19.86 8.36 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-O 121.079 0.466 . . . . 0.0 111.688 -176.682 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' THR . . . . . 0.523 HG23 ' O ' ' A' ' 39' ' ' LYS . 6.7 t -99.76 173.28 6.77 Favored 'General case' 0 C--N 1.32 -0.708 0 O-C-N 122.006 -0.434 . . . . 0.0 109.961 179.844 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 29.8 m170 -88.04 142.31 27.88 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-O 121.491 0.662 . . . . 0.0 111.354 179.116 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.599 ' O ' ' HG3' ' A' ' 48' ' ' LYS . 0.2 OUTLIER -69.92 -18.34 63.37 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.54 -0.755 . . . . 0.0 109.725 -179.19 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.665 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -53.89 -44.71 70.71 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-N 115.849 -0.614 . . . . 0.0 112.305 -177.932 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.483 ' N ' ' HD3' ' A' ' 45' ' ' LYS . 21.8 ptmt -67.41 -28.17 67.69 Favored 'General case' 0 CA--C 1.517 -0.29 0 CA-C-O 121.449 0.643 . . . . 0.0 110.538 -178.156 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.466 ' HB3' HD12 ' A' ' 44' ' ' LEU . 7.9 tt -72.08 -47.44 51.39 Favored 'General case' 0 C--N 1.313 -1.01 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.886 179.083 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.599 ' HG3' ' O ' ' A' ' 44' ' ' LEU . 29.5 mtpt -58.69 -48.3 81.59 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.419 -179.233 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.665 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 5.6 pt-20 -68.83 -31.9 71.21 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.709 -179.281 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 28.8 t -67.44 -46.11 74.07 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-O 121.028 0.442 . . . . 0.0 111.234 -178.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.451 ' CD1' HG11 ' A' ' 26' ' ' VAL . 2.0 p90 -75.83 -32.78 59.95 Favored 'General case' 0 N--CA 1.445 -0.683 0 C-N-CA 119.801 -0.76 . . . . 0.0 110.544 -177.217 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . 0.539 ' SG ' ' HG2' ' A' ' 59' ' ' MET . 86.8 m -62.58 -44.41 96.38 Favored 'General case' 0 C--O 1.238 0.489 0 CA-C-O 120.85 0.357 . . . . 0.0 110.792 179.163 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 11.8 pt20 -67.96 -32.97 73.77 Favored 'General case' 0 N--CA 1.447 -0.585 0 C-N-CA 120.668 -0.413 . . . . 0.0 110.527 -179.828 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 15.9 mmt180 -57.78 -45.07 86.49 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-O 121.292 0.568 . . . . 0.0 111.115 177.433 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.443 ' NE2' ' HA ' ' A' ' 52' ' ' CYS . 3.2 mt-30 -71.36 -20.62 62.14 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.629 179.441 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 79.98 30.51 42.52 Favored Glycine 0 N--CA 1.441 -1.03 0 C-N-CA 120.861 -0.685 . . . . 0.0 111.558 -179.774 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 25.9 m -129.21 152.79 80.01 Favored Pre-proline 0 C--N 1.323 -0.555 0 O-C-N 122.502 -0.411 . . . . 0.0 110.723 -178.592 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . 0.413 ' HG2' ' OG ' ' A' ' 61' ' ' SER . 43.2 Cg_endo -71.45 150.61 58.27 Favored 'Trans proline' 0 N--CA 1.455 -0.772 0 C-N-CA 122.347 2.031 . . . . 0.0 111.903 177.538 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.539 ' HG2' ' SG ' ' A' ' 52' ' ' CYS . 79.8 mtp -70.37 -9.93 57.63 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.451 -177.443 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 33.6 p30 -84.52 -16.4 42.46 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.241 0.543 . . . . 0.0 111.365 -179.244 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.413 ' OG ' ' HG2' ' A' ' 58' ' ' PRO . 69.2 m -89.72 -20.63 23.36 Favored 'General case' 0 C--N 1.311 -1.101 0 N-CA-C 112.877 0.695 . . . . 0.0 112.877 -175.367 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.456 HD13 ' SG ' ' A' ' 52' ' ' CYS . 1.4 pp -124.09 170.95 10.17 Favored 'General case' 0 C--N 1.306 -1.309 0 N-CA-C 112.945 0.72 . . . . 0.0 112.945 -177.446 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.477 ' O ' ' HA ' ' A' ' 90' ' ' VAL . 47.2 mtm180 -121.66 120.76 35.67 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.674 -0.693 . . . . 0.0 110.844 -177.099 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -102.64 115.33 30.36 Favored 'General case' 0 C--N 1.311 -1.105 0 CA-C-O 121.084 0.469 . . . . 0.0 111.024 179.166 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.478 ' C ' HD23 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -144.38 164.15 31.67 Favored 'General case' 0 N--CA 1.445 -0.688 0 CA-C-O 121.469 0.652 . . . . 0.0 111.238 -179.769 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 83.2 t80 -143.62 134.15 24.88 Favored 'General case' 0 C--N 1.309 -1.192 0 N-CA-C 109.565 -0.532 . . . . 0.0 109.565 179.192 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 49.91 26.86 2.13 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 124.214 1.006 . . . . 0.0 112.75 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 87.45 20.89 50.44 Favored Glycine 0 N--CA 1.447 -0.613 0 C-N-CA 120.949 -0.643 . . . . 0.0 113.211 -179.596 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -128.55 134.34 48.62 Favored 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 108.766 -0.827 . . . . 0.0 108.766 179.181 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . 0.434 ' HE ' ' HB2' ' A' ' 70' ' ' ARG . 0.0 OUTLIER -72.44 144.95 47.94 Favored 'General case' 0 C--N 1.309 -1.157 0 O-C-N 121.66 -0.65 . . . . 0.0 110.706 179.349 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 22.3 mm -91.44 121.61 42.06 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.243 0 CA-C-O 121.321 0.582 . . . . 0.0 110.791 -178.276 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.415 ' O ' ' HB2' ' A' ' 75' ' ' HIS . . . -94.47 162.2 13.91 Favored 'General case' 0 N--CA 1.435 -1.18 0 N-CA-C 109.384 -0.598 . . . . 0.0 109.384 179.185 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 46.4 m-20 -69.42 -26.28 64.54 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-O 121.435 0.636 . . . . 0.0 110.558 -178.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 5.5 m-80 -93.19 4.72 53.52 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-O 121.311 0.577 . . . . 0.0 109.655 -178.763 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . 0.589 ' O ' ' HB2' ' A' ' 44' ' ' LEU . 8.4 m170 -83.13 146.22 28.78 Favored 'General case' 0 CA--C 1.496 -1.099 0 CA-C-N 116.222 -0.444 . . . . 0.0 109.906 -179.349 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 57.3 p -120.86 154.42 57.58 Favored Pre-proline 0 C--N 1.304 -1.412 0 C-N-CA 120.815 -0.354 . . . . 0.0 111.209 178.894 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -58.93 -39.72 78.38 Favored 'Trans proline' 0 C--N 1.348 0.508 0 C-N-CA 122.673 2.249 . . . . 0.0 111.758 179.334 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . 0.489 ' HG3' ' N ' ' A' ' 79' ' ' GLU . 29.0 pttt -68.92 -36.37 77.92 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.208 0.528 . . . . 0.0 110.792 -178.301 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.489 ' N ' ' HG3' ' A' ' 78' ' ' LYS . 33.5 mm-40 -72.38 -41.16 66.64 Favored 'General case' 0 N--CA 1.444 -0.74 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.903 -179.124 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 5.5 mt -78.35 -3.51 43.43 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.084 0.468 . . . . 0.0 111.402 -179.011 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 78.14 45.0 10.63 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 121.001 -0.619 . . . . 0.0 112.858 177.153 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 61.0 mtt -105.05 164.98 11.4 Favored 'General case' 0 C--N 1.313 -1.019 0 N-CA-C 110.008 -0.367 . . . . 0.0 110.008 179.162 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -145.21 -169.64 3.25 Favored 'General case' 0 C--N 1.314 -0.97 0 N-CA-C 109.915 -0.402 . . . . 0.0 109.915 177.54 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -70.54 139.67 51.6 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 121.117 0.484 . . . . 0.0 110.98 -179.63 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 75.43 2.46 3.84 Favored 'General case' 0 C--O 1.239 0.531 0 C-N-CA 124.487 1.115 . . . . 0.0 111.266 179.969 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 7.9 t0 -62.34 157.54 19.57 Favored 'General case' 0 C--O 1.239 0.51 0 CA-C-O 121.37 0.605 . . . . 0.0 110.639 177.9 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 7.7 p -125.45 142.94 40.7 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.231 0 CA-C-O 121.457 0.646 . . . . 0.0 111.533 -176.485 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 3.6 mp -113.15 152.05 14.93 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.924 0 N-CA-C 108.809 -0.811 . . . . 0.0 108.809 178.704 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 13.8 tp10 -106.61 139.3 41.28 Favored 'General case' 0 C--N 1.314 -0.962 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 -176.4 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . 0.552 ' HB ' ' HA2' ' A' ' 28' ' ' GLY . 88.0 t -130.61 136.08 59.07 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.084 0 CA-C-O 121.358 0.599 . . . . 0.0 110.747 178.694 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 88.2 m-85 -120.39 -178.9 3.8 Favored 'General case' 0 C--N 1.311 -1.099 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 178.813 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 7.5 tp60 -105.76 148.96 26.89 Favored 'General case' 0 C--N 1.307 -1.247 0 N-CA-C 109.512 -0.551 . . . . 0.0 109.512 178.559 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -137.37 17.91 2.94 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-O 121.053 0.454 . . . . 0.0 111.076 175.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 98.6 mt-30 -60.57 -164.01 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.732 0 CA-C-O 121.747 0.784 . . . . 0.0 112.588 178.647 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 10.4 t -158.41 165.53 34.46 Favored 'General case' 0 N--CA 1.444 -0.763 0 O-C-N 121.766 -0.584 . . . . 0.0 109.847 -175.444 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -113.27 111.11 2.63 Favored Glycine 0 N--CA 1.441 -0.972 0 C-N-CA 120.682 -0.77 . . . . 0.0 111.852 179.235 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.442 -0.943 0 CA-C-O 119.044 -0.864 . . . . 0.0 111.591 179.977 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 28.4 ttt . . . . . 0 N--CA 1.474 0.735 0 CA-C-O 121.323 0.582 . . . . 0.0 110.984 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 45.8 m -123.97 -59.68 1.49 Allowed 'General case' 0 C--N 1.315 -0.917 0 CA-C-O 121.188 0.518 . . . . 0.0 110.022 177.068 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -109.87 -40.95 4.63 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 121.865 0.84 . . . . 0.0 109.356 177.401 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 9.0 pt20 -66.22 136.85 56.45 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-N 114.743 -1.117 . . . . 0.0 112.684 -176.592 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -121.36 160.42 24.07 Favored 'General case' 0 C--N 1.313 -1.001 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 174.695 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -138.9 125.61 20.8 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-O 121.25 0.548 . . . . 0.0 110.989 -179.022 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.422 ' HD3' ' O ' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -158.6 134.55 6.15 Favored Pre-proline 0 C--N 1.314 -0.958 0 CA-C-N 115.791 -0.641 . . . . 0.0 110.624 -179.056 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_exo -56.17 119.94 7.46 Favored 'Trans proline' 0 C--O 1.235 0.365 0 C-N-CA 122.892 2.395 . . . . 0.0 112.774 179.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 48.2 m -163.03 151.91 14.64 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.226 178.935 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 40.5 m 62.9 88.56 0.09 Allowed 'General case' 0 CA--C 1.536 0.42 0 CA-C-O 121.652 0.739 . . . . 0.0 111.824 179.112 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -110.12 115.27 29.44 Favored 'General case' 0 C--N 1.308 -1.198 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 178.427 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -119.95 105.11 10.75 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-O 120.986 0.422 . . . . 0.0 110.552 -178.893 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.421 ' O ' HD12 ' A' ' 13' ' ' LEU . 4.0 pp -151.5 150.74 30.73 Favored 'General case' 0 N--CA 1.437 -1.107 0 CA-C-O 121.296 0.569 . . . . 0.0 110.78 176.757 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 116.83 13.04 8.11 Favored Glycine 0 C--N 1.302 -1.312 0 CA-C-N 115.478 -0.783 . . . . 0.0 111.871 178.402 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 37.6 t70 -76.52 130.56 38.1 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-O 121.158 0.504 . . . . 0.0 109.962 179.344 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 12.5 ptpt -155.16 -164.74 1.85 Allowed 'General case' 0 C--N 1.307 -1.269 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.335 -176.311 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 7.9 ptpt -53.9 159.52 1.7 Allowed 'General case' 0 C--O 1.236 0.382 0 CA-C-O 122.206 1.003 . . . . 0.0 112.642 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.484 ' HB2' ' CE1' ' A' ' 21' ' ' TYR . 7.3 pt-20 -77.54 95.32 4.49 Favored 'General case' 0 C--N 1.305 -1.364 0 CA-C-N 114.66 -1.154 . . . . 0.0 112.947 -178.878 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -144.06 132.55 4.91 Favored Glycine 0 C--N 1.309 -0.946 0 N-CA-C 111.531 -0.628 . . . . 0.0 111.531 174.351 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 63.04 38.08 11.18 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-O 121.803 0.811 . . . . 0.0 110.063 -179.302 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.484 ' CE1' ' HB2' ' A' ' 18' ' ' GLU . 39.5 p90 -106.62 177.05 4.97 Favored 'General case' 0 C--N 1.311 -1.084 0 CA-C-N 115.256 -0.884 . . . . 0.0 110.028 -178.66 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . 0.414 ' HB ' ' HA ' ' A' ' 84' ' ' GLU . 18.6 pt -126.34 171.75 14.53 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.279 0 CA-C-O 121.305 0.574 . . . . 0.0 109.775 178.334 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 9.1 mtmt -118.27 140.57 49.61 Favored 'General case' 0 C--N 1.298 -1.667 0 N-CA-C 109.152 -0.684 . . . . 0.0 109.152 -178.387 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.5 mp -137.04 162.28 33.75 Favored 'General case' 0 C--N 1.305 -1.36 0 CA-C-O 121.354 0.597 . . . . 0.0 110.827 176.375 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.454 ' HG3' ' CD2' ' A' ' 35' ' ' HIS . 3.7 tmmt? -134.68 143.73 47.39 Favored 'General case' 0 C--N 1.308 -1.235 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.396 179.974 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . 0.591 HG12 ' CD1' ' A' ' 51' ' ' TYR . 0.9 OUTLIER -114.29 141.13 31.71 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.538 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.3 178.576 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.411 HD11 ' HZ1' ' A' ' 25' ' ' LYS . 32.0 mm -111.43 99.22 8.24 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.025 0 N-CA-C 108.403 -0.962 . . . . 0.0 108.403 175.414 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . 0.522 ' HA2' ' HB ' ' A' ' 90' ' ' VAL . . . -66.0 164.24 40.11 Favored Glycine 0 N--CA 1.424 -2.162 0 C-N-CA 120.63 -0.795 . . . . 0.0 113.625 179.124 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.06 -23.72 66.65 Favored 'General case' 0 C--N 1.308 -1.207 0 C-N-CA 123.785 0.834 . . . . 0.0 110.528 177.902 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -91.78 11.55 24.31 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.279 -0.873 . . . . 0.0 109.518 179.197 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 48.0 m 70.17 14.98 7.63 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-O 121.785 0.802 . . . . 0.0 110.319 -179.254 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 8.4 t -73.34 103.86 4.16 Favored 'General case' 0 N--CA 1.443 -0.801 0 CA-C-N 115.082 -0.963 . . . . 0.0 110.469 179.397 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.459 ' HA ' ' O ' ' A' ' 26' ' ' VAL . 1.3 mp0 -85.11 107.47 17.21 Favored 'General case' 0 CA--C 1.511 -0.543 0 CA-C-O 121.246 0.546 . . . . 0.0 109.981 178.834 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 29.8 mm -100.42 138.75 23.71 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.283 0 N-CA-C 109.72 -0.474 . . . . 0.0 109.72 -179.194 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . 0.454 ' CD2' ' HG3' ' A' ' 25' ' ' LYS . 11.6 m170 -118.38 131.38 56.3 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 -179.305 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 1.1 p90 -146.91 151.08 36.46 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-O 121.207 0.527 . . . . 0.0 111.305 -177.38 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 41.9 mmtm -108.78 119.61 40.05 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 -179.558 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 35.6 m -137.37 161.04 35.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-O 121.397 0.618 . . . . 0.0 111.331 -179.167 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.487 ' O ' HG22 ' A' ' 42' ' ' THR . 10.5 mmmt -83.28 161.12 21.56 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.78 178.896 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -74.71 -36.27 62.71 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-O 121.001 0.429 . . . . 0.0 111.319 179.833 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 8.5 t -94.19 10.76 32.65 Favored 'General case' 0 N--CA 1.443 -0.803 0 CA-C-O 121.405 0.621 . . . . 0.0 111.766 -177.085 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' THR . . . . . 0.487 HG22 ' O ' ' A' ' 39' ' ' LYS . 2.0 t -92.48 169.09 10.82 Favored 'General case' 0 C--N 1.323 -0.55 0 O-C-N 121.688 -0.633 . . . . 0.0 109.862 -178.857 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 27.9 m170 -82.77 141.89 32.0 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-O 121.483 0.659 . . . . 0.0 111.821 -179.795 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.637 ' O ' ' HG3' ' A' ' 48' ' ' LYS . 0.2 OUTLIER -70.48 -18.14 62.97 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 115.421 -0.808 . . . . 0.0 109.922 -179.662 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.659 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -52.32 -45.31 65.55 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.068 -0.514 . . . . 0.0 112.117 -178.467 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.418 ' N ' ' HD3' ' A' ' 45' ' ' LYS . 16.3 ptmt -65.63 -29.59 70.18 Favored 'General case' 0 C--O 1.218 -0.581 0 CA-C-O 121.42 0.629 . . . . 0.0 110.47 -178.066 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.507 ' HB3' HD11 ' A' ' 44' ' ' LEU . 7.9 tt -73.86 -45.7 49.42 Favored 'General case' 0 C--N 1.309 -1.188 0 CA-C-N 115.481 -0.781 . . . . 0.0 109.716 179.939 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.637 ' HG3' ' O ' ' A' ' 44' ' ' LEU . 26.9 mtpt -58.7 -50.17 74.86 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-O 121.38 0.609 . . . . 0.0 110.156 -179.15 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.659 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 8.3 pt-20 -68.33 -33.76 74.89 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.865 -178.294 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 31.3 t -65.46 -46.74 78.65 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-O 121.201 0.524 . . . . 0.0 111.341 -178.674 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.591 ' CD1' HG12 ' A' ' 26' ' ' VAL . 1.6 p90 -76.43 -33.14 58.79 Favored 'General case' 0 N--CA 1.441 -0.878 0 C-N-CA 120.061 -0.656 . . . . 0.0 110.541 -176.836 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . 0.46 ' SG ' ' HG2' ' A' ' 59' ' ' MET . 88.1 m -62.36 -45.36 93.53 Favored 'General case' 0 CA--C 1.509 -0.609 0 CA-C-O 121.098 0.475 . . . . 0.0 110.674 -179.97 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 13.5 pt20 -69.49 -32.36 71.19 Favored 'General case' 0 N--CA 1.441 -0.908 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.545 -179.269 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 30.8 mmt180 -57.2 -40.48 77.52 Favored 'General case' 0 C--N 1.342 0.278 0 CA-C-O 121.25 0.548 . . . . 0.0 110.834 176.937 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.401 HE21 ' HB2' ' A' ' 55' ' ' GLN . 3.0 mt-30 -78.25 -21.04 50.5 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.874 179.616 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 80.73 34.03 28.94 Favored Glycine 0 N--CA 1.443 -0.883 0 C-N-CA 120.946 -0.645 . . . . 0.0 112.163 179.705 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 34.7 m -134.25 150.44 74.07 Favored Pre-proline 0 C--N 1.325 -0.469 0 O-C-N 122.567 -0.373 . . . . 0.0 110.553 -179.918 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . 0.465 ' HG2' ' OG ' ' A' ' 61' ' ' SER . 37.1 Cg_endo -66.8 150.18 83.37 Favored 'Trans proline' 0 C--O 1.239 0.56 0 C-N-CA 122.496 2.131 . . . . 0.0 112.354 179.243 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.46 ' HG2' ' SG ' ' A' ' 52' ' ' CYS . 78.2 mtp -70.39 -14.32 62.51 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.396 -177.163 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 2.0 p-10 -88.73 -9.16 52.91 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-O 121.031 0.443 . . . . 0.0 111.899 -178.547 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.465 ' OG ' ' HG2' ' A' ' 58' ' ' PRO . 73.1 m -94.2 -16.51 23.61 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 112.195 0.442 . . . . 0.0 112.195 179.67 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.457 HD13 ' SG ' ' A' ' 52' ' ' CYS . 1.3 pp -125.44 162.49 24.72 Favored 'General case' 0 C--N 1.315 -0.896 0 N-CA-C 113.056 0.762 . . . . 0.0 113.056 -178.796 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.528 ' O ' ' HA ' ' A' ' 90' ' ' VAL . 3.2 mmp_? -109.19 118.4 36.64 Favored 'General case' 0 C--N 1.311 -1.07 0 CA-C-N 115.078 -0.965 . . . . 0.0 110.801 -177.876 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.436 ' HB3' ' OH ' ' A' ' 51' ' ' TYR . 0.2 OUTLIER -102.54 113.05 26.08 Favored 'General case' 0 C--N 1.304 -1.372 0 CA-C-O 121.102 0.477 . . . . 0.0 110.388 176.044 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.454 ' C ' HD23 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -142.67 163.6 32.38 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-O 121.555 0.693 . . . . 0.0 111.231 -179.226 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 89.7 t80 -143.41 134.48 25.64 Favored 'General case' 0 C--N 1.309 -1.173 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 179.323 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 49.25 27.59 1.92 Allowed 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 124.04 0.936 . . . . 0.0 112.421 -179.51 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 85.64 22.28 50.88 Favored Glycine 0 CA--C 1.521 0.461 0 C-N-CA 121.069 -0.586 . . . . 0.0 113.167 -179.676 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -129.81 135.67 48.69 Favored 'General case' 0 C--N 1.323 -0.556 0 O-C-N 122.235 -0.567 . . . . 0.0 109.697 179.887 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -64.8 148.31 51.51 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-O 121.55 0.691 . . . . 0.0 110.988 177.764 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.406 HG12 ' HA ' ' A' ' 65' ' ' LEU . 22.6 mm -100.0 117.3 44.98 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.407 0 CA-C-O 121.101 0.476 . . . . 0.0 109.954 178.435 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.417 ' O ' ' HB2' ' A' ' 75' ' ' HIS . . . -93.79 163.77 13.39 Favored 'General case' 0 N--CA 1.436 -1.137 0 N-CA-C 109.755 -0.461 . . . . 0.0 109.755 -179.898 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 26.4 m-20 -69.82 -24.52 63.48 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-O 121.354 0.597 . . . . 0.0 111.064 -178.141 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 7.1 m-80 -95.38 5.56 51.31 Favored 'General case' 0 C--N 1.313 -1.001 0 CA-C-O 121.414 0.626 . . . . 0.0 109.42 -179.802 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . 0.551 ' O ' ' HB2' ' A' ' 44' ' ' LEU . 2.3 m170 -84.08 147.28 27.46 Favored 'General case' 0 CA--C 1.503 -0.853 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 -179.874 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.446 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 68.7 p -123.07 155.15 64.7 Favored Pre-proline 0 C--N 1.306 -1.316 0 CA-C-O 120.548 0.213 . . . . 0.0 110.949 179.255 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_exo -59.96 -38.62 77.43 Favored 'Trans proline' 0 N--CA 1.458 -0.581 0 C-N-CA 122.435 2.09 . . . . 0.0 111.277 178.724 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . 0.514 ' HG3' ' N ' ' A' ' 79' ' ' GLU . 33.7 pttt -67.09 -40.1 86.89 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.232 -178.663 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.514 ' N ' ' HG3' ' A' ' 78' ' ' LYS . 65.7 mm-40 -72.88 -36.85 67.43 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-O 121.178 0.513 . . . . 0.0 110.937 -178.763 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.459 HD23 ' CG ' ' A' ' 75' ' ' HIS . 5.4 mt -79.64 -3.02 45.31 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.198 0.523 . . . . 0.0 110.895 -179.651 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 75.51 42.16 27.97 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 121.145 -0.55 . . . . 0.0 112.9 177.635 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 64.0 mtt -99.78 162.75 12.81 Favored 'General case' 0 C--N 1.312 -1.054 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 179.111 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . 0.501 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 11.3 pt-20 -142.42 -170.42 3.18 Favored 'General case' 0 C--N 1.31 -1.115 0 N-CA-C 109.975 -0.38 . . . . 0.0 109.975 177.641 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.414 ' HA ' ' HB ' ' A' ' 22' ' ' ILE . 11.3 pt-20 -70.65 143.84 51.29 Favored 'General case' 0 N--CA 1.441 -0.886 0 C-N-CA 120.121 -0.631 . . . . 0.0 110.644 -179.132 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 74.51 3.0 4.22 Favored 'General case' 0 C--N 1.322 -0.587 0 C-N-CA 124.078 0.951 . . . . 0.0 111.192 178.818 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . 0.501 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 1.8 t0 -63.11 158.48 19.64 Favored 'General case' 0 CA--C 1.513 -0.463 0 CA-C-O 121.325 0.584 . . . . 0.0 110.727 178.452 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 9.3 p -127.66 144.25 38.1 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.539 0 CA-C-O 121.351 0.595 . . . . 0.0 111.077 -177.496 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 3.6 mp -112.24 149.91 14.66 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.066 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 178.129 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.417 ' O ' HD13 ' A' ' 65' ' ' LEU . 8.9 tp10 -104.72 137.52 42.41 Favored 'General case' 0 C--N 1.312 -1.041 0 N-CA-C 109.611 -0.514 . . . . 0.0 109.611 -176.001 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . 0.528 ' HA ' ' O ' ' A' ' 63' ' ' ARG . 65.3 t -126.12 131.9 71.13 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.895 0 CA-C-O 121.186 0.517 . . . . 0.0 111.08 178.81 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . 0.52 ' HB2' ' HB2' ' A' ' 63' ' ' ARG . 67.3 m-85 -114.18 176.15 5.16 Favored 'General case' 0 C--N 1.315 -0.909 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 179.644 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 10.4 tp60 -109.19 130.49 55.49 Favored 'General case' 0 C--N 1.304 -1.392 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 179.513 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -118.49 17.52 13.71 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 121.207 0.527 . . . . 0.0 110.45 178.038 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . 0.454 ' CG ' ' HB3' ' A' ' 61' ' ' SER . 99.5 mt-30 -64.36 -168.66 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.592 177.416 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 12.8 t -174.98 -174.64 0.79 Allowed 'General case' 0 C--N 1.317 -0.818 0 O-C-N 121.373 -0.829 . . . . 0.0 109.938 -174.711 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -103.53 -35.73 3.48 Favored Glycine 0 N--CA 1.437 -1.29 0 C-N-CA 121.03 -0.605 . . . . 0.0 111.603 179.783 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.439 -1.134 0 CA-C-O 118.466 -1.186 . . . . 0.0 111.335 -179.676 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.534 ' HA ' ' NE2' ' A' ' 4' ' ' GLN . 11.9 mmt . . . . . 0 N--CA 1.484 1.264 0 CA-C-O 120.94 0.4 . . . . 0.0 111.712 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 31.4 t -107.97 -15.62 14.49 Favored 'General case' 0 C--N 1.309 -1.187 0 CA-C-O 121.193 0.52 . . . . 0.0 111.492 -177.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -119.3 -9.87 9.83 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.911 0.862 . . . . 0.0 110.202 -178.499 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . 0.534 ' NE2' ' HA ' ' A' ' 1' ' ' MET . 0.0 OUTLIER -83.61 -51.46 7.28 Favored 'General case' 0 C--N 1.306 -1.285 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.59 -178.581 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -78.2 149.27 33.72 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-O 121.308 0.575 . . . . 0.0 111.933 -176.755 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -75.06 130.71 39.76 Favored 'General case' 0 C--N 1.317 -0.809 0 N-CA-C 109.224 -0.658 . . . . 0.0 109.224 175.267 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 14.2 ptmm? -129.79 138.76 33.82 Favored Pre-proline 0 C--N 1.31 -1.147 0 O-C-N 122.172 -0.33 . . . . 0.0 110.628 -177.815 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -52.31 111.8 0.71 Allowed 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 123.046 2.497 . . . . 0.0 112.882 -178.195 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 15.0 m -104.64 -0.03 28.01 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.782 179.742 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 36.5 m -64.05 133.05 52.34 Favored 'General case' 0 C--O 1.234 0.249 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 177.972 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . 0.431 ' HA ' ' HZ1' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -92.71 162.9 13.96 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 121.72 0.771 . . . . 0.0 112.451 -175.321 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.407 ' H ' ' CD ' ' A' ' 11' ' ' GLU . 27.2 m-20 -126.05 81.95 2.03 Favored 'General case' 0 CA--C 1.507 -0.688 0 CA-C-N 115.218 -0.901 . . . . 0.0 108.657 177.907 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 5.6 mp -65.9 -56.98 8.96 Favored 'General case' 0 C--N 1.307 -1.252 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.378 -178.874 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 59.02 61.31 7.49 Favored Glycine 0 N--CA 1.448 -0.516 0 N-CA-C 110.113 -1.195 . . . . 0.0 110.113 -176.656 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -54.95 123.87 14.88 Favored 'General case' 0 C--O 1.239 0.551 0 C-N-CA 123.097 0.559 . . . . 0.0 112.063 -175.255 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 21.8 ptmt -159.61 -172.88 3.87 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.43 -0.804 . . . . 0.0 109.193 -179.67 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 56.0 mtpt -90.37 -172.66 3.52 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 121.197 0.522 . . . . 0.0 111.431 179.036 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 -85.1 -175.52 5.78 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-O 121.406 0.622 . . . . 0.0 112.013 -176.529 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 102.69 140.31 10.91 Favored Glycine 0 N--CA 1.445 -0.749 0 CA-C-N 115.891 -0.595 . . . . 0.0 112.507 179.325 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.607 ' O ' ' HG3' ' A' ' 39' ' ' LYS . 52.9 mm-40 71.31 27.24 3.19 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 123.188 0.595 . . . . 0.0 112.148 176.25 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 42.6 p90 -126.2 164.97 19.79 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-O 121.615 0.721 . . . . 0.0 112.091 -177.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 23.4 pt -119.33 171.94 6.98 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.012 0 CA-C-N 115.372 -0.831 . . . . 0.0 110.13 177.612 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.515 ' HD3' ' N ' ' A' ' 23' ' ' LYS . 0.0 OUTLIER -121.14 143.07 49.3 Favored 'General case' 0 C--N 1.305 -1.35 0 N-CA-C 108.815 -0.809 . . . . 0.0 108.815 -178.751 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.5 mp -136.28 159.34 42.06 Favored 'General case' 0 C--N 1.3 -1.559 0 CA-C-O 121.194 0.521 . . . . 0.0 110.982 176.662 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.416 ' O ' ' HA ' ' A' ' 87' ' ' VAL . 5.3 tmmm? -126.82 142.45 51.54 Favored 'General case' 0 N--CA 1.439 -0.999 0 CA-C-O 121.513 0.673 . . . . 0.0 110.458 -179.404 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . 0.49 HG13 ' CD1' ' A' ' 51' ' ' TYR . 0.9 OUTLIER -117.57 142.23 32.72 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.458 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.975 -179.581 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.513 ' O ' ' HB ' ' A' ' 90' ' ' VAL . 48.5 mm -103.68 118.63 51.07 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.289 0 N-CA-C 107.164 -1.421 . . . . 0.0 107.164 174.318 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . 0.424 ' HA2' ' HB ' ' A' ' 90' ' ' VAL . . . -90.71 162.94 29.37 Favored Glycine 0 N--CA 1.419 -2.462 0 C-N-CA 120.049 -1.072 . . . . 0.0 111.717 -176.021 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.87 -25.32 64.97 Favored 'General case' 0 C--N 1.309 -1.153 0 CA-C-O 121.653 0.74 . . . . 0.0 110.72 176.356 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -82.0 1.44 35.57 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.199 177.451 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 9.7 m 73.52 13.18 4.53 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 122.216 1.008 . . . . 0.0 109.017 -175.413 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 2.9 t -76.91 116.46 17.59 Favored 'General case' 0 N--CA 1.44 -0.93 0 CA-C-N 114.46 -1.246 . . . . 0.0 110.475 -178.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.404 ' HA ' ' O ' ' A' ' 26' ' ' VAL . 45.1 mt-10 -89.49 110.78 21.58 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.286 0.565 . . . . 0.0 109.857 177.638 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 39.1 mm -99.8 137.76 26.28 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.44 0 N-CA-C 109.724 -0.472 . . . . 0.0 109.724 -178.928 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 12.5 m170 -117.91 132.41 56.41 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 108.648 -0.871 . . . . 0.0 108.648 179.514 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 1.3 p90 -145.39 168.0 21.56 Favored 'General case' 0 C--N 1.31 -1.11 0 CA-C-O 121.025 0.441 . . . . 0.0 111.026 -178.485 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 88.9 mttt -126.93 115.86 19.92 Favored 'General case' 0 N--CA 1.445 -0.677 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.542 -177.013 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 33.1 m -134.54 162.52 38.74 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 CA-C-O 120.964 0.411 . . . . 0.0 110.153 179.517 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.607 ' HG3' ' O ' ' A' ' 20' ' ' GLU . 81.6 tttt -89.01 165.78 14.33 Favored 'General case' 0 C--N 1.31 -1.128 0 O-C-N 122.011 -0.431 . . . . 0.0 110.859 -179.155 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -73.45 -36.79 65.94 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 112.675 0.62 . . . . 0.0 112.675 -177.156 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 10.1 t -93.34 13.64 20.84 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 120.926 0.393 . . . . 0.0 111.814 -177.695 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' THR . . . . . 0.557 HG22 ' O ' ' A' ' 39' ' ' LYS . 3.4 t -95.37 173.14 7.67 Favored 'General case' 0 C--N 1.321 -0.664 0 C-N-CA 120.11 -0.636 . . . . 0.0 110.366 -179.248 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 34.5 m170 -92.39 141.65 28.3 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-O 121.432 0.634 . . . . 0.0 111.699 -178.854 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.472 ' HB2' ' O ' ' A' ' 75' ' ' HIS . 0.8 OUTLIER -63.87 -18.27 64.01 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.437 -0.801 . . . . 0.0 111.279 179.31 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.437 ' HA ' ' HD3' ' A' ' 48' ' ' LYS . 0.0 OUTLIER -51.07 -40.43 58.32 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.801 -179.751 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.605 ' O ' ' HG3' ' A' ' 49' ' ' GLU . 19.2 mtpp -66.88 -46.0 76.3 Favored 'General case' 0 CA--C 1.488 -1.417 0 CA-C-O 121.95 0.881 . . . . 0.0 109.286 178.253 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 9.0 tt -60.14 -49.68 76.68 Favored 'General case' 0 C--N 1.291 -1.948 0 CA-C-N 114.616 -1.175 . . . . 0.0 110.11 -176.044 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.507 ' HA ' ' CE2' ' A' ' 51' ' ' TYR . 29.9 mtpt -59.26 -46.51 88.32 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.745 -0.661 . . . . 0.0 111.018 179.46 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.605 ' HG3' ' O ' ' A' ' 46' ' ' LYS . 1.4 pp20? -71.92 -30.68 65.59 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 121.336 0.589 . . . . 0.0 110.406 -178.346 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 17.8 m -70.42 -42.64 71.35 Favored 'General case' 0 N--CA 1.44 -0.954 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.943 -179.338 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.507 ' CE2' ' HA ' ' A' ' 48' ' ' LYS . 3.0 p90 -76.3 -32.87 58.98 Favored 'General case' 0 C--N 1.321 -0.649 0 C-N-CA 119.3 -0.96 . . . . 0.0 110.102 179.182 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . 0.522 ' SG ' HD12 ' A' ' 62' ' ' LEU . 47.4 m -60.82 -44.08 97.39 Favored 'General case' 0 CA--C 1.512 -0.483 0 CA-C-O 120.975 0.417 . . . . 0.0 110.691 177.749 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 12.3 pt20 -66.76 -35.06 79.21 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.58 179.463 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 2.5 mmm180 -59.02 -30.12 67.77 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-O 121.006 0.432 . . . . 0.0 111.246 177.024 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.458 HE21 ' HB2' ' A' ' 55' ' ' GLN . 3.5 mt-30 -90.4 -21.74 21.8 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 120.953 0.406 . . . . 0.0 110.844 179.602 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 78.85 34.03 35.5 Favored Glycine 0 N--CA 1.444 -0.772 0 C-N-CA 120.492 -0.861 . . . . 0.0 111.897 179.722 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 33.4 m -134.02 150.18 73.64 Favored Pre-proline 0 C--N 1.327 -0.401 0 O-C-N 122.543 -0.386 . . . . 0.0 110.417 -179.213 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . 0.488 ' HG2' ' OG ' ' A' ' 61' ' ' SER . 28.6 Cg_endo -64.12 150.9 87.39 Favored 'Trans proline' 0 N--CA 1.46 -0.498 0 C-N-CA 122.681 2.254 . . . . 0.0 112.269 179.199 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.429 ' HG2' ' SG ' ' A' ' 52' ' ' CYS . 74.4 mtp -73.07 -10.32 59.67 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.12 -178.142 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 2.2 p-10 -91.87 -9.68 42.43 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.232 -179.457 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.488 ' OG ' ' HG2' ' A' ' 58' ' ' PRO . 68.4 m -93.87 -12.89 27.94 Favored 'General case' 0 C--N 1.317 -0.807 0 N-CA-C 113.127 0.788 . . . . 0.0 113.127 -179.406 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.522 HD12 ' SG ' ' A' ' 52' ' ' CYS . 1.3 pp -128.26 165.56 20.28 Favored 'General case' 0 C--N 1.308 -1.213 0 O-C-N 121.638 -0.664 . . . . 0.0 112.726 -179.349 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.557 ' O ' ' HA ' ' A' ' 90' ' ' VAL . 3.7 mmp_? -111.95 118.12 34.61 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.814 -177.361 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -103.06 113.75 27.48 Favored 'General case' 0 C--N 1.302 -1.461 0 CA-C-O 120.94 0.4 . . . . 0.0 110.559 176.026 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.464 ' C ' HD22 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -142.25 161.21 38.61 Favored 'General case' 0 N--CA 1.445 -0.685 0 CA-C-O 121.605 0.716 . . . . 0.0 111.438 -179.455 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 93.7 t80 -144.63 136.73 26.1 Favored 'General case' 0 C--N 1.311 -1.093 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 179.061 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 48.88 27.06 1.48 Allowed 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 124.358 1.063 . . . . 0.0 112.631 -179.368 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 84.62 25.43 42.42 Favored Glycine 0 N--CA 1.447 -0.593 0 C-N-CA 120.806 -0.712 . . . . 0.0 113.025 -179.112 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -131.95 137.66 48.02 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 178.896 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -74.31 145.36 44.0 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-O 121.324 0.583 . . . . 0.0 109.747 178.492 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 23.6 mm -90.36 119.93 38.33 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.606 0 CA-C-O 121.15 0.5 . . . . 0.0 110.622 -178.508 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -90.64 163.46 14.53 Favored 'General case' 0 N--CA 1.437 -1.075 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 179.636 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . 0.416 ' HB3' ' HB3' ' A' ' 45' ' ' LYS . 59.6 m-20 -71.17 -21.38 62.17 Favored 'General case' 0 C--N 1.313 -1.007 0 CA-C-O 121.627 0.727 . . . . 0.0 110.362 -179.818 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 9.0 m-80 -97.73 6.83 47.4 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.735 -0.666 . . . . 0.0 109.504 179.528 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . 0.472 ' O ' ' HB2' ' A' ' 44' ' ' LEU . 3.4 m170 -82.81 140.74 32.78 Favored 'General case' 0 CA--C 1.508 -0.664 0 N-CA-C 109.538 -0.542 . . . . 0.0 109.538 178.858 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.404 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 67.0 p -117.73 154.77 51.08 Favored Pre-proline 0 C--N 1.309 -1.154 0 CA-C-O 120.45 0.166 . . . . 0.0 110.703 179.601 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -59.57 -39.79 71.74 Favored 'Trans proline' 0 N--CA 1.458 -0.576 0 C-N-CA 122.439 2.093 . . . . 0.0 111.43 179.129 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . 0.488 ' HG3' ' N ' ' A' ' 79' ' ' GLU . 28.2 pttt -67.77 -38.92 84.06 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.225 -178.013 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.488 ' N ' ' HG3' ' A' ' 78' ' ' LYS . 9.4 mm-40 -73.32 -36.26 66.18 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.929 0.395 . . . . 0.0 110.953 -178.291 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.452 HD23 ' CG ' ' A' ' 75' ' ' HIS . 5.8 mt -82.3 2.72 30.72 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.212 0.529 . . . . 0.0 110.996 -179.704 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 72.62 39.6 55.58 Favored Glycine 0 N--CA 1.453 -0.188 0 C-N-CA 120.962 -0.637 . . . . 0.0 112.618 177.745 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 65.0 mtt -98.55 162.5 13.11 Favored 'General case' 0 C--N 1.312 -1.046 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 179.514 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -143.59 -170.74 3.37 Favored 'General case' 0 C--N 1.306 -1.293 0 CA-C-O 120.803 0.335 . . . . 0.0 110.201 -179.563 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.417 ' O ' ' HB2' ' A' ' 85' ' ' GLU . 5.6 pt-20 -70.84 136.01 48.44 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 120.994 0.426 . . . . 0.0 110.829 179.875 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . 0.417 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 16.1 mm-40 74.25 5.58 4.64 Favored 'General case' 0 C--O 1.238 0.485 0 C-N-CA 124.008 0.923 . . . . 0.0 111.813 178.356 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 6.2 t0 -60.54 160.37 9.09 Favored 'General case' 0 C--O 1.238 0.453 0 CA-C-O 121.271 0.558 . . . . 0.0 110.874 176.109 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . 0.416 ' HA ' ' O ' ' A' ' 25' ' ' LYS . 7.5 p -126.54 143.62 39.42 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.002 0 CA-C-O 121.255 0.55 . . . . 0.0 111.443 -177.238 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 3.7 mp -116.1 153.72 17.68 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 179.063 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -106.11 138.76 41.73 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.923 0.392 . . . . 0.0 110.37 -176.737 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . 0.557 ' HA ' ' O ' ' A' ' 63' ' ' ARG . 89.4 t -128.33 134.38 64.96 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-O 121.389 0.614 . . . . 0.0 111.475 178.987 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . 0.546 ' HB2' ' HB2' ' A' ' 63' ' ' ARG . 70.4 m-85 -116.31 176.24 5.19 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.85 -0.614 . . . . 0.0 109.693 178.536 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 9.3 tp60 -108.41 129.58 55.25 Favored 'General case' 0 C--N 1.31 -1.109 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 178.429 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -119.26 20.77 12.5 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.079 0.466 . . . . 0.0 110.629 178.177 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . 0.438 ' CG ' ' HB3' ' A' ' 61' ' ' SER . 99.5 mt-30 -63.22 -162.05 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 121.412 0.625 . . . . 0.0 111.878 178.472 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 7.7 t -154.95 159.32 40.33 Favored 'General case' 0 C--N 1.309 -1.156 0 O-C-N 121.63 -0.669 . . . . 0.0 110.148 -175.632 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 159.6 -58.34 0.32 Allowed Glycine 0 N--CA 1.44 -1.071 0 N-CA-C 111.346 -0.701 . . . . 0.0 111.346 179.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.437 -1.279 0 CA-C-O 118.645 -1.086 . . . . 0.0 111.393 -179.755 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.7 ptm . . . . . 0 N--CA 1.481 1.111 0 CA-C-O 121.473 0.654 . . . . 0.0 110.805 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 66.4 m -164.9 -29.89 0.03 OUTLIER 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.864 -175.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 25.7 m-20 -75.02 3.19 8.82 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 116.568 -0.287 . . . . 0.0 111.764 -178.569 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 2.1 pt20 -165.37 173.9 10.65 Favored 'General case' 0 N--CA 1.444 -0.741 0 N-CA-C 108.514 -0.921 . . . . 0.0 108.514 -178.116 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -110.89 167.76 10.0 Favored 'General case' 0 C--N 1.311 -1.069 0 N-CA-C 109.897 -0.409 . . . . 0.0 109.897 177.83 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -155.65 133.04 10.95 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 109.726 -0.472 . . . . 0.0 109.726 179.698 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 16.7 ptpt -156.59 157.22 30.84 Favored Pre-proline 0 C--N 1.312 -1.022 0 CA-C-N 116.694 -0.23 . . . . 0.0 110.724 -178.793 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 36.0 Cg_endo -66.21 -172.88 0.3 Allowed 'Trans proline' 0 C--N 1.35 0.614 0 C-N-CA 122.599 2.199 . . . . 0.0 111.622 177.274 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 5.2 p -91.96 80.27 5.18 Favored 'General case' 0 C--N 1.312 -1.026 0 O-C-N 121.743 -0.598 . . . . 0.0 111.426 -178.407 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 5.8 m -50.35 -57.06 8.78 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-O 121.547 0.689 . . . . 0.0 109.99 176.941 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -104.11 135.18 46.09 Favored 'General case' 0 N--CA 1.437 -1.116 0 N-CA-C 107.657 -1.238 . . . . 0.0 107.657 176.713 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -128.13 138.53 52.55 Favored 'General case' 0 C--N 1.311 -1.084 0 CA-C-O 121.515 0.674 . . . . 0.0 112.434 -173.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.667 ' O ' ' HE3' ' A' ' 16' ' ' LYS . 80.2 mt -102.9 147.99 26.22 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.643 -179.459 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -89.58 -30.69 12.83 Favored Glycine 0 C--N 1.305 -1.146 0 C-N-CA 120.367 -0.92 . . . . 0.0 111.656 178.139 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -105.92 107.93 19.19 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-O 121.208 0.527 . . . . 0.0 109.966 178.651 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.667 ' HE3' ' O ' ' A' ' 13' ' ' LEU . 89.7 mttt -122.18 134.37 54.72 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-O 121.109 0.48 . . . . 0.0 111.955 -176.467 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.434 ' HE2' ' N ' ' A' ' 17' ' ' LYS . 0.0 OUTLIER 176.86 178.08 0.26 Allowed 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 177.856 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -161.43 149.02 14.97 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 121.174 0.511 . . . . 0.0 110.747 176.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 178.04 -177.47 48.38 Favored Glycine 0 N--CA 1.436 -1.318 0 N-CA-C 110.798 -0.921 . . . . 0.0 110.798 -179.671 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 33.6 mm-40 66.26 43.69 2.7 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-O 121.389 0.614 . . . . 0.0 110.42 179.042 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 12.3 p90 -124.62 164.94 18.79 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-O 121.539 0.685 . . . . 0.0 111.805 -178.012 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 27.9 pt -112.58 173.19 2.79 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.976 0 CA-C-N 115.436 -0.802 . . . . 0.0 109.38 178.06 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 6.8 mtmt -112.37 145.9 39.28 Favored 'General case' 0 C--N 1.289 -2.055 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 -178.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.6 mp -140.84 160.29 40.37 Favored 'General case' 0 C--N 1.302 -1.459 0 CA-C-O 121.21 0.529 . . . . 0.0 110.797 173.799 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.409 ' HE2' ' HB3' ' A' ' 25' ' ' LYS . 5.1 tmmm? -132.74 142.69 49.16 Favored 'General case' 0 C--N 1.312 -1.039 0 CA-C-O 121.391 0.615 . . . . 0.0 110.721 -179.088 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . 0.502 ' O ' ' HA ' ' A' ' 33' ' ' GLU . 0.9 OUTLIER -117.27 141.18 36.94 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.439 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.608 -179.991 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.462 ' O ' ' HB ' ' A' ' 90' ' ' VAL . 43.7 mm -104.24 114.77 44.72 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.037 0 N-CA-C 107.409 -1.33 . . . . 0.0 107.409 174.378 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . 0.45 ' HA2' ' HB ' ' A' ' 90' ' ' VAL . . . -87.01 162.84 34.21 Favored Glycine 0 N--CA 1.423 -2.207 0 C-N-CA 119.856 -1.164 . . . . 0.0 111.241 -177.337 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.68 -30.07 30.02 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-O 121.116 0.484 . . . . 0.0 112.258 177.175 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -93.55 13.62 21.34 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-O 121.272 0.558 . . . . 0.0 110.193 -179.301 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 23.6 m 74.65 21.01 2.28 Favored 'General case' 0 CA--C 1.504 -0.811 0 CA-C-O 122.623 1.201 . . . . 0.0 108.396 -178.91 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 2.5 m -68.78 94.57 0.61 Allowed 'General case' 0 N--CA 1.425 -1.721 0 CA-C-N 113.295 -1.775 . . . . 0.0 111.763 -179.164 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.502 ' HA ' ' O ' ' A' ' 26' ' ' VAL . 37.9 mt-10 -82.33 104.08 12.38 Favored 'General case' 0 CA--C 1.506 -0.746 0 C-N-CA 120.369 -0.532 . . . . 0.0 110.265 176.968 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.422 HG21 ' HA ' ' A' ' 51' ' ' TYR . 36.8 mm -100.18 133.73 42.21 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.767 0 N-CA-C 108.963 -0.755 . . . . 0.0 108.963 178.419 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 12.5 m170 -113.34 128.81 56.58 Favored 'General case' 0 C--N 1.316 -0.854 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 -179.43 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 1.1 p90 -140.91 149.08 41.43 Favored 'General case' 0 C--N 1.306 -1.301 0 CA-C-O 121.488 0.661 . . . . 0.0 111.311 -177.937 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 96.3 mttt -113.97 105.65 13.49 Favored 'General case' 0 C--N 1.31 -1.117 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.859 -178.691 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.462 ' HB ' HG21 ' A' ' 42' ' ' THR . 14.6 m -129.88 162.58 37.29 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.277 -177.592 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.412 ' O ' HG23 ' A' ' 42' ' ' THR . 46.3 mtpt -79.46 178.32 8.2 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-O 121.731 0.777 . . . . 0.0 112.093 -178.779 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -87.59 -31.03 20.06 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.538 -0.756 . . . . 0.0 109.91 178.3 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 10.2 t -92.87 13.0 21.76 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 115.617 -0.719 . . . . 0.0 111.465 -177.631 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' THR . . . . . 0.462 HG21 ' HB ' ' A' ' 38' ' ' VAL . 6.4 t -94.56 162.83 13.64 Favored 'General case' 0 C--N 1.318 -0.795 0 O-C-N 122.029 -0.419 . . . . 0.0 109.974 -178.371 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . 0.498 ' O ' ' HG3' ' A' ' 46' ' ' LYS . 24.5 m170 -85.37 141.15 30.21 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-O 121.033 0.444 . . . . 0.0 110.149 177.838 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.651 ' O ' ' HG3' ' A' ' 48' ' ' LYS . 0.5 OUTLIER -63.76 -20.28 65.64 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.888 -179.898 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.703 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -50.7 -47.29 59.04 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 112.173 0.435 . . . . 0.0 112.173 -178.476 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.498 ' HG3' ' O ' ' A' ' 43' ' ' HIS . 0.0 OUTLIER -68.84 -30.11 68.59 Favored 'General case' 0 C--O 1.222 -0.363 0 CA-C-O 121.165 0.507 . . . . 0.0 110.964 -178.872 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 7.8 tt -72.19 -48.53 42.53 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.549 178.559 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.651 ' HG3' ' O ' ' A' ' 44' ' ' LEU . 24.4 mtpt -57.16 -46.6 82.63 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-O 121.374 0.607 . . . . 0.0 110.46 -178.463 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.703 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 8.3 pt-20 -71.95 -32.94 67.79 Favored 'General case' 0 C--N 1.312 -1.052 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.692 -179.166 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' SER . . . . . 0.536 ' O ' ' HG2' ' A' ' 54' ' ' ARG . 23.2 t -62.18 -46.23 89.88 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-O 121.01 0.433 . . . . 0.0 110.699 -179.178 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.474 ' CD1' HG13 ' A' ' 26' ' ' VAL . 2.4 p90 -75.39 -33.0 60.96 Favored 'General case' 0 N--CA 1.441 -0.924 0 C-N-CA 119.744 -0.783 . . . . 0.0 110.701 -178.064 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . 0.549 ' SG ' ' HG2' ' A' ' 59' ' ' MET . 97.0 m -63.08 -45.89 90.0 Favored 'General case' 0 CA--C 1.509 -0.615 0 CA-C-O 121.08 0.467 . . . . 0.0 110.644 179.607 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -66.8 -34.45 77.85 Favored 'General case' 0 N--CA 1.442 -0.847 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.476 -179.499 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.536 ' HG2' ' O ' ' A' ' 50' ' ' SER . 40.0 mmt180 -57.23 -40.44 77.56 Favored 'General case' 0 C--N 1.349 0.572 0 CA-C-O 121.105 0.478 . . . . 0.0 111.153 176.813 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.503 ' NE2' ' HA ' ' A' ' 52' ' ' CYS . 2.8 mt-30 -77.24 -21.45 53.73 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.028 0.442 . . . . 0.0 110.982 -179.335 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 80.63 38.28 17.41 Favored Glycine 0 N--CA 1.443 -0.863 0 C-N-CA 120.674 -0.774 . . . . 0.0 111.793 -179.908 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 29.9 m -140.67 149.19 55.98 Favored Pre-proline 0 C--N 1.327 -0.392 0 N-CA-C 110.172 -0.307 . . . . 0.0 110.172 -179.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -66.07 150.7 85.1 Favored 'Trans proline' 0 C--O 1.241 0.674 0 C-N-CA 122.325 2.016 . . . . 0.0 111.964 178.529 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.549 ' HG2' ' SG ' ' A' ' 52' ' ' CYS . 81.2 mtp -69.19 -8.87 49.66 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.95 -176.845 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 22.8 p30 -91.94 -12.46 33.36 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-O 121.134 0.492 . . . . 0.0 111.534 -178.476 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.429 ' HB3' HE21 ' A' ' 94' ' ' GLN . 75.3 m -84.28 -23.14 30.46 Favored 'General case' 0 N--CA 1.442 -0.831 0 CA-C-O 121.225 0.536 . . . . 0.0 111.391 179.848 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.523 HD11 ' SG ' ' A' ' 52' ' ' CYS . 2.0 pp -131.82 151.96 51.32 Favored 'General case' 0 C--N 1.309 -1.183 0 CA-C-O 121.549 0.69 . . . . 0.0 112.204 -178.231 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.432 ' O ' ' HA ' ' A' ' 90' ' ' VAL . 1.1 ptp180 -109.97 139.96 44.51 Favored 'General case' 0 C--N 1.312 -1.06 0 CA-C-O 121.5 0.667 . . . . 0.0 112.657 -179.417 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -112.3 119.71 39.23 Favored 'General case' 0 C--N 1.311 -1.077 0 CA-C-N 114.96 -1.018 . . . . 0.0 110.726 -177.969 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.457 ' C ' HD23 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -142.79 164.23 30.65 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-O 121.327 0.584 . . . . 0.0 111.101 178.955 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 88.4 t80 -145.68 134.12 21.94 Favored 'General case' 0 C--N 1.312 -1.053 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 179.091 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 6.5 pt-20 49.1 28.08 1.98 Allowed 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 124.155 0.982 . . . . 0.0 112.102 -179.351 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 84.55 25.26 43.37 Favored Glycine 0 N--CA 1.447 -0.571 0 C-N-CA 120.848 -0.692 . . . . 0.0 113.195 -178.906 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 3.0 pt20 -131.63 134.68 46.25 Favored 'General case' 0 C--N 1.32 -0.695 0 O-C-N 122.21 -0.582 . . . . 0.0 109.893 178.681 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . 0.425 ' HD3' ' N ' ' A' ' 70' ' ' ARG . 0.0 OUTLIER -65.77 144.1 57.09 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-O 121.553 0.692 . . . . 0.0 110.43 176.767 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 23.3 mm -94.5 119.79 42.98 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.573 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 179.471 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -98.02 162.9 13.0 Favored 'General case' 0 N--CA 1.438 -1.031 0 CA-C-O 120.909 0.385 . . . . 0.0 110.0 -178.237 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . 0.454 ' HB3' ' HB3' ' A' ' 45' ' ' LYS . 62.0 m-20 -67.65 -23.75 65.37 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-O 121.375 0.607 . . . . 0.0 111.381 -178.511 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 3.1 m-80 -97.25 4.93 50.77 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-O 121.433 0.635 . . . . 0.0 109.69 -178.719 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . 0.521 ' O ' ' HB2' ' A' ' 44' ' ' LEU . 5.9 m170 -84.72 142.69 29.67 Favored 'General case' 0 CA--C 1.504 -0.826 0 CA-C-N 116.187 -0.46 . . . . 0.0 109.768 179.908 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 81.8 p -117.29 154.0 50.13 Favored Pre-proline 0 C--N 1.304 -1.401 0 CA-C-N 116.631 -0.259 . . . . 0.0 110.792 179.177 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_exo -60.33 -37.71 80.16 Favored 'Trans proline' 0 N--CA 1.456 -0.68 0 C-N-CA 122.435 2.09 . . . . 0.0 111.204 179.298 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . 0.459 ' HG3' ' N ' ' A' ' 79' ' ' GLU . 34.5 pttt -68.93 -35.88 77.32 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.14 -178.279 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.459 ' N ' ' HG3' ' A' ' 78' ' ' LYS . 14.4 mm-40 -76.61 -37.35 56.57 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-O 121.039 0.447 . . . . 0.0 111.322 -178.898 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.463 HD22 ' CG ' ' A' ' 75' ' ' HIS . 5.2 mt -78.72 -5.16 52.42 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.241 0.543 . . . . 0.0 110.627 179.626 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 78.73 43.43 11.72 Favored Glycine 0 N--CA 1.45 -0.368 0 CA-C-N 115.884 -0.598 . . . . 0.0 112.883 176.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 61.1 mtt -101.89 162.29 13.02 Favored 'General case' 0 C--N 1.312 -1.025 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 178.652 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -138.14 -170.98 2.92 Favored 'General case' 0 C--N 1.313 -1.016 0 N-CA-C 110.04 -0.356 . . . . 0.0 110.04 179.506 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -70.11 129.38 39.25 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-O 121.273 0.559 . . . . 0.0 111.049 179.755 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 76.25 11.98 2.78 Favored 'General case' 0 C--N 1.316 -0.865 0 C-N-CA 124.312 1.045 . . . . 0.0 112.399 178.216 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -66.11 167.24 10.34 Favored 'General case' 0 C--O 1.239 0.551 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.107 174.332 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . 0.407 ' HA ' ' O ' ' A' ' 25' ' ' LYS . 8.8 p -129.39 145.27 35.99 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.105 0 CA-C-O 121.298 0.57 . . . . 0.0 111.751 -176.928 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 3.8 mp -115.82 153.71 17.37 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.741 0 N-CA-C 108.63 -0.878 . . . . 0.0 108.63 178.824 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -106.35 137.66 43.92 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 120.981 0.42 . . . . 0.0 110.491 -176.149 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . 0.462 ' HB ' ' O ' ' A' ' 27' ' ' ILE . 97.9 t -129.61 135.89 60.43 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.909 0 CA-C-O 121.254 0.55 . . . . 0.0 110.821 178.971 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . 0.406 ' HB2' ' HG3' ' A' ' 63' ' ' ARG . 84.5 m-85 -122.77 171.75 8.95 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.065 179.853 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 9.0 tp60 -97.49 135.83 38.78 Favored 'General case' 0 C--N 1.308 -1.205 0 N-CA-C 109.779 -0.452 . . . . 0.0 109.779 179.482 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -126.58 19.94 7.29 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 121.306 0.574 . . . . 0.0 110.764 176.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . 0.429 HE21 ' HB3' ' A' ' 61' ' ' SER . 97.2 mt-30 -66.43 -155.16 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.736 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.241 175.042 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 8.2 t -166.17 101.74 0.63 Allowed 'General case' 0 C--N 1.318 -0.797 0 CA-C-O 122.287 1.041 . . . . 0.0 110.929 -178.597 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -146.11 95.41 0.17 Allowed Glycine 0 N--CA 1.437 -1.267 0 CA-C-N 115.078 -0.965 . . . . 0.0 112.191 179.388 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.12 0 CA-C-O 118.384 -1.231 . . . . 0.0 111.281 178.419 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 47.1 ttm . . . . . 0 N--CA 1.47 0.534 0 CA-C-O 120.859 0.361 . . . . 0.0 111.676 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 8.6 p -89.14 24.44 2.14 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 112.502 0.556 . . . . 0.0 112.502 -176.423 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 62.92 43.04 7.08 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-O 121.432 0.634 . . . . 0.0 110.768 179.693 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 40.3 mt-30 -57.62 106.44 0.34 Allowed 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.159 -0.928 . . . . 0.0 110.686 179.443 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . 0.444 ' CD ' ' H ' ' A' ' 5' ' ' GLU . 0.1 OUTLIER -84.08 168.26 16.04 Favored 'General case' 0 C--N 1.309 -1.18 0 CA-C-N 115.532 -0.758 . . . . 0.0 111.416 -176.858 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -100.76 141.23 33.92 Favored 'General case' 0 N--CA 1.438 -1.044 0 CA-C-N 115.971 -0.559 . . . . 0.0 109.785 178.509 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 22.0 ptmt -139.59 152.36 68.5 Favored Pre-proline 0 C--N 1.31 -1.132 0 N-CA-C 109.406 -0.59 . . . . 0.0 109.406 -179.318 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 21.0 Cg_exo -62.54 104.86 0.38 Allowed 'Trans proline' 0 C--O 1.236 0.418 0 C-N-CA 122.399 2.066 . . . . 0.0 111.539 178.673 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 3.1 p -80.04 114.62 19.09 Favored 'General case' 0 C--N 1.305 -1.363 0 CA-C-N 115.839 -0.618 . . . . 0.0 111.046 179.929 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 7.7 m -80.6 84.04 6.26 Favored 'General case' 0 N--CA 1.442 -0.858 0 CA-C-O 121.638 0.732 . . . . 0.0 110.216 179.715 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 -143.75 139.21 29.31 Favored 'General case' 0 C--N 1.311 -1.107 0 CA-C-N 115.705 -0.68 . . . . 0.0 109.742 -179.203 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -78.64 -22.84 46.27 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 120.885 0.374 . . . . 0.0 111.683 -177.518 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 80.9 mt -63.18 -77.6 0.05 Allowed 'General case' 0 C--O 1.234 0.242 0 N-CA-C 111.976 0.362 . . . . 0.0 111.976 -178.732 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 68.17 77.35 0.36 Allowed Glycine 0 N--CA 1.446 -0.666 0 N-CA-C 110.465 -1.054 . . . . 0.0 110.465 -177.02 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -60.07 143.9 50.92 Favored 'General case' 0 C--O 1.238 0.478 0 CA-C-O 121.273 0.559 . . . . 0.0 111.234 -176.867 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 71.9 mmtt -89.69 -166.09 1.51 Allowed 'General case' 0 C--N 1.309 -1.176 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.172 -178.133 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 45.7 tttm -80.35 160.68 25.35 Favored 'General case' 0 N--CA 1.434 -1.254 0 O-C-N 122.036 -0.415 . . . . 0.0 111.146 -179.669 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -45.64 118.49 1.81 Allowed 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 115.56 -0.746 . . . . 0.0 111.603 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -159.14 6.02 0.13 Allowed Glycine 0 C--N 1.317 -0.49 0 N-CA-C 111.547 -0.621 . . . . 0.0 111.547 178.879 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -122.58 35.17 4.94 Favored 'General case' 0 C--N 1.311 -1.073 0 CA-C-O 121.605 0.716 . . . . 0.0 109.799 -178.826 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.429 ' CE1' ' HB3' ' A' ' 37' ' ' LYS . 51.8 p90 -113.18 157.2 21.99 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.121 -178.027 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 29.0 pt -104.21 173.47 1.36 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.961 0 CA-C-O 121.785 0.803 . . . . 0.0 110.632 178.801 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.402 ' HE3' ' HG3' ' A' ' 85' ' ' GLU . 11.2 mtmt -115.57 145.86 42.28 Favored 'General case' 0 C--N 1.295 -1.781 0 CA-C-N 115.791 -0.641 . . . . 0.0 109.54 -178.356 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.0 mp -141.03 163.48 32.85 Favored 'General case' 0 C--N 1.306 -1.289 0 CA-C-O 121.213 0.53 . . . . 0.0 111.335 174.25 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.498 ' NZ ' HD13 ' A' ' 27' ' ' ILE . 3.1 tmmt? -135.52 144.26 46.21 Favored 'General case' 0 N--CA 1.445 -0.71 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.568 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . 0.557 ' O ' ' HA ' ' A' ' 33' ' ' GLU . 0.9 OUTLIER -114.41 142.48 26.97 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.121 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.891 179.886 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.498 HD13 ' NZ ' ' A' ' 25' ' ' LYS . 41.4 mm -110.94 97.71 6.09 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.842 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 176.079 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . 0.525 ' HA2' ' HB ' ' A' ' 90' ' ' VAL . . . -66.21 165.06 39.71 Favored Glycine 0 N--CA 1.434 -1.476 0 C-N-CA 120.646 -0.787 . . . . 0.0 113.918 178.691 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.91 -19.48 18.04 Favored 'General case' 0 C--N 1.315 -0.933 0 C-N-CA 124.286 1.034 . . . . 0.0 112.411 178.906 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.415 ' O ' ' HB2' ' A' ' 31' ' ' SER . 23.4 t70 -106.9 13.4 27.76 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.521 0.677 . . . . 0.0 110.03 -179.039 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' SER . . . . . 0.415 ' HB2' ' O ' ' A' ' 30' ' ' ASP . 62.6 m 74.72 23.6 1.78 Allowed 'General case' 0 CA--C 1.506 -0.742 0 CA-C-O 122.768 1.271 . . . . 0.0 108.076 -178.076 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 9.6 m -71.09 91.51 0.91 Allowed 'General case' 0 N--CA 1.426 -1.655 0 CA-C-N 113.384 -1.734 . . . . 0.0 110.411 179.096 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.557 ' HA ' ' O ' ' A' ' 26' ' ' VAL . 24.8 mt-10 -83.09 107.33 15.59 Favored 'General case' 0 CA--C 1.511 -0.555 0 CA-C-O 121.279 0.561 . . . . 0.0 110.887 -179.816 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 28.2 mm -103.65 138.12 29.43 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.242 0 N-CA-C 109.147 -0.686 . . . . 0.0 109.147 178.637 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . 0.401 ' CD2' ' HG3' ' A' ' 25' ' ' LYS . 12.3 m170 -115.45 133.64 55.84 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 -179.915 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -146.6 165.31 29.89 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-O 121.141 0.496 . . . . 0.0 111.035 -177.997 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.429 ' HB3' ' CE1' ' A' ' 21' ' ' TYR . 64.7 mmtt -123.79 115.33 21.18 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.14 -0.482 . . . . 0.0 109.912 -177.683 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 20.3 m -136.79 154.5 31.85 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-O 120.91 0.386 . . . . 0.0 110.346 179.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.564 ' O ' HG21 ' A' ' 42' ' ' THR . 83.4 tttt -81.14 163.03 23.4 Favored 'General case' 0 C--N 1.314 -0.955 0 O-C-N 121.837 -0.54 . . . . 0.0 111.07 -178.663 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' MET . . . . . 0.475 ' O ' ' HG2' ' A' ' 78' ' ' LYS . 0.0 OUTLIER -68.64 -39.59 80.68 Favored 'General case' 0 N--CA 1.466 0.327 0 O-C-N 121.905 -0.497 . . . . 0.0 111.986 -177.785 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 14.9 t -93.23 13.39 21.37 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-O 121.167 0.508 . . . . 0.0 111.742 -175.777 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' THR . . . . . 0.564 HG21 ' O ' ' A' ' 39' ' ' LYS . 2.2 t -92.95 164.37 13.32 Favored 'General case' 0 C--N 1.323 -0.57 0 O-C-N 121.833 -0.542 . . . . 0.0 110.34 -179.031 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . 0.488 ' O ' ' HG2' ' A' ' 46' ' ' LYS . 17.2 m170 -77.12 139.55 39.99 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.42 0.628 . . . . 0.0 111.146 178.93 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.615 ' HB2' ' O ' ' A' ' 75' ' ' HIS . 0.2 OUTLIER -70.03 -17.6 63.27 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 115.68 -0.691 . . . . 0.0 109.516 -179.224 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.738 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -53.94 -45.64 71.31 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.963 -178.456 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.488 ' HG2' ' O ' ' A' ' 43' ' ' HIS . 13.6 ptmm? -63.5 -30.15 71.32 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 121.563 0.697 . . . . 0.0 110.61 -178.649 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.51 ' HB3' HD13 ' A' ' 44' ' ' LEU . 8.2 tt -72.44 -48.91 37.42 Favored 'General case' 0 C--N 1.31 -1.139 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.085 179.37 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.575 ' HG3' ' O ' ' A' ' 44' ' ' LEU . 27.0 mtpt -58.57 -46.84 86.07 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 121.321 0.581 . . . . 0.0 110.619 -178.292 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.738 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 5.9 pt-20 -70.3 -31.55 68.94 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.683 -179.167 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 26.6 t -67.28 -45.85 75.39 Favored 'General case' 0 N--CA 1.455 -0.193 0 CA-C-O 121.102 0.477 . . . . 0.0 111.32 -179.129 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.439 ' CD1' HG12 ' A' ' 26' ' ' VAL . 2.1 p90 -76.03 -32.53 59.4 Favored 'General case' 0 N--CA 1.443 -0.784 0 C-N-CA 119.613 -0.835 . . . . 0.0 110.359 -176.992 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . 0.495 ' SG ' ' HG2' ' A' ' 59' ' ' MET . 85.1 m -63.01 -43.65 98.19 Favored 'General case' 0 CA--C 1.513 -0.449 0 CA-C-O 120.969 0.414 . . . . 0.0 110.864 178.878 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 12.7 pt20 -68.74 -33.58 74.15 Favored 'General case' 0 N--CA 1.448 -0.546 0 C-N-CA 120.513 -0.475 . . . . 0.0 110.419 -179.638 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.486 ' HA ' ' NE ' ' A' ' 54' ' ' ARG . 3.2 mmp_? -57.79 -43.45 85.62 Favored 'General case' 0 C--N 1.341 0.236 0 CA-C-O 121.233 0.54 . . . . 0.0 111.117 177.319 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.415 HE21 ' HB2' ' A' ' 55' ' ' GLN . 2.9 mt-30 -75.33 -20.24 59.16 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 121.222 0.534 . . . . 0.0 110.814 179.299 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 79.94 29.39 47.02 Favored Glycine 0 N--CA 1.446 -0.698 0 C-N-CA 121.056 -0.592 . . . . 0.0 112.044 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 34.7 m -129.47 148.99 71.57 Favored Pre-proline 0 C--N 1.322 -0.607 0 O-C-N 122.48 -0.423 . . . . 0.0 110.981 -178.527 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . 0.5 ' HG2' ' OG ' ' A' ' 61' ' ' SER . 33.5 Cg_endo -66.99 150.87 82.82 Favored 'Trans proline' 0 N--CA 1.456 -0.728 0 C-N-CA 122.459 2.106 . . . . 0.0 112.296 178.713 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.495 ' HG2' ' SG ' ' A' ' 52' ' ' CYS . 75.8 mtp -70.61 -8.83 54.57 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.589 -177.086 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.8 p-10 -92.37 -9.74 40.68 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.662 -179.466 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.5 ' OG ' ' HG2' ' A' ' 58' ' ' PRO . 70.0 m -89.64 -22.78 22.13 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-O 121.016 0.436 . . . . 0.0 111.703 -179.182 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 1.2 pp -126.05 171.15 11.05 Favored 'General case' 0 C--N 1.314 -0.978 0 O-C-N 121.965 -0.46 . . . . 0.0 111.996 -178.69 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.5 ' CG ' ' HB3' ' A' ' 93' ' ' GLU . 57.1 mtp180 -122.38 122.8 39.88 Favored 'General case' 0 CA--C 1.506 -0.744 0 CA-C-O 120.967 0.413 . . . . 0.0 110.663 -177.698 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -100.83 115.01 29.33 Favored 'General case' 0 C--N 1.304 -1.384 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.614 177.671 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.457 ' C ' HD23 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -143.87 162.01 37.21 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-O 121.46 0.648 . . . . 0.0 111.396 179.728 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 87.1 t80 -143.18 135.56 27.28 Favored 'General case' 0 C--N 1.306 -1.304 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 179.002 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 49.62 31.12 3.98 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.057 0.943 . . . . 0.0 112.166 -179.564 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 84.94 14.24 70.13 Favored Glycine 0 N--CA 1.447 -0.612 0 CA-C-N 116.019 -0.537 . . . . 0.0 113.447 179.025 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . 0.413 ' O ' ' HB2' ' A' ' 65' ' ' LEU . 2.7 pt20 -122.25 135.16 54.71 Favored 'General case' 0 C--N 1.317 -0.807 0 O-C-N 122.139 -0.624 . . . . 0.0 109.505 -178.737 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.46 140.57 48.35 Favored 'General case' 0 C--N 1.313 -1.005 0 CA-C-O 121.44 0.638 . . . . 0.0 109.961 178.843 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 22.8 mm -86.74 121.76 38.04 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.517 0 CA-C-O 121.075 0.464 . . . . 0.0 110.344 -178.338 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.409 ' O ' ' HB2' ' A' ' 75' ' ' HIS . . . -95.75 161.15 14.14 Favored 'General case' 0 N--CA 1.434 -1.246 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 179.667 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 48.5 m-20 -66.01 -27.89 68.46 Favored 'General case' 0 C--N 1.311 -1.108 0 CA-C-O 121.352 0.596 . . . . 0.0 110.925 -178.689 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 8.0 m-80 -91.92 1.64 57.05 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-O 121.107 0.48 . . . . 0.0 109.97 -178.793 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . 0.615 ' O ' ' HB2' ' A' ' 44' ' ' LEU . 7.6 m170 -81.02 146.75 30.5 Favored 'General case' 0 CA--C 1.498 -1.033 0 N-CA-C 109.778 -0.453 . . . . 0.0 109.778 -179.381 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.408 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 80.5 p -122.13 155.69 60.98 Favored Pre-proline 0 C--N 1.303 -1.44 0 C-N-CA 121.086 -0.245 . . . . 0.0 111.072 178.897 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_exo -60.79 -36.91 82.02 Favored 'Trans proline' 0 N--CA 1.46 -0.46 0 C-N-CA 122.385 2.056 . . . . 0.0 111.086 178.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . 0.475 ' HG2' ' O ' ' A' ' 40' ' ' MET . 16.4 ptmt -67.47 -38.92 85.13 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.848 -0.614 . . . . 0.0 111.376 -179.306 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -77.96 -32.71 51.58 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.602 -178.317 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.437 HD22 ' CG ' ' A' ' 75' ' ' HIS . 5.5 mt -83.16 0.92 43.05 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.137 0.494 . . . . 0.0 110.733 179.27 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 72.86 44.45 37.66 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 121.158 -0.544 . . . . 0.0 112.975 176.746 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 62.9 mtt -102.52 166.33 10.59 Favored 'General case' 0 C--N 1.313 -0.998 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 179.285 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . 0.411 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 11.3 pt-20 -140.8 -171.28 3.21 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-O 120.717 0.294 . . . . 0.0 110.65 178.829 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -69.15 126.91 31.27 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-O 121.687 0.756 . . . . 0.0 111.698 -177.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . 0.402 ' HG3' ' HE3' ' A' ' 23' ' ' LYS . 44.0 mt-10 76.2 13.34 2.61 Favored 'General case' 0 C--N 1.316 -0.859 0 C-N-CA 124.745 1.218 . . . . 0.0 111.498 178.03 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . 0.411 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 4.3 t0 -59.43 162.05 5.19 Favored 'General case' 0 C--O 1.239 0.549 0 CA-C-N 115.456 -0.793 . . . . 0.0 109.842 173.965 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 12.1 p -125.78 143.76 38.22 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.467 0 CA-C-O 121.342 0.591 . . . . 0.0 111.086 -176.415 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 3.8 mp -113.4 153.26 14.98 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.994 0 N-CA-C 109.087 -0.708 . . . . 0.0 109.087 179.207 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -105.72 138.7 41.47 Favored 'General case' 0 C--N 1.314 -0.946 0 CA-C-O 120.992 0.425 . . . . 0.0 109.932 -176.652 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . 0.525 ' HB ' ' HA2' ' A' ' 28' ' ' GLY . 91.4 t -131.04 134.73 61.14 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.066 0 CA-C-O 121.382 0.611 . . . . 0.0 110.733 179.394 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 92.0 m-85 -121.87 -178.92 3.97 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-N 115.913 -0.585 . . . . 0.0 109.511 179.543 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 8.1 tp60 -103.32 144.94 30.7 Favored 'General case' 0 C--N 1.307 -1.275 0 N-CA-C 109.747 -0.464 . . . . 0.0 109.747 179.135 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . 0.5 ' HB3' ' CG ' ' A' ' 63' ' ' ARG . 10.1 pt-20 -135.31 21.14 3.41 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.322 0.582 . . . . 0.0 110.684 176.12 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 80.8 mt-30 -60.77 -169.29 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.449 0 CA-C-N 115.595 -0.73 . . . . 0.0 111.209 176.048 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 13.4 t -158.19 166.76 31.62 Favored 'General case' 0 C--N 1.313 -1.004 0 O-C-N 121.685 -0.634 . . . . 0.0 109.86 -176.297 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -146.46 130.47 3.68 Favored Glycine 0 N--CA 1.438 -1.167 0 N-CA-C 111.409 -0.676 . . . . 0.0 111.409 179.774 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.44 -1.096 0 CA-C-O 118.507 -1.163 . . . . 0.0 111.425 179.667 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 67.5 mtt . . . . . 0 N--CA 1.479 0.992 0 CA-C-O 120.952 0.406 . . . . 0.0 111.117 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 39.6 m -134.43 -11.29 2.46 Favored 'General case' 0 CA--C 1.543 0.675 0 CA-C-O 120.916 0.388 . . . . 0.0 111.682 -178.529 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 28.3 m-20 -98.43 17.05 19.82 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-O 121.415 0.626 . . . . 0.0 110.424 -179.417 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 9.3 pt20 -73.47 4.43 4.83 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.768 -0.651 . . . . 0.0 112.198 -179.664 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 23.3 tt0 -64.16 160.71 17.78 Favored 'General case' 0 N--CA 1.437 -1.11 0 CA-C-O 121.448 0.642 . . . . 0.0 110.522 178.764 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -141.05 169.28 17.91 Favored 'General case' 0 C--N 1.303 -1.456 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 179.717 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.432 ' HD2' ' N ' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -135.37 150.55 72.78 Favored Pre-proline 0 C--N 1.299 -1.616 0 CA-C-N 116.693 -0.23 . . . . 0.0 110.476 -178.652 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -68.76 -162.75 0.08 OUTLIER 'Trans proline' 0 CA--C 1.532 0.398 0 C-N-CA 122.808 2.339 . . . . 0.0 112.12 179.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 44.1 m -128.08 86.17 2.44 Favored 'General case' 0 C--N 1.31 -1.137 0 O-C-N 121.723 -0.611 . . . . 0.0 110.449 -179.116 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 38.4 m -131.41 -42.15 1.07 Allowed 'General case' 0 C--N 1.314 -0.947 0 N-CA-C 109.386 -0.598 . . . . 0.0 109.386 178.258 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -63.32 154.86 30.41 Favored 'General case' 0 C--O 1.238 0.496 0 N-CA-C 108.632 -0.877 . . . . 0.0 108.632 175.753 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -75.58 77.42 2.59 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.781 0.8 . . . . 0.0 111.757 -177.352 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 81.3 mt -63.5 -62.61 1.56 Allowed 'General case' 0 C--N 1.307 -1.247 0 CA-C-N 114.68 -1.146 . . . . 0.0 109.803 177.116 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 155.89 -46.14 0.52 Allowed Glycine 0 CA--C 1.498 -1.006 0 N-CA-C 110.723 -0.951 . . . . 0.0 110.723 177.823 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -71.24 121.33 18.22 Favored 'General case' 0 C--N 1.312 -1.023 0 N-CA-C 109.398 -0.593 . . . . 0.0 109.398 177.812 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 57.8 mttp -129.04 161.51 29.81 Favored 'General case' 0 C--N 1.313 -1.02 0 CA-C-O 120.979 0.418 . . . . 0.0 110.901 -176.83 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 24.4 mtpp -132.05 173.83 10.82 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.593 178.674 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -156.66 163.38 39.38 Favored 'General case' 0 N--CA 1.439 -0.99 0 CA-C-O 121.133 0.492 . . . . 0.0 111.097 179.273 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 102.37 130.98 7.18 Favored Glycine 0 N--CA 1.442 -0.953 0 CA-C-N 116.033 -0.53 . . . . 0.0 112.436 179.973 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.471 ' O ' ' HG3' ' A' ' 39' ' ' LYS . 25.4 tt0 67.35 22.37 9.53 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 123.701 0.8 . . . . 0.0 112.108 177.271 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 43.7 p90 -113.36 162.97 15.45 Favored 'General case' 0 C--N 1.321 -0.663 0 O-C-N 121.669 -0.645 . . . . 0.0 110.514 178.479 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 28.2 pt -121.5 172.01 9.31 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.236 0 CA-C-O 121.325 0.583 . . . . 0.0 110.365 178.785 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 1.5 mppt? -119.12 145.41 45.98 Favored 'General case' 0 C--N 1.298 -1.638 0 N-CA-C 108.744 -0.835 . . . . 0.0 108.744 -179.356 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.4 mp -138.36 164.59 28.92 Favored 'General case' 0 C--N 1.303 -1.444 0 CA-C-O 121.332 0.587 . . . . 0.0 111.089 176.19 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.428 ' HE2' ' HB3' ' A' ' 25' ' ' LYS . 5.5 tmmm? -133.26 143.02 48.82 Favored 'General case' 0 N--CA 1.434 -1.228 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.358 -178.965 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . 0.526 ' O ' ' HA ' ' A' ' 33' ' ' GLU . 0.9 OUTLIER -114.4 142.68 26.24 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.377 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.039 -179.261 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 46.5 mm -105.04 115.16 46.37 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.028 0 N-CA-C 107.505 -1.295 . . . . 0.0 107.505 175.042 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . 0.415 ' HA2' ' HB ' ' A' ' 90' ' ' VAL . . . -82.77 166.9 45.54 Favored Glycine 0 N--CA 1.42 -2.37 0 C-N-CA 120.202 -0.999 . . . . 0.0 111.748 -176.58 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.38 -23.07 65.53 Favored 'General case' 0 C--N 1.305 -1.343 0 CA-C-O 121.527 0.68 . . . . 0.0 111.023 178.395 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -103.4 15.36 29.26 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.429 0.633 . . . . 0.0 109.493 178.704 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 29.2 t 73.12 16.85 4.2 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 123.771 0.828 . . . . 0.0 111.139 179.526 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 12.5 t -73.45 111.57 8.71 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 116.154 -0.476 . . . . 0.0 109.822 179.477 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.526 ' HA ' ' O ' ' A' ' 26' ' ' VAL . 43.9 mt-10 -88.37 108.64 19.45 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 121.376 0.607 . . . . 0.0 110.701 179.768 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 27.0 mm -98.37 137.22 26.51 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.269 0 N-CA-C 109.233 -0.654 . . . . 0.0 109.233 179.741 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 12.8 m170 -115.75 133.1 56.37 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 -179.846 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 1.2 p90 -147.79 165.13 31.48 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-O 121.147 0.499 . . . . 0.0 111.552 -178.428 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 9.4 ptpp? -119.91 125.23 47.94 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.173 0.511 . . . . 0.0 110.94 179.713 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 33.9 m -140.56 154.94 22.45 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 178.773 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.471 ' HG3' ' O ' ' A' ' 20' ' ' GLU . 83.9 tttt -87.87 162.81 16.73 Favored 'General case' 0 C--N 1.306 -1.29 0 O-C-N 121.796 -0.565 . . . . 0.0 111.442 -178.02 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -78.45 15.26 1.02 Allowed 'General case' 0 N--CA 1.479 1.018 0 O-C-N 121.856 -0.527 . . . . 0.0 112.25 -177.03 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 14.4 t -138.66 3.34 2.28 Favored 'General case' 0 C--N 1.308 -1.236 0 CA-C-O 121.23 0.538 . . . . 0.0 110.784 -177.162 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' THR . . . . . 0.431 HG23 ' O ' ' A' ' 39' ' ' LYS . 7.3 t -96.84 166.22 11.73 Favored 'General case' 0 N--CA 1.44 -0.97 0 CA-C-O 120.913 0.387 . . . . 0.0 110.357 -175.355 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 63.4 m170 -84.63 144.12 28.81 Favored 'General case' 0 C--N 1.314 -0.974 0 CA-C-O 121.498 0.666 . . . . 0.0 111.276 -178.896 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.546 ' O ' ' HG2' ' A' ' 48' ' ' LYS . 0.9 OUTLIER -65.7 -15.0 62.39 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.423 -0.808 . . . . 0.0 111.129 178.975 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.673 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -52.07 -48.37 64.71 Favored 'General case' 0 C--O 1.222 -0.391 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.803 -179.481 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 20.5 ptmt -67.03 -31.65 72.33 Favored 'General case' 0 C--O 1.208 -1.117 0 CA-C-O 120.894 0.378 . . . . 0.0 110.892 -179.943 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 8.6 tt -71.19 -49.97 38.02 Favored 'General case' 0 C--N 1.307 -1.241 0 CA-C-O 121.021 0.438 . . . . 0.0 110.766 -178.834 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.546 ' HG2' ' O ' ' A' ' 44' ' ' LEU . 6.1 ptmm? -62.41 -41.16 98.47 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.657 -178.207 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.673 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 8.7 pt-20 -72.04 -34.2 68.59 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-O 121.09 0.472 . . . . 0.0 110.417 178.072 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 5.4 m -65.06 -43.53 91.97 Favored 'General case' 0 C--O 1.234 0.262 0 N-CA-C 112.296 0.48 . . . . 0.0 112.296 -178.118 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.473 ' CD1' HG12 ' A' ' 26' ' ' VAL . 2.1 p90 -76.03 -33.38 59.63 Favored 'General case' 0 N--CA 1.444 -0.767 0 C-N-CA 119.326 -0.95 . . . . 0.0 110.189 -178.951 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . 0.5 ' SG ' HD12 ' A' ' 62' ' ' LEU . 91.6 m -62.42 -44.91 95.31 Favored 'General case' 0 CA--C 1.511 -0.544 0 CA-C-O 121.199 0.523 . . . . 0.0 110.611 179.556 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 13.2 pt20 -67.35 -34.79 78.04 Favored 'General case' 0 N--CA 1.443 -0.78 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.533 -179.032 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 2.3 mmp_? -56.3 -43.06 78.52 Favored 'General case' 0 C--N 1.346 0.427 0 CA-C-O 121.045 0.45 . . . . 0.0 111.232 177.331 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.406 HE21 ' HB2' ' A' ' 55' ' ' GLN . 2.9 mt-30 -73.86 -21.46 60.1 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.127 0.489 . . . . 0.0 110.931 179.631 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 84.68 28.12 33.19 Favored Glycine 0 N--CA 1.444 -0.769 0 C-N-CA 120.814 -0.707 . . . . 0.0 112.247 179.501 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 31.4 m -128.83 150.2 74.36 Favored Pre-proline 0 C--N 1.327 -0.405 0 O-C-N 122.418 -0.46 . . . . 0.0 110.753 -178.706 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . 0.466 ' HG2' ' OG ' ' A' ' 61' ' ' SER . 28.8 Cg_endo -65.39 153.96 75.83 Favored 'Trans proline' 0 N--CA 1.456 -0.715 0 C-N-CA 122.216 1.944 . . . . 0.0 111.5 177.115 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.454 ' HG2' ' SG ' ' A' ' 52' ' ' CYS . 77.3 mtp -74.97 -8.63 57.07 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.437 -176.201 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 24.2 p30 -90.55 -12.13 38.03 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-O 121.102 0.477 . . . . 0.0 111.596 -178.225 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.466 ' OG ' ' HG2' ' A' ' 58' ' ' PRO . 64.3 m -83.95 -21.08 31.93 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-O 121.24 0.543 . . . . 0.0 111.275 -179.234 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.5 HD12 ' SG ' ' A' ' 52' ' ' CYS . 1.2 pp -129.9 173.04 11.06 Favored 'General case' 0 C--N 1.309 -1.179 0 CA-C-O 121.479 0.657 . . . . 0.0 112.667 -176.932 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.435 ' HG3' ' HB2' ' A' ' 91' ' ' TYR . 1.1 ptp180 -129.35 132.64 47.12 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 115.53 -0.759 . . . . 0.0 111.741 -179.659 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.463 ' CZ ' ' HE2' ' A' ' 48' ' ' LYS . 0.1 OUTLIER -107.66 120.29 41.82 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-N 115.187 -0.915 . . . . 0.0 110.758 -177.662 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.469 ' C ' HD23 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -145.51 163.91 33.24 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-O 121.491 0.662 . . . . 0.0 111.173 179.72 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 80.3 t80 -146.29 135.59 22.84 Favored 'General case' 0 C--N 1.307 -1.267 0 N-CA-C 109.199 -0.667 . . . . 0.0 109.199 178.503 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 49.89 28.57 2.89 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 124.126 0.971 . . . . 0.0 112.387 179.525 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 85.03 22.69 51.83 Favored Glycine 0 N--CA 1.445 -0.742 0 C-N-CA 121.146 -0.55 . . . . 0.0 112.96 179.596 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 2.6 pt20 -130.15 134.41 47.3 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 179.085 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 1.3 ppt_? -71.98 148.39 45.98 Favored 'General case' 0 C--N 1.31 -1.142 0 CA-C-O 121.298 0.57 . . . . 0.0 110.252 178.303 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 23.4 mm -95.39 123.23 47.46 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.226 0 O-C-N 121.919 -0.488 . . . . 0.0 110.901 -177.757 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -99.46 164.56 12.05 Favored 'General case' 0 N--CA 1.447 -0.596 0 N-CA-C 110.168 -0.308 . . . . 0.0 110.168 179.704 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 31.7 m-20 -64.87 -28.06 69.29 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.239 0.542 . . . . 0.0 111.015 -179.298 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 3.3 m-80 -96.12 5.59 50.75 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 121.097 0.475 . . . . 0.0 110.06 -177.373 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . 0.479 ' CG ' HD22 ' A' ' 80' ' ' LEU . 3.4 m170 -83.17 140.52 32.53 Favored 'General case' 0 CA--C 1.502 -0.896 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 179.788 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.417 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 59.9 p -119.08 155.7 53.0 Favored Pre-proline 0 C--N 1.306 -1.311 0 C-N-CA 120.985 -0.286 . . . . 0.0 110.936 179.469 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_exo -61.82 -37.87 63.73 Favored 'Trans proline' 0 N--CA 1.46 -0.461 0 C-N-CA 122.465 2.11 . . . . 0.0 111.341 179.808 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . 0.473 ' HG3' ' N ' ' A' ' 79' ' ' GLU . 34.1 pttt -68.04 -36.01 79.19 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.621 -179.344 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.473 ' N ' ' HG3' ' A' ' 78' ' ' LYS . 11.2 mm-40 -74.01 -42.5 60.25 Favored 'General case' 0 CA--C 1.512 -0.511 0 CA-C-O 121.18 0.514 . . . . 0.0 111.01 -179.576 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.479 HD22 ' CG ' ' A' ' 75' ' ' HIS . 5.7 mt -76.19 -6.45 51.35 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.037 0.446 . . . . 0.0 111.237 -178.246 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 80.57 46.9 7.08 Favored Glycine 0 N--CA 1.447 -0.575 0 C-N-CA 120.862 -0.685 . . . . 0.0 112.744 177.885 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 59.3 mtt -106.64 164.32 12.18 Favored 'General case' 0 C--N 1.314 -0.942 0 O-C-N 122.51 -0.406 . . . . 0.0 109.982 178.437 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -138.18 -169.35 2.55 Favored 'General case' 0 C--N 1.313 -0.987 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 178.256 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.452 ' O ' ' HB2' ' A' ' 85' ' ' GLU . 11.5 pt-20 -78.44 134.32 37.38 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-O 121.545 0.688 . . . . 0.0 111.719 -178.893 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . 0.452 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 37.7 mt-10 78.97 8.22 1.97 Allowed 'General case' 0 C--N 1.325 -0.468 0 C-N-CA 125.104 1.361 . . . . 0.0 111.539 -179.426 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 4.6 t0 -63.26 166.52 6.15 Favored 'General case' 0 C--O 1.239 0.539 0 CA-C-N 115.734 -0.667 . . . . 0.0 110.472 175.687 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . 0.424 ' HA ' ' O ' ' A' ' 25' ' ' LYS . 8.3 p -129.08 143.63 40.65 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.076 0 CA-C-O 121.358 0.599 . . . . 0.0 111.654 -176.754 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 3.5 mp -113.58 154.87 14.9 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 179.18 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 11.0 tp10 -107.88 138.9 43.32 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-O 121.032 0.444 . . . . 0.0 110.686 -176.262 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . 0.415 ' HB ' ' HA2' ' A' ' 28' ' ' GLY . 97.6 t -129.92 135.29 61.44 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.92 0 CA-C-O 121.362 0.601 . . . . 0.0 110.883 178.872 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . 0.435 ' HB2' ' HG3' ' A' ' 63' ' ' ARG . 81.2 m-85 -121.78 173.91 7.18 Favored 'General case' 0 C--N 1.31 -1.147 0 CA-C-N 116.115 -0.493 . . . . 0.0 109.915 178.856 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 9.5 tp60 -101.09 148.83 24.61 Favored 'General case' 0 C--N 1.306 -1.315 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 179.903 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -143.34 21.14 1.89 Allowed 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.075 0.464 . . . . 0.0 110.998 177.419 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 97.6 mt-30 -54.35 -174.1 0.0 OUTLIER 'General case' 0 CA--C 1.54 0.592 0 CA-C-O 121.511 0.672 . . . . 0.0 112.576 177.19 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 5.3 t -86.37 -33.72 20.43 Favored 'General case' 0 C--N 1.314 -0.971 0 O-C-N 121.492 -0.755 . . . . 0.0 111.423 -172.319 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 141.72 -56.69 0.58 Allowed Glycine 0 N--CA 1.445 -0.74 0 C-N-CA 120.649 -0.786 . . . . 0.0 112.265 178.622 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.441 -0.976 0 CA-C-O 118.303 -1.276 . . . . 0.0 111.406 179.715 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 71.7 mtm . . . . . 0 N--CA 1.471 0.604 0 N-CA-C 111.876 0.324 . . . . 0.0 111.876 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 49.4 m -104.98 -71.97 0.72 Allowed 'General case' 0 C--N 1.331 -0.204 0 O-C-N 121.57 -0.706 . . . . 0.0 112.557 -178.206 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -114.29 22.35 13.83 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.581 0.705 . . . . 0.0 111.201 -175.036 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -100.07 3.5 44.09 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-O 122.023 0.916 . . . . 0.0 109.759 -179.0 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -145.5 156.75 43.91 Favored 'General case' 0 C--N 1.298 -1.642 0 CA-C-N 114.781 -1.099 . . . . 0.0 110.205 -177.887 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -146.05 161.21 40.64 Favored 'General case' 0 C--N 1.314 -0.944 0 N-CA-C 110.073 -0.343 . . . . 0.0 110.073 179.245 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 20.5 ptmt -151.98 154.86 33.17 Favored Pre-proline 0 C--N 1.318 -0.778 0 N-CA-C 110.002 -0.37 . . . . 0.0 110.002 -179.57 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -58.58 122.71 12.11 Favored 'Trans proline' 0 C--O 1.241 0.656 0 C-N-CA 122.77 2.314 . . . . 0.0 111.599 179.985 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 45.3 t -148.3 159.23 44.2 Favored 'General case' 0 N--CA 1.436 -1.153 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 -178.037 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 10.7 t -86.45 -7.73 58.18 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 121.459 0.647 . . . . 0.0 109.664 178.155 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 29.4 mt-10 -139.04 138.28 37.03 Favored 'General case' 0 CA--C 1.503 -0.834 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.768 178.687 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 -79.79 134.84 36.37 Favored 'General case' 0 C--N 1.311 -1.082 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.48 -179.86 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 72.0 mt -105.6 159.42 15.97 Favored 'General case' 0 C--N 1.308 -1.198 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.1 -178.965 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 151.37 49.86 0.02 OUTLIER Glycine 0 C--N 1.312 -0.767 0 N-CA-C 110.489 -1.044 . . . . 0.0 110.489 -177.667 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -73.9 131.19 41.22 Favored 'General case' 0 C--N 1.319 -0.74 0 C-N-CA 122.852 0.461 . . . . 0.0 111.296 -177.108 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 45.7 mtmt -134.93 169.38 17.49 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.077 -178.464 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 21.7 ptmt -75.23 159.53 31.44 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.083 0.468 . . . . 0.0 110.705 179.509 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 34.2 mt-10 -113.23 -178.86 3.48 Favored 'General case' 0 C--N 1.309 -1.165 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.568 178.715 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.411 ' H ' ' HD1' ' A' ' 21' ' ' TYR . . . 143.69 119.05 1.34 Allowed Glycine 0 N--CA 1.448 -0.505 0 N-CA-C 111.864 -0.495 . . . . 0.0 111.864 179.677 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 68.23 48.08 0.94 Allowed 'General case' 0 N--CA 1.476 0.841 0 CA-C-O 121.701 0.763 . . . . 0.0 109.462 179.135 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.496 ' CE2' ' HD2' ' A' ' 37' ' ' LYS . 47.2 p90 -122.41 158.92 28.65 Favored 'General case' 0 C--N 1.313 -1.013 0 CA-C-O 121.683 0.754 . . . . 0.0 111.796 -175.255 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . 0.457 ' HB ' ' HA ' ' A' ' 84' ' ' GLU . 23.9 pt -116.59 172.29 4.78 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.25 0 CA-C-N 115.294 -0.867 . . . . 0.0 109.206 176.442 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.437 ' HG2' ' HG2' ' A' ' 37' ' ' LYS . 34.6 mtmt -110.66 148.85 31.39 Favored 'General case' 0 C--N 1.298 -1.635 0 N-CA-C 109.75 -0.463 . . . . 0.0 109.75 179.739 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.6 mp -140.53 154.22 46.47 Favored 'General case' 0 C--N 1.3 -1.58 0 CA-C-O 121.345 0.593 . . . . 0.0 110.664 171.916 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.468 ' O ' ' HA ' ' A' ' 87' ' ' VAL . 5.4 tmmm? -128.41 143.84 51.05 Favored 'General case' 0 C--N 1.308 -1.212 0 CA-C-O 121.376 0.608 . . . . 0.0 110.334 -178.546 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . 0.496 ' O ' ' HA ' ' A' ' 33' ' ' GLU . 0.9 OUTLIER -115.96 140.16 39.18 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.494 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.249 -179.132 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 46.8 mm -103.81 112.12 36.09 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.28 0 N-CA-C 107.194 -1.41 . . . . 0.0 107.194 174.496 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . 0.471 ' HA2' ' HB ' ' A' ' 90' ' ' VAL . . . -80.87 166.58 48.94 Favored Glycine 0 N--CA 1.428 -1.89 0 C-N-CA 120.181 -1.009 . . . . 0.0 111.493 -176.92 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.92 -20.07 64.83 Favored 'General case' 0 C--N 1.314 -0.978 0 CA-C-O 121.567 0.699 . . . . 0.0 110.902 177.481 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -97.16 12.97 30.87 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 121.685 0.755 . . . . 0.0 109.568 177.653 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 21.7 m 69.81 14.64 8.02 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.744 -179.055 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 7.9 t -72.79 116.93 13.87 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.533 -179.215 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.496 ' HA ' ' O ' ' A' ' 26' ' ' VAL . 41.7 mt-10 -89.44 106.33 18.38 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.214 0.531 . . . . 0.0 110.791 178.333 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 29.5 mm -96.44 136.11 28.36 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.426 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 178.574 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 12.5 m170 -115.62 131.35 56.96 Favored 'General case' 0 C--N 1.321 -0.674 0 N-CA-C 109.783 -0.451 . . . . 0.0 109.783 -178.373 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 2.1 p90 -147.2 149.09 32.26 Favored 'General case' 0 C--N 1.309 -1.163 0 CA-C-O 121.33 0.586 . . . . 0.0 111.379 -179.311 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.496 ' HD2' ' CE2' ' A' ' 21' ' ' TYR . 38.1 mtmt -110.03 123.3 49.43 Favored 'General case' 0 C--N 1.313 -0.979 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.418 178.774 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 22.5 m -141.33 165.19 19.19 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.96 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 179.816 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.437 ' O ' HG23 ' A' ' 42' ' ' THR . 48.0 mtpt -84.81 176.71 8.34 Favored 'General case' 0 C--N 1.308 -1.237 0 CA-C-O 121.566 0.698 . . . . 0.0 111.517 179.854 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.38 -33.99 20.34 Favored 'General case' 0 C--N 1.307 -1.27 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.25 178.672 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 9.0 t -94.06 25.32 3.78 Favored 'General case' 0 N--CA 1.444 -0.732 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.24 -177.765 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' THR . . . . . 0.437 HG23 ' O ' ' A' ' 39' ' ' LYS . 7.0 t -108.08 172.6 6.74 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 109.711 -0.477 . . . . 0.0 109.711 178.85 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . 0.41 ' O ' ' HG3' ' A' ' 46' ' ' LYS . 47.8 m170 -92.92 143.89 25.8 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-O 121.501 0.667 . . . . 0.0 111.479 -179.618 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.534 ' HB2' ' O ' ' A' ' 75' ' ' HIS . 0.7 OUTLIER -68.13 -17.3 64.32 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.564 178.469 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.496 ' HA ' ' HD3' ' A' ' 48' ' ' LYS . 0.0 OUTLIER -54.82 -44.94 74.3 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.883 -179.361 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.597 ' HZ2' ' HB2' ' A' ' 46' ' ' LYS . 0.0 OUTLIER -74.0 -26.12 60.27 Favored 'General case' 0 N--CA 1.439 -1.009 0 CA-C-O 121.296 0.57 . . . . 0.0 110.493 -179.176 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.418 ' C ' HD21 ' A' ' 47' ' ' LEU . 8.7 tt -72.96 -52.03 16.09 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.605 178.464 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.496 ' HD3' ' HA ' ' A' ' 45' ' ' LYS . 6.1 ptmm? -59.7 -41.04 89.88 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.98 0.419 . . . . 0.0 111.557 -178.695 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.47 -31.12 65.16 Favored 'General case' 0 C--N 1.318 -0.779 0 C-N-CA 120.437 -0.505 . . . . 0.0 110.564 178.247 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' SER . . . . . 0.559 ' HB2' ' O ' ' A' ' 46' ' ' LYS . 8.6 t -66.23 -42.89 88.04 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.481 -178.398 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.45 ' CD2' ' HA ' ' A' ' 48' ' ' LYS . 3.4 p90 -76.51 -32.85 58.55 Favored 'General case' 0 N--CA 1.446 -0.625 0 C-N-CA 119.672 -0.811 . . . . 0.0 110.502 -179.473 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . 0.454 ' HA ' ' NE2' ' A' ' 55' ' ' GLN . 90.8 m -63.77 -45.03 91.65 Favored 'General case' 0 CA--C 1.509 -0.625 0 CA-C-O 121.229 0.537 . . . . 0.0 110.291 179.07 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . 0.412 ' HG2' ' O ' ' A' ' 50' ' ' SER . 13.8 pt20 -66.46 -33.96 76.88 Favored 'General case' 0 N--CA 1.444 -0.734 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.319 -178.987 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 2.2 mmp_? -56.05 -39.16 71.6 Favored 'General case' 0 C--N 1.349 0.571 0 CA-C-O 121.244 0.545 . . . . 0.0 111.08 176.204 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.454 ' NE2' ' HA ' ' A' ' 52' ' ' CYS . 2.7 mt-30 -82.32 -22.07 35.78 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.363 -178.482 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 83.6 29.54 32.32 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 120.43 -0.891 . . . . 0.0 111.721 179.736 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 21.0 m -129.11 149.9 73.89 Favored Pre-proline 0 C--O 1.238 0.495 0 O-C-N 122.519 -0.401 . . . . 0.0 110.692 -177.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . 0.489 ' HG2' ' OG ' ' A' ' 61' ' ' SER . 34.3 Cg_endo -65.78 149.71 86.6 Favored 'Trans proline' 0 C--O 1.238 0.483 0 C-N-CA 122.487 2.125 . . . . 0.0 112.383 178.445 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.442 ' HG2' ' SG ' ' A' ' 52' ' ' CYS . 73.4 mtp -74.25 -9.31 58.48 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.514 -177.28 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 2.0 p-10 -91.73 -8.32 47.26 Favored 'General case' 0 C--N 1.311 -1.068 0 CA-C-O 121.142 0.496 . . . . 0.0 111.266 -179.09 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.489 ' OG ' ' HG2' ' A' ' 58' ' ' PRO . 71.0 m -91.76 -20.32 21.65 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 121.012 0.434 . . . . 0.0 111.946 -179.785 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.442 HD12 ' SG ' ' A' ' 52' ' ' CYS . 1.9 pp -130.4 155.21 46.78 Favored 'General case' 0 C--N 1.315 -0.931 0 N-CA-C 112.629 0.603 . . . . 0.0 112.629 -179.229 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.549 ' O ' ' HA ' ' A' ' 90' ' ' VAL . 40.2 mtm-85 -105.79 130.23 53.82 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.576 -177.943 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -107.12 116.12 31.37 Favored 'General case' 0 C--N 1.309 -1.191 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.458 178.131 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.462 ' C ' HD21 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -141.89 163.2 33.54 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 121.464 0.65 . . . . 0.0 111.353 179.704 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 90.5 t80 -145.07 138.04 26.41 Favored 'General case' 0 C--N 1.308 -1.218 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 179.602 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 49.86 26.76 2.06 Favored 'General case' 0 N--CA 1.485 1.314 0 C-N-CA 123.997 0.919 . . . . 0.0 112.118 -179.261 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 82.66 23.11 56.94 Favored Glycine 0 CA--C 1.522 0.512 0 C-N-CA 120.525 -0.845 . . . . 0.0 113.087 -177.618 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 2.6 pt20 -129.57 134.36 47.69 Favored 'General case' 0 C--N 1.319 -0.735 0 O-C-N 122.177 -0.601 . . . . 0.0 109.471 179.797 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -68.31 143.59 55.14 Favored 'General case' 0 C--N 1.307 -1.278 0 CA-C-O 121.53 0.681 . . . . 0.0 110.612 176.662 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 25.1 mm -90.26 122.94 42.18 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.468 0 CA-C-O 121.055 0.455 . . . . 0.0 110.866 -178.148 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.406 ' O ' ' HB2' ' A' ' 75' ' ' HIS . . . -96.04 163.12 13.26 Favored 'General case' 0 N--CA 1.436 -1.153 0 N-CA-C 109.701 -0.481 . . . . 0.0 109.701 178.8 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . 0.411 ' HB3' ' HB3' ' A' ' 45' ' ' LYS . 36.5 m-20 -68.53 -24.07 64.6 Favored 'General case' 0 C--N 1.31 -1.113 0 CA-C-O 121.645 0.736 . . . . 0.0 110.547 -179.644 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 12.0 m-80 -97.4 8.45 44.56 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.725 -0.67 . . . . 0.0 109.956 -178.984 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . 0.534 ' O ' ' HB2' ' A' ' 44' ' ' LEU . 4.5 m170 -85.91 140.57 30.25 Favored 'General case' 0 CA--C 1.502 -0.887 0 CA-C-N 115.982 -0.554 . . . . 0.0 109.568 179.426 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 81.9 p -117.83 155.34 50.98 Favored Pre-proline 0 C--N 1.306 -1.317 0 C-N-CA 120.945 -0.302 . . . . 0.0 111.343 179.237 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -59.94 -40.97 57.47 Favored 'Trans proline' 0 C--N 1.347 0.453 0 C-N-CA 122.756 2.304 . . . . 0.0 111.625 179.517 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . 0.488 ' HG3' ' N ' ' A' ' 79' ' ' GLU . 35.2 pttt -67.04 -37.21 83.7 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.204 0.525 . . . . 0.0 110.813 -178.775 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.488 ' N ' ' HG3' ' A' ' 78' ' ' LYS . 23.6 mm-40 -72.3 -41.82 66.19 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-O 121.007 0.432 . . . . 0.0 111.051 -179.128 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.447 HD22 ' CG ' ' A' ' 75' ' ' HIS . 4.6 mt -77.21 -9.1 58.57 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.068 0.461 . . . . 0.0 111.123 -178.885 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 82.42 44.05 7.62 Favored Glycine 0 C--O 1.237 0.323 0 C-N-CA 120.739 -0.743 . . . . 0.0 113.004 178.121 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 55.3 mtt -103.62 162.71 12.83 Favored 'General case' 0 C--N 1.317 -0.843 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 178.414 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -143.45 -165.43 2.09 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 121.06 0.457 . . . . 0.0 111.017 178.934 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.457 ' HA ' ' HB ' ' A' ' 22' ' ' ILE . 9.0 pt-20 -68.55 117.41 10.26 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-O 121.737 0.779 . . . . 0.0 112.743 -177.454 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 11.3 tt0 82.07 14.46 0.51 Allowed 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 125.435 1.494 . . . . 0.0 110.944 175.851 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -62.44 166.57 5.01 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-N 115.54 -0.755 . . . . 0.0 110.445 176.423 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . 0.468 ' HA ' ' O ' ' A' ' 25' ' ' LYS . 10.4 p -126.9 146.02 33.51 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.072 0 CA-C-O 121.451 0.643 . . . . 0.0 111.897 -175.925 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 3.6 mp -116.05 153.76 17.63 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.752 0 N-CA-C 108.764 -0.828 . . . . 0.0 108.764 177.507 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 13.5 tp10 -106.15 137.9 43.28 Favored 'General case' 0 C--N 1.319 -0.723 0 O-C-N 122.073 -0.392 . . . . 0.0 110.83 -176.822 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . 0.549 ' HA ' ' O ' ' A' ' 63' ' ' ARG . 95.2 t -127.31 131.8 70.13 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-O 121.251 0.548 . . . . 0.0 111.553 178.85 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 63.9 m-85 -116.13 174.95 5.77 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.101 -0.5 . . . . 0.0 109.829 179.461 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 10.2 tp60 -103.06 128.17 50.04 Favored 'General case' 0 C--N 1.312 -1.038 0 N-CA-C 110.058 -0.349 . . . . 0.0 110.058 178.047 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . 0.428 ' HB3' ' CG ' ' A' ' 63' ' ' ARG . 11.6 pt-20 -119.7 19.44 12.53 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.151 0.5 . . . . 0.0 110.9 177.904 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 97.3 mt-30 -57.94 -169.45 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.586 0 CA-C-O 121.445 0.641 . . . . 0.0 111.615 176.263 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 9.9 t -157.22 164.94 37.19 Favored 'General case' 0 N--CA 1.437 -1.112 0 O-C-N 121.521 -0.737 . . . . 0.0 110.105 -175.355 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -95.23 -168.12 35.86 Favored Glycine 0 N--CA 1.437 -1.266 0 C-N-CA 121.027 -0.606 . . . . 0.0 111.828 -179.687 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.436 -1.35 0 CA-C-O 118.123 -1.376 . . . . 0.0 110.777 -179.494 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.424 ' SD ' ' N ' ' A' ' 1' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.48 1.069 0 N-CA-C 111.752 0.278 . . . . 0.0 111.752 . . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 10.8 m -94.36 -33.45 13.17 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.495 0.664 . . . . 0.0 111.112 -177.89 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -121.25 106.75 11.79 Favored 'General case' 0 N--CA 1.425 -1.688 0 N-CA-C 107.47 -1.307 . . . . 0.0 107.47 179.929 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 19.2 mm-40 -90.5 175.89 6.9 Favored 'General case' 0 C--N 1.283 -2.299 0 CA-C-N 115.086 -0.961 . . . . 0.0 110.832 -175.061 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -80.76 150.51 29.23 Favored 'General case' 0 N--CA 1.439 -1.024 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 178.784 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -146.14 149.91 34.89 Favored 'General case' 0 C--N 1.305 -1.342 0 CA-C-O 120.993 0.425 . . . . 0.0 109.906 -179.047 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 6.0 ptpp? -128.6 154.6 79.61 Favored Pre-proline 0 N--CA 1.43 -1.437 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 -179.332 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -55.57 -20.98 29.13 Favored 'Trans proline' 0 CA--C 1.539 0.737 0 C-N-CA 123.103 2.535 . . . . 0.0 113.722 -178.521 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 45.2 t -77.36 -26.39 51.9 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.464 0.649 . . . . 0.0 109.811 178.349 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 58.2 m -80.74 114.12 19.41 Favored 'General case' 0 N--CA 1.44 -0.962 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.459 179.606 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 3.7 tm-20 -78.41 112.05 15.04 Favored 'General case' 0 N--CA 1.439 -0.986 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 178.51 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -138.79 -171.26 3.04 Favored 'General case' 0 N--CA 1.437 -1.084 0 N-CA-C 107.558 -1.275 . . . . 0.0 107.558 -179.429 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 68.9 mt -102.87 169.25 8.71 Favored 'General case' 0 C--N 1.304 -1.372 0 O-C-N 121.515 -0.741 . . . . 0.0 111.44 -176.411 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 92.65 19.49 37.49 Favored Glycine 0 N--CA 1.439 -1.145 0 N-CA-C 110.683 -0.967 . . . . 0.0 110.683 -176.627 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -52.0 -26.76 11.41 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 124.021 0.928 . . . . 0.0 112.857 179.701 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.503 ' HD2' ' N ' ' A' ' 16' ' ' LYS . 0.1 OUTLIER -74.34 122.38 22.83 Favored 'General case' 0 C--N 1.297 -1.68 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 179.617 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 6.1 mmmm -131.22 135.79 47.68 Favored 'General case' 0 C--N 1.305 -1.363 0 CA-C-O 122.0 0.905 . . . . 0.0 113.28 -175.315 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -61.32 157.0 17.49 Favored 'General case' 0 C--N 1.307 -1.267 0 CA-C-N 114.387 -1.279 . . . . 0.0 111.487 174.133 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 127.25 -37.24 2.41 Favored Glycine 0 N--CA 1.444 -0.809 0 N-CA-C 111.135 -0.786 . . . . 0.0 111.135 -177.6 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.417 ' O ' ' HG3' ' A' ' 39' ' ' LYS . 49.3 mt-10 -120.17 47.54 1.74 Allowed 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 179.013 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.408 ' CD1' ' HB3' ' A' ' 37' ' ' LYS . 26.6 p90 -110.03 160.61 16.29 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-O 121.859 0.837 . . . . 0.0 113.071 -176.009 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 26.3 pt -109.15 173.21 2.0 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.098 0 CA-C-N 114.693 -1.139 . . . . 0.0 109.233 177.319 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 16.2 mtmt -113.66 142.81 45.56 Favored 'General case' 0 C--N 1.293 -1.869 0 N-CA-C 109.384 -0.599 . . . . 0.0 109.384 -178.174 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.6 mp -137.83 159.72 41.22 Favored 'General case' 0 C--N 1.302 -1.491 0 CA-C-O 121.216 0.531 . . . . 0.0 110.851 174.605 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.52 ' HG3' ' CD2' ' A' ' 35' ' ' HIS . 3.1 tmmt? -131.63 143.87 50.63 Favored 'General case' 0 N--CA 1.433 -1.299 0 CA-C-O 121.259 0.552 . . . . 0.0 110.638 -179.592 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . 0.525 HG12 ' CD1' ' A' ' 51' ' ' TYR . 0.9 OUTLIER -112.06 141.06 28.72 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.429 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.182 178.672 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.418 HD13 ' NZ ' ' A' ' 25' ' ' LYS . 41.6 mm -106.46 115.84 48.92 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.133 0 N-CA-C 107.641 -1.244 . . . . 0.0 107.641 175.214 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . 0.421 ' HA2' ' HB ' ' A' ' 90' ' ' VAL . . . -86.14 169.47 41.99 Favored Glycine 0 N--CA 1.416 -2.651 0 C-N-CA 120.302 -0.951 . . . . 0.0 111.689 -177.008 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.25 -22.15 66.84 Favored 'General case' 0 C--N 1.299 -1.604 0 CA-C-O 121.634 0.73 . . . . 0.0 110.579 178.671 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -102.25 14.63 31.45 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.506 -0.77 . . . . 0.0 109.44 -179.338 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 46.2 m 69.99 19.71 6.8 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 115.574 -0.739 . . . . 0.0 111.005 179.812 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 11.1 t -76.71 114.55 15.58 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.172 178.86 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.458 ' HA ' ' O ' ' A' ' 26' ' ' VAL . 24.1 mt-10 -90.01 113.44 25.12 Favored 'General case' 0 CA--C 1.502 -0.896 0 CA-C-O 121.159 0.504 . . . . 0.0 110.696 177.614 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 30.1 mm -102.59 130.07 53.14 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.909 0 N-CA-C 108.152 -1.055 . . . . 0.0 108.152 176.378 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . 0.52 ' CD2' ' HG3' ' A' ' 25' ' ' LYS . 11.0 m170 -117.55 116.25 26.73 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 -177.148 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -129.28 170.08 14.06 Favored 'General case' 0 C--N 1.304 -1.397 0 CA-C-O 121.18 0.514 . . . . 0.0 111.452 -175.254 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.408 ' HB3' ' CD1' ' A' ' 21' ' ' TYR . 61.1 mmtt -121.44 121.64 38.0 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 -178.798 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 33.0 m -139.84 156.13 25.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-O 120.93 0.395 . . . . 0.0 110.439 179.545 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.538 ' O ' HG23 ' A' ' 42' ' ' THR . 79.2 tttt -86.55 163.13 17.65 Favored 'General case' 0 C--N 1.314 -0.94 0 O-C-N 121.964 -0.46 . . . . 0.0 110.794 -178.732 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' MET . . . . . 0.481 ' O ' ' HG2' ' A' ' 78' ' ' LYS . 0.0 OUTLIER -71.89 -37.93 70.07 Favored 'General case' 0 CA--C 1.519 -0.238 0 N-CA-C 112.234 0.457 . . . . 0.0 112.234 -177.026 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 14.9 t -92.71 15.11 15.23 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-O 121.343 0.592 . . . . 0.0 111.608 -177.027 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' THR . . . . . 0.538 HG23 ' O ' ' A' ' 39' ' ' LYS . 2.3 t -96.48 169.74 9.7 Favored 'General case' 0 C--N 1.32 -0.684 0 O-C-N 121.485 -0.76 . . . . 0.0 110.224 -179.267 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 29.8 m170 -85.81 142.24 29.07 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-O 121.4 0.619 . . . . 0.0 111.163 179.535 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.603 ' O ' ' HG3' ' A' ' 48' ' ' LYS . 0.2 OUTLIER -69.21 -17.16 63.75 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.559 -0.746 . . . . 0.0 109.686 -179.115 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.646 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -53.88 -45.65 71.13 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-N 115.728 -0.669 . . . . 0.0 112.602 -177.9 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.517 ' O ' ' HB2' ' A' ' 50' ' ' SER . 0.1 OUTLIER -69.89 -25.02 63.49 Favored 'General case' 0 C--O 1.219 -0.536 0 CA-C-O 121.297 0.57 . . . . 0.0 110.795 -178.266 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.477 ' HB3' HD13 ' A' ' 44' ' ' LEU . 7.8 tt -73.4 -47.29 43.14 Favored 'General case' 0 C--N 1.312 -1.062 0 CA-C-N 115.927 -0.579 . . . . 0.0 109.776 177.282 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.603 ' HG3' ' O ' ' A' ' 44' ' ' LEU . 26.7 mtpt -57.81 -47.59 82.16 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.605 -179.277 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.646 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 5.0 pt-20 -69.97 -34.52 73.5 Favored 'General case' 0 C--N 1.313 -0.981 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.446 -179.058 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' SER . . . . . 0.517 ' HB2' ' O ' ' A' ' 46' ' ' LYS . 7.9 t -65.63 -43.88 88.17 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.351 -177.682 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.525 ' CD1' HG12 ' A' ' 26' ' ' VAL . 1.7 p90 -76.51 -33.7 58.62 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 119.727 -0.789 . . . . 0.0 110.531 -178.593 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . 0.485 ' SG ' HD11 ' A' ' 62' ' ' LEU . 98.6 m -62.54 -44.54 96.1 Favored 'General case' 0 C--O 1.239 0.545 0 CA-C-O 121.252 0.549 . . . . 0.0 110.657 179.327 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 14.0 pt20 -69.28 -33.78 73.73 Favored 'General case' 0 N--CA 1.442 -0.832 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.508 -179.228 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 2.1 mmp_? -57.47 -40.05 77.72 Favored 'General case' 0 C--N 1.349 0.569 0 CA-C-O 121.179 0.514 . . . . 0.0 111.377 177.625 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.4 HE21 ' HB2' ' A' ' 55' ' ' GLN . 3.3 mt-30 -78.1 -20.96 51.17 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.236 0.541 . . . . 0.0 110.964 -179.819 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 82.86 29.1 35.83 Favored Glycine 0 N--CA 1.445 -0.72 0 C-N-CA 120.896 -0.668 . . . . 0.0 112.138 -179.542 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 34.6 m -128.39 150.85 75.44 Favored Pre-proline 0 C--N 1.325 -0.467 0 N-CA-C 110.211 -0.292 . . . . 0.0 110.211 -179.826 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . 0.576 ' HG2' ' OG ' ' A' ' 61' ' ' SER . 31.1 Cg_endo -70.61 152.84 65.18 Favored 'Trans proline' 0 N--CA 1.455 -0.755 0 C-N-CA 122.212 1.941 . . . . 0.0 112.212 179.349 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.402 ' HG2' ' SG ' ' A' ' 52' ' ' CYS . 81.2 mtp -68.65 -10.19 54.59 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 121.092 0.472 . . . . 0.0 111.729 -176.532 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . 0.491 ' OD1' ' HB2' ' A' ' 58' ' ' PRO . 2.1 p-10 -91.16 -11.99 36.78 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-O 121.137 0.494 . . . . 0.0 111.114 -179.991 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.576 ' OG ' ' HG2' ' A' ' 58' ' ' PRO . 74.9 m -83.21 -23.6 32.76 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-O 121.088 0.47 . . . . 0.0 111.87 -178.481 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.485 HD11 ' SG ' ' A' ' 52' ' ' CYS . 1.1 pp -124.65 171.79 9.77 Favored 'General case' 0 C--N 1.305 -1.369 0 N-CA-C 113.117 0.784 . . . . 0.0 113.117 -175.796 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.454 ' O ' ' HA ' ' A' ' 90' ' ' VAL . 51.3 mtm180 -121.11 113.88 20.65 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.584 -0.735 . . . . 0.0 110.851 -177.375 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -98.21 116.41 30.36 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-O 121.194 0.521 . . . . 0.0 111.513 179.943 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.461 ' C ' HD21 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -147.06 166.51 26.65 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 121.186 0.517 . . . . 0.0 110.597 178.956 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 83.0 t80 -147.38 136.13 22.02 Favored 'General case' 0 C--N 1.31 -1.141 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 177.672 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 51.58 26.8 3.51 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 124.31 1.044 . . . . 0.0 112.028 -179.869 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 84.37 22.57 53.88 Favored Glycine 0 N--CA 1.448 -0.535 0 C-N-CA 120.808 -0.71 . . . . 0.0 112.611 -179.145 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 2.5 pt20 -128.82 134.27 48.29 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 179.57 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 15.4 ptt180 -68.2 146.98 52.88 Favored 'General case' 0 C--N 1.306 -1.309 0 CA-C-O 121.368 0.604 . . . . 0.0 111.038 178.443 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.427 HG12 ' HA ' ' A' ' 65' ' ' LEU . 21.8 mm -94.65 117.54 38.63 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.13 0 CA-C-O 121.147 0.498 . . . . 0.0 110.041 179.11 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -95.78 160.99 14.21 Favored 'General case' 0 N--CA 1.435 -1.195 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 179.71 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . 0.414 ' CA ' ' HB3' ' A' ' 45' ' ' LYS . 55.1 m-20 -65.33 -22.99 66.89 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-O 121.665 0.745 . . . . 0.0 110.646 -179.511 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 12.4 m-80 -97.07 4.55 51.31 Favored 'General case' 0 C--N 1.311 -1.08 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.132 -178.08 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . 0.602 ' O ' ' HB2' ' A' ' 44' ' ' LEU . 4.8 m170 -83.68 146.7 28.09 Favored 'General case' 0 CA--C 1.508 -0.65 0 N-CA-C 109.43 -0.581 . . . . 0.0 109.43 178.874 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 59.7 p -120.24 155.11 56.26 Favored Pre-proline 0 C--N 1.311 -1.069 0 C-N-CA 120.867 -0.333 . . . . 0.0 111.012 178.3 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -59.22 -40.21 71.24 Favored 'Trans proline' 0 N--CA 1.461 -0.438 0 C-N-CA 122.607 2.205 . . . . 0.0 111.693 179.557 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . 0.481 ' HG2' ' O ' ' A' ' 40' ' ' MET . 0.0 OUTLIER -69.47 -36.2 76.34 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.852 0.358 . . . . 0.0 111.617 -178.042 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -74.93 -35.28 62.18 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.882 0.372 . . . . 0.0 111.246 -179.055 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.435 HD21 ' CG ' ' A' ' 75' ' ' HIS . 5.5 mt -80.55 -0.76 39.09 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.245 0.545 . . . . 0.0 110.819 179.728 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 76.36 45.76 13.85 Favored Glycine 0 CA--C 1.509 -0.317 0 CA-C-N 116.062 -0.517 . . . . 0.0 112.794 177.6 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 59.6 mtt -106.37 164.65 11.86 Favored 'General case' 0 C--N 1.311 -1.082 0 O-C-N 122.522 -0.399 . . . . 0.0 110.255 179.422 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . 0.418 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 10.0 pt-20 -141.16 -166.24 2.13 Favored 'General case' 0 C--N 1.316 -0.885 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 177.584 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.446 ' O ' ' HB2' ' A' ' 85' ' ' GLU . 6.9 pt-20 -72.93 141.52 47.83 Favored 'General case' 0 N--CA 1.444 -0.774 0 C-N-CA 120.363 -0.535 . . . . 0.0 109.801 177.747 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . 0.446 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 66.5 mm-40 72.87 4.92 5.1 Favored 'General case' 0 C--N 1.32 -0.682 0 C-N-CA 123.722 0.809 . . . . 0.0 111.848 -179.109 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . 0.418 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 2.3 t70 -60.8 155.41 19.49 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 121.139 0.495 . . . . 0.0 110.179 176.862 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . 0.464 ' HA ' ' O ' ' A' ' 25' ' ' LYS . 8.8 p -125.94 141.78 44.61 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.497 0 CA-C-O 121.406 0.622 . . . . 0.0 111.265 -177.011 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 3.7 mp -110.24 152.52 12.23 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.884 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 179.029 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.428 ' O ' HD13 ' A' ' 65' ' ' LEU . 3.0 tt0 -103.32 130.9 50.71 Favored 'General case' 0 C--N 1.309 -1.153 0 CA-C-O 121.296 0.57 . . . . 0.0 111.127 -175.507 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . 0.454 ' HA ' ' O ' ' A' ' 63' ' ' ARG . 60.6 t -126.73 132.94 69.6 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.948 0 CA-C-O 121.588 0.708 . . . . 0.0 111.242 179.959 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 76.3 m-85 -116.78 -178.22 3.38 Favored 'General case' 0 C--N 1.309 -1.182 0 CA-C-N 115.639 -0.71 . . . . 0.0 109.724 177.639 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 9.3 tp60 -109.66 145.63 36.18 Favored 'General case' 0 C--N 1.313 -0.982 0 N-CA-C 109.779 -0.452 . . . . 0.0 109.779 179.676 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -137.95 20.35 2.83 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.346 0.593 . . . . 0.0 110.296 175.57 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 97.6 mt-30 -61.91 -164.74 0.01 OUTLIER 'General case' 0 CA--C 1.542 0.645 0 CA-C-N 115.539 -0.755 . . . . 0.0 112.56 178.449 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 9.8 t -177.06 176.82 1.34 Allowed 'General case' 0 N--CA 1.445 -0.723 0 N-CA-C 109.836 -0.431 . . . . 0.0 109.836 -175.38 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -124.66 7.23 8.39 Favored Glycine 0 N--CA 1.44 -1.087 0 N-CA-C 110.021 -1.232 . . . . 0.0 110.021 178.288 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.432 -1.587 0 CA-C-O 118.141 -1.366 . . . . 0.0 110.888 -179.174 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 19.5 mmt . . . . . 0 N--CA 1.476 0.863 0 CA-C-O 121.243 0.544 . . . . 0.0 111.069 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 39.9 m -115.95 2.36 13.49 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.763 179.362 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 65.75 37.83 5.52 Favored 'General case' 0 N--CA 1.479 0.985 0 CA-C-O 121.406 0.622 . . . . 0.0 109.784 -179.166 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 42.0 mt-30 -58.43 -64.62 0.86 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.539 -177.619 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -162.44 158.08 23.33 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-O 120.804 0.335 . . . . 0.0 110.366 -178.664 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -134.74 130.81 36.77 Favored 'General case' 0 C--N 1.314 -0.958 0 CA-C-O 121.133 0.492 . . . . 0.0 110.053 175.655 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 51.5 mttp -120.27 152.27 54.55 Favored Pre-proline 0 N--CA 1.428 -1.55 0 CA-C-N 116.105 -0.498 . . . . 0.0 109.699 -179.423 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.448 ' HB3' ' HB2' ' A' ' 53' ' ' GLN . 17.4 Cg_exo -63.87 108.9 0.98 Allowed 'Trans proline' 0 N--CA 1.449 -1.125 0 C-N-CA 121.935 1.757 . . . . 0.0 109.523 175.32 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 15.8 m -78.3 133.58 37.62 Favored 'General case' 0 C--N 1.306 -1.3 0 CA-C-O 121.442 0.639 . . . . 0.0 111.826 -174.859 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 20.3 m -122.81 115.8 22.62 Favored 'General case' 0 N--CA 1.441 -0.916 0 N-CA-C 109.098 -0.704 . . . . 0.0 109.098 177.925 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -71.48 129.91 39.97 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-O 120.722 0.296 . . . . 0.0 110.552 -179.16 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -58.43 -52.75 64.33 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.622 179.368 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 84.4 mt -55.2 -61.82 2.07 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 121.151 0.5 . . . . 0.0 110.462 176.984 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 90.52 32.64 9.2 Favored Glycine 0 N--CA 1.442 -0.962 0 N-CA-C 111.125 -0.79 . . . . 0.0 111.125 179.52 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -123.98 101.58 7.31 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-O 121.374 0.607 . . . . 0.0 110.084 -178.333 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.428 ' N ' ' HD3' ' A' ' 16' ' ' LYS . 0.1 OUTLIER -107.42 150.0 27.26 Favored 'General case' 0 C--N 1.303 -1.417 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.109 179.692 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 21.1 ptmt -73.06 148.1 44.4 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-O 120.798 0.332 . . . . 0.0 110.195 179.843 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -162.5 -173.06 3.39 Favored 'General case' 0 N--CA 1.44 -0.941 0 CA-C-O 120.914 0.387 . . . . 0.0 110.656 -177.89 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 97.87 124.97 5.07 Favored Glycine 0 CA--C 1.503 -0.688 0 N-CA-C 111.495 -0.642 . . . . 0.0 111.495 -178.948 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 18.1 mm-40 64.21 63.2 0.8 Allowed 'General case' 0 CA--C 1.519 -0.245 0 CA-C-O 121.936 0.874 . . . . 0.0 110.019 -179.485 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.495 ' CZ ' ' HD3' ' A' ' 37' ' ' LYS . 6.3 p90 -132.74 176.25 8.62 Favored 'General case' 0 C--N 1.308 -1.212 0 CA-C-N 115.441 -0.799 . . . . 0.0 111.274 -179.332 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 24.0 pt -115.01 171.95 4.24 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.978 0 CA-C-O 121.372 0.605 . . . . 0.0 109.714 176.925 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 11.6 mtmt -114.61 144.46 43.36 Favored 'General case' 0 C--N 1.294 -1.805 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 -178.74 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.9 mp -139.05 161.3 37.72 Favored 'General case' 0 C--N 1.301 -1.52 0 CA-C-O 121.339 0.59 . . . . 0.0 110.945 175.051 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.439 ' O ' ' HA ' ' A' ' 87' ' ' VAL . 5.6 tmmm? -130.22 142.37 50.57 Favored 'General case' 0 N--CA 1.438 -1.043 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.377 -179.43 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . 0.514 ' O ' ' HA ' ' A' ' 33' ' ' GLU . 0.9 OUTLIER -113.14 142.35 25.85 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.411 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.392 179.844 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 45.0 mm -103.82 113.36 40.49 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.251 0 N-CA-C 107.381 -1.34 . . . . 0.0 107.381 175.147 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -74.64 -177.56 38.74 Favored Glycine 0 N--CA 1.432 -1.598 0 C-N-CA 120.755 -0.736 . . . . 0.0 113.105 -175.649 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.792 ' H ' ' NE2' ' A' ' 29' ' ' GLN . 0.0 OUTLIER -70.0 -26.21 63.97 Favored 'General case' 0 C--N 1.305 -1.367 0 N-CA-C 108.532 -0.914 . . . . 0.0 108.532 -178.672 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 37.0 t70 -102.83 12.51 36.1 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 114.868 -1.06 . . . . 0.0 108.47 177.09 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 49.9 m 71.15 20.66 5.07 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 114.974 -1.012 . . . . 0.0 110.905 -179.141 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 8.2 t -67.7 120.56 14.27 Favored 'General case' 0 N--CA 1.447 -0.597 0 N-CA-C 108.779 -0.823 . . . . 0.0 108.779 177.711 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.514 ' HA ' ' O ' ' A' ' 26' ' ' VAL . 46.5 mt-10 -89.15 108.97 19.9 Favored 'General case' 0 C--N 1.313 -0.986 0 CA-C-O 121.338 0.59 . . . . 0.0 111.217 -178.138 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 38.9 mm -98.54 136.85 27.89 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.562 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 177.68 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 11.7 m170 -117.34 133.31 56.12 Favored 'General case' 0 C--N 1.316 -0.854 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 -178.388 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 1.7 p90 -147.2 170.35 17.42 Favored 'General case' 0 C--N 1.309 -1.178 0 CA-C-O 121.376 0.608 . . . . 0.0 111.607 -178.35 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.495 ' HD3' ' CZ ' ' A' ' 21' ' ' TYR . 15.1 ptpt -130.7 119.91 23.08 Favored 'General case' 0 C--N 1.314 -0.975 0 CA-C-N 115.584 -0.734 . . . . 0.0 111.027 -178.543 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 24.4 m -139.84 159.57 27.0 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 116.23 -0.441 . . . . 0.0 109.968 -179.26 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 25.9 mtpp -77.11 176.17 8.96 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-O 121.342 0.592 . . . . 0.0 111.18 179.347 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.5 -35.79 19.39 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.874 178.323 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 13.8 t -93.8 10.52 32.78 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 121.292 0.567 . . . . 0.0 111.607 -176.181 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 7.2 t -94.74 173.65 7.5 Favored 'General case' 0 C--N 1.32 -0.698 0 O-C-N 121.779 -0.575 . . . . 0.0 110.201 -179.617 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 46.0 m170 -90.4 147.72 23.26 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 121.637 0.732 . . . . 0.0 111.611 -179.101 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.502 ' O ' ' HG2' ' A' ' 48' ' ' LYS . 1.3 mm? -70.23 -13.22 62.08 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.426 -0.806 . . . . 0.0 110.707 178.754 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.487 ' HB3' ' HB2' ' A' ' 73' ' ' ASP . 0.0 OUTLIER -54.26 -43.23 70.77 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.986 -178.899 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -71.19 -33.35 69.88 Favored 'General case' 0 C--O 1.2 -1.536 0 CA-C-O 121.069 0.461 . . . . 0.0 110.443 178.918 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.4 HD12 HD11 ' A' ' 44' ' ' LEU . 9.4 tt -69.14 -50.96 43.16 Favored 'General case' 0 C--N 1.309 -1.187 0 CA-C-O 121.105 0.479 . . . . 0.0 110.793 -178.855 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.502 ' HG2' ' O ' ' A' ' 44' ' ' LEU . 4.5 ptmm? -62.17 -40.62 96.61 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.542 -178.966 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.7 -32.86 68.26 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.11 0.481 . . . . 0.0 110.468 177.986 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' SER . . . . . 0.633 ' O ' ' HG2' ' A' ' 54' ' ' ARG . 5.3 m -68.81 -40.98 79.24 Favored 'General case' 0 N--CA 1.45 -0.445 0 N-CA-C 112.52 0.563 . . . . 0.0 112.52 -177.822 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.463 ' CD1' HG12 ' A' ' 26' ' ' VAL . 2.0 p90 -76.45 -33.06 58.76 Favored 'General case' 0 C--N 1.317 -0.809 0 C-N-CA 119.005 -1.078 . . . . 0.0 110.203 179.352 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . 0.608 ' SG ' HD12 ' A' ' 62' ' ' LEU . 92.0 m -61.37 -45.65 93.47 Favored 'General case' 0 CA--C 1.511 -0.521 0 CA-C-O 121.221 0.534 . . . . 0.0 110.19 178.597 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . 0.448 ' HB2' ' HB3' ' A' ' 8' ' ' PRO . 13.8 pt20 -65.44 -35.67 81.61 Favored 'General case' 0 N--CA 1.442 -0.845 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.536 -179.663 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.633 ' HG2' ' O ' ' A' ' 50' ' ' SER . 41.9 mmt-85 -57.36 -39.1 75.26 Favored 'General case' 0 C--N 1.348 0.524 0 CA-C-O 121.123 0.487 . . . . 0.0 111.388 177.327 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.44 HE21 ' HB2' ' A' ' 55' ' ' GLN . 3.0 mt-30 -78.53 -21.78 48.3 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-O 120.958 0.408 . . . . 0.0 110.783 179.859 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 82.9 29.74 33.85 Favored Glycine 0 N--CA 1.442 -0.931 0 C-N-CA 120.434 -0.888 . . . . 0.0 111.727 179.348 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 35.9 m -130.43 148.26 69.2 Favored Pre-proline 0 C--N 1.323 -0.584 0 O-C-N 122.454 -0.439 . . . . 0.0 110.645 -178.969 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 29.1 Cg_endo -65.78 150.73 85.79 Favored 'Trans proline' 0 N--CA 1.458 -0.602 0 C-N-CA 122.27 1.98 . . . . 0.0 111.72 177.971 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 73.6 mtp -67.49 -7.79 28.51 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-N 116.113 -0.494 . . . . 0.0 112.236 -176.661 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 24.2 p30 -90.41 -12.19 38.22 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 121.387 0.613 . . . . 0.0 111.162 -179.194 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 68.1 m -84.94 -20.32 30.82 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.775 -179.906 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.608 HD12 ' SG ' ' A' ' 52' ' ' CYS . 1.4 pp -136.66 157.44 46.75 Favored 'General case' 0 C--N 1.31 -1.115 0 CA-C-O 121.71 0.767 . . . . 0.0 113.027 -176.545 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.409 ' HG3' ' HB2' ' A' ' 91' ' ' TYR . 1.2 ptp180 -115.68 138.1 51.43 Favored 'General case' 0 C--N 1.314 -0.953 0 CA-C-N 115.049 -0.978 . . . . 0.0 112.376 179.224 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.427 ' CZ ' ' HE2' ' A' ' 48' ' ' LYS . 0.1 OUTLIER -114.14 120.84 41.88 Favored 'General case' 0 C--N 1.313 -0.979 0 CA-C-N 114.983 -1.008 . . . . 0.0 110.541 -176.968 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.464 ' C ' HD22 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -142.94 164.76 29.21 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.33 0.586 . . . . 0.0 111.043 179.298 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 92.3 t80 -147.05 135.33 21.69 Favored 'General case' 0 C--N 1.314 -0.952 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 178.918 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 6.6 pt-20 49.33 26.3 1.54 Allowed 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 124.406 1.082 . . . . 0.0 112.549 -179.17 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 87.57 21.76 46.42 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.913 -0.661 . . . . 0.0 112.934 -179.082 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 2.7 pt20 -129.93 136.78 49.87 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 109.365 -0.606 . . . . 0.0 109.365 -179.808 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 3.1 ptt180 -68.67 147.5 51.78 Favored 'General case' 0 C--N 1.308 -1.231 0 CA-C-O 121.585 0.707 . . . . 0.0 111.02 177.671 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 21.8 mm -97.52 118.55 44.19 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.227 0 N-CA-C 109.708 -0.478 . . . . 0.0 109.708 179.014 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -103.28 167.05 10.06 Favored 'General case' 0 N--CA 1.442 -0.864 0 CA-C-O 120.881 0.372 . . . . 0.0 110.211 -178.854 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . 0.487 ' HB2' ' HB3' ' A' ' 45' ' ' LYS . 8.6 p-10 -66.6 -22.06 66.13 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.779 -178.236 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 9.2 m-80 -98.93 1.78 45.91 Favored 'General case' 0 CA--C 1.51 -0.568 0 CA-C-O 121.238 0.542 . . . . 0.0 110.205 -178.553 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . 0.448 ' CG ' HD21 ' A' ' 80' ' ' LEU . 3.2 m170 -81.06 141.72 34.06 Favored 'General case' 0 C--N 1.318 -0.799 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 179.714 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 70.2 p -116.64 153.58 49.1 Favored Pre-proline 0 C--N 1.307 -1.245 0 C-N-CA 121.072 -0.251 . . . . 0.0 110.675 179.242 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_exo -61.36 -37.75 69.95 Favored 'Trans proline' 0 N--CA 1.459 -0.549 0 C-N-CA 122.463 2.109 . . . . 0.0 111.557 179.796 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . 0.51 ' HG3' ' N ' ' A' ' 79' ' ' GLU . 33.1 pttt -68.83 -38.65 79.97 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.92 -178.713 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.51 ' N ' ' HG3' ' A' ' 78' ' ' LYS . 11.8 mm-40 -72.74 -38.29 67.44 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-O 120.953 0.406 . . . . 0.0 111.098 -178.808 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.448 HD21 ' CG ' ' A' ' 75' ' ' HIS . 5.2 mt -76.46 -6.79 53.29 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-O 121.485 0.66 . . . . 0.0 110.468 179.39 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 79.44 43.08 10.74 Favored Glycine 0 N--CA 1.452 -0.258 0 CA-C-N 115.905 -0.588 . . . . 0.0 112.954 177.201 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 60.6 mtt -102.82 165.6 10.96 Favored 'General case' 0 C--N 1.314 -0.937 0 N-CA-C 109.835 -0.431 . . . . 0.0 109.835 179.126 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -142.66 -171.45 3.43 Favored 'General case' 0 C--N 1.314 -0.952 0 N-CA-C 109.37 -0.604 . . . . 0.0 109.37 177.663 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -71.24 139.01 49.91 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-O 121.435 0.636 . . . . 0.0 111.145 -178.845 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 17.7 tp10 74.51 5.72 4.53 Favored 'General case' 0 C--N 1.321 -0.659 0 C-N-CA 125.012 1.325 . . . . 0.0 111.761 179.229 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -66.22 165.91 12.95 Favored 'General case' 0 C--O 1.238 0.475 0 CA-C-O 121.05 0.452 . . . . 0.0 110.763 176.941 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . 0.439 ' HA ' ' O ' ' A' ' 25' ' ' LYS . 14.9 p -127.55 145.18 35.37 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.876 0 CA-C-O 121.443 0.64 . . . . 0.0 112.054 -175.299 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 3.6 mp -115.56 152.86 17.17 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 177.527 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 -107.19 138.19 43.84 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.038 0.447 . . . . 0.0 110.601 -175.981 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 84.9 t -129.74 137.38 56.85 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.75 0 CA-C-O 121.299 0.571 . . . . 0.0 111.351 -179.3 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . 0.409 ' HB2' ' HG3' ' A' ' 63' ' ' ARG . 96.5 m-85 -123.77 167.09 14.49 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.09 178.802 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 7.0 tp60 -95.39 139.01 32.29 Favored 'General case' 0 C--N 1.31 -1.113 0 N-CA-C 109.841 -0.429 . . . . 0.0 109.841 -179.654 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -127.19 18.98 7.02 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.366 0.603 . . . . 0.0 110.281 176.911 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 98.6 mt-30 -63.63 -161.75 0.01 OUTLIER 'General case' 0 CA--C 1.541 0.599 0 CA-C-N 115.472 -0.785 . . . . 0.0 111.203 176.803 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 9.3 t -120.11 -25.44 5.75 Favored 'General case' 0 C--N 1.316 -0.873 0 O-C-N 121.595 -0.691 . . . . 0.0 110.911 -176.862 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 142.01 122.33 1.77 Allowed Glycine 0 N--CA 1.438 -1.187 0 N-CA-C 111.088 -0.805 . . . . 0.0 111.088 -179.826 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.342 0 CA-C-O 118.775 -1.014 . . . . 0.0 111.56 -178.68 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.4 mtt . . . . . 0 N--CA 1.475 0.825 0 CA-C-O 120.92 0.391 . . . . 0.0 110.972 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 73.0 m 67.99 13.54 9.16 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-O 121.882 0.849 . . . . 0.0 110.434 -178.989 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 11.5 p-10 -102.51 1.63 35.3 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-N 114.972 -1.013 . . . . 0.0 110.232 -177.64 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 6.4 pt20 -134.91 15.9 3.56 Favored 'General case' 0 C--N 1.313 -1.012 0 CA-C-O 121.792 0.806 . . . . 0.0 110.093 -174.177 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -137.26 151.88 49.19 Favored 'General case' 0 C--N 1.304 -1.391 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.345 -177.492 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -167.57 146.15 4.79 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 116.184 -0.462 . . . . 0.0 109.917 179.709 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 21.8 ptmt -141.21 145.94 40.76 Favored Pre-proline 0 C--N 1.316 -0.862 0 N-CA-C 110.286 -0.264 . . . . 0.0 110.286 178.76 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 69.8 Cg_endo -77.9 166.54 25.0 Favored 'Trans proline' 0 C--O 1.242 0.683 0 C-N-CA 122.314 2.01 . . . . 0.0 111.597 177.818 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 23.1 t -166.15 173.21 10.46 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 110.007 -0.368 . . . . 0.0 110.007 -178.503 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 23.8 m -145.4 -78.33 0.19 Allowed 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.112 0.482 . . . . 0.0 110.521 179.272 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -154.42 157.58 38.7 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.933 0.397 . . . . 0.0 110.098 -178.76 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -119.04 157.37 27.94 Favored 'General case' 0 C--N 1.315 -0.899 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 178.952 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 1.3 pp -161.06 160.39 30.43 Favored 'General case' 0 C--N 1.316 -0.887 0 O-C-N 121.866 -0.522 . . . . 0.0 110.597 -178.671 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -158.13 30.2 0.48 Allowed Glycine 0 CA--C 1.503 -0.697 0 C-N-CA 121.019 -0.61 . . . . 0.0 112.084 179.008 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -59.66 127.63 32.94 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-O 120.871 0.367 . . . . 0.0 110.4 178.697 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 30.5 mmmt -100.73 -165.05 1.17 Allowed 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.917 0.389 . . . . 0.0 110.499 -178.654 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.571 ' CD ' ' H ' ' A' ' 18' ' ' GLU . 3.7 tmtp? -65.67 172.12 3.69 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.425 0.631 . . . . 0.0 110.685 178.446 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.571 ' H ' ' CD ' ' A' ' 17' ' ' LYS . 1.2 pm0 -157.16 174.92 14.74 Favored 'General case' 0 N--CA 1.434 -1.264 0 CA-C-N 115.984 -0.553 . . . . 0.0 109.642 -177.019 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -120.07 21.66 8.78 Favored Glycine 0 N--CA 1.441 -1.032 0 N-CA-C 110.8 -0.92 . . . . 0.0 110.8 175.632 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 24.9 mm-40 61.11 43.6 11.03 Favored 'General case' 0 C--N 1.344 0.35 0 CA-C-O 121.818 0.818 . . . . 0.0 110.274 -178.955 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.41 ' CE1' ' HB2' ' A' ' 37' ' ' LYS . 55.4 p90 -115.24 -179.55 3.67 Favored 'General case' 0 C--N 1.309 -1.177 0 CA-C-N 115.027 -0.988 . . . . 0.0 109.987 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 26.3 pt -125.68 172.19 13.44 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.889 0 CA-C-O 121.463 0.649 . . . . 0.0 110.593 178.029 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 3.7 mtmt -120.1 141.95 49.34 Favored 'General case' 0 C--N 1.299 -1.599 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 -179.271 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.4 mp -136.02 162.51 32.68 Favored 'General case' 0 C--N 1.305 -1.361 0 CA-C-O 121.283 0.563 . . . . 0.0 111.02 177.218 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.416 ' HE2' ' HB3' ' A' ' 25' ' ' LYS . 4.9 tmmm? -131.4 142.54 50.06 Favored 'General case' 0 N--CA 1.437 -1.092 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.386 -179.114 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . 0.489 ' O ' ' HA ' ' A' ' 33' ' ' GLU . 0.9 OUTLIER -113.13 142.05 26.83 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.447 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.232 179.892 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.459 ' O ' ' HB ' ' A' ' 90' ' ' VAL . 43.7 mm -104.32 115.54 46.44 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.952 0 N-CA-C 107.373 -1.343 . . . . 0.0 107.373 175.373 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -78.85 179.09 52.97 Favored Glycine 0 N--CA 1.431 -1.669 0 C-N-CA 120.795 -0.717 . . . . 0.0 113.138 -175.683 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.795 ' H ' ' NE2' ' A' ' 29' ' ' GLN . 0.0 OUTLIER -74.7 -22.26 58.94 Favored 'General case' 0 N--CA 1.436 -1.167 0 CA-C-O 121.996 0.903 . . . . 0.0 108.73 -178.105 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -102.62 12.57 36.19 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.032 -0.985 . . . . 0.0 108.525 176.171 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 37.1 t 73.36 18.09 3.76 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 115.174 -0.921 . . . . 0.0 110.418 -179.541 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 7.9 t -70.44 116.57 10.92 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 179.058 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.489 ' HA ' ' O ' ' A' ' 26' ' ' VAL . 37.0 mt-10 -87.76 110.59 20.57 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-O 121.144 0.497 . . . . 0.0 110.484 179.979 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 32.1 mm -98.57 139.04 21.4 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.573 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 178.235 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 10.1 m170 -119.37 131.73 55.73 Favored 'General case' 0 C--N 1.315 -0.905 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 -178.962 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 1.4 p90 -146.88 173.42 12.42 Favored 'General case' 0 C--N 1.309 -1.167 0 CA-C-O 121.15 0.5 . . . . 0.0 110.862 -178.463 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.41 ' HB2' ' CE1' ' A' ' 21' ' ' TYR . 17.6 ptpt -134.29 120.65 20.22 Favored 'General case' 0 C--N 1.314 -0.951 0 CA-C-O 121.191 0.519 . . . . 0.0 111.137 -179.144 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 26.3 m -137.97 162.47 31.26 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 N-CA-C 109.406 -0.59 . . . . 0.0 109.406 -179.743 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.512 ' O ' HG23 ' A' ' 42' ' ' THR . 40.6 tttp -86.79 163.26 17.36 Favored 'General case' 0 C--N 1.313 -0.988 0 O-C-N 121.519 -0.738 . . . . 0.0 110.947 -179.596 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.82 -41.72 91.49 Favored 'General case' 0 CA--C 1.517 -0.298 0 N-CA-C 112.79 0.663 . . . . 0.0 112.79 -177.808 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 11.9 t -96.11 13.14 28.22 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-O 121.068 0.461 . . . . 0.0 112.113 -174.988 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' THR . . . . . 0.512 HG23 ' O ' ' A' ' 39' ' ' LYS . 2.0 t -91.03 161.88 14.94 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 179.666 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . 0.41 ' O ' ' HG2' ' A' ' 46' ' ' LYS . 42.5 m170 -75.06 138.86 42.44 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-O 121.589 0.709 . . . . 0.0 111.572 -179.979 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.604 ' O ' ' HG3' ' A' ' 48' ' ' LYS . 0.2 OUTLIER -67.94 -15.4 63.59 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.219 -0.901 . . . . 0.0 109.972 -179.02 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.663 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -53.35 -45.97 69.36 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.844 -0.616 . . . . 0.0 112.433 -177.952 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.427 ' N ' ' HD3' ' A' ' 45' ' ' LYS . 21.8 ptmt -65.82 -29.37 69.83 Favored 'General case' 0 C--O 1.218 -0.562 0 CA-C-O 121.345 0.593 . . . . 0.0 110.579 -178.528 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.539 ' HB3' HD12 ' A' ' 44' ' ' LEU . 7.7 tt -72.97 -46.47 52.16 Favored 'General case' 0 C--N 1.311 -1.076 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.925 -179.596 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.604 ' HG3' ' O ' ' A' ' 44' ' ' LEU . 26.8 mtpt -58.29 -48.79 79.37 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-O 121.512 0.672 . . . . 0.0 110.185 -179.142 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.663 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 7.0 pt-20 -71.16 -31.32 67.53 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.976 -178.793 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' SER . . . . . 0.43 ' O ' ' HG2' ' A' ' 54' ' ' ARG . 38.0 t -65.44 -45.69 82.84 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.979 0.419 . . . . 0.0 111.283 -179.811 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.476 ' CD1' HG11 ' A' ' 26' ' ' VAL . 2.1 p90 -76.47 -32.64 58.49 Favored 'General case' 0 N--CA 1.443 -0.786 0 C-N-CA 119.86 -0.736 . . . . 0.0 110.539 -177.378 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . 0.475 ' SG ' ' HG2' ' A' ' 59' ' ' MET . 99.7 m -64.15 -44.15 92.99 Favored 'General case' 0 CA--C 1.509 -0.634 0 CA-C-O 121.105 0.479 . . . . 0.0 110.547 179.436 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 13.5 pt20 -67.73 -33.46 74.92 Favored 'General case' 0 N--CA 1.443 -0.779 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.274 -179.668 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.43 ' HG2' ' O ' ' A' ' 50' ' ' SER . 13.7 mmt180 -57.5 -38.16 74.17 Favored 'General case' 0 C--N 1.348 0.524 0 CA-C-O 121.018 0.437 . . . . 0.0 111.042 177.055 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.438 HE21 ' HB2' ' A' ' 55' ' ' GLN . 3.7 mt-30 -82.19 -22.47 35.96 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.968 -179.746 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 82.94 29.18 35.26 Favored Glycine 0 N--CA 1.443 -0.849 0 C-N-CA 120.548 -0.834 . . . . 0.0 111.886 -179.868 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 33.9 m -125.56 150.9 69.46 Favored Pre-proline 0 C--N 1.325 -0.467 0 O-C-N 122.45 -0.441 . . . . 0.0 110.649 -178.661 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . 0.485 ' HG2' ' OG ' ' A' ' 61' ' ' SER . 43.4 Cg_endo -71.01 149.9 59.74 Favored 'Trans proline' 0 N--CA 1.453 -0.871 0 C-N-CA 122.295 1.997 . . . . 0.0 111.856 177.277 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.475 ' HG2' ' SG ' ' A' ' 52' ' ' CYS . 80.6 mtp -70.1 -7.55 42.38 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.779 -177.279 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 31.3 p30 -89.12 -11.98 42.39 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.472 0.653 . . . . 0.0 110.968 179.272 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.485 ' OG ' ' HG2' ' A' ' 58' ' ' PRO . 70.3 m -90.81 -19.05 23.87 Favored 'General case' 0 N--CA 1.439 -0.986 0 N-CA-C 112.459 0.54 . . . . 0.0 112.459 -178.122 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.447 HD13 ' SG ' ' A' ' 52' ' ' CYS . 1.4 pp -128.09 167.89 16.13 Favored 'General case' 0 C--N 1.313 -1.0 0 N-CA-C 113.139 0.792 . . . . 0.0 113.139 -177.674 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.501 ' O ' ' HA ' ' A' ' 90' ' ' VAL . 35.6 mtm180 -118.66 118.29 31.26 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.261 -0.881 . . . . 0.0 110.669 -177.566 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -101.56 112.41 24.95 Favored 'General case' 0 C--N 1.312 -1.037 0 CA-C-O 121.134 0.492 . . . . 0.0 110.723 178.704 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.474 ' C ' HD22 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -141.52 164.62 29.73 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-O 121.528 0.68 . . . . 0.0 111.461 -179.377 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 88.3 t80 -144.77 133.81 22.68 Favored 'General case' 0 C--N 1.308 -1.198 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 177.733 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 49.36 29.59 2.85 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 124.264 1.025 . . . . 0.0 112.288 -178.884 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 87.26 16.28 60.94 Favored Glycine 0 N--CA 1.446 -0.681 0 C-N-CA 120.969 -0.634 . . . . 0.0 113.599 179.593 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 2.7 pt20 -125.86 135.73 52.28 Favored 'General case' 0 C--N 1.32 -0.698 0 O-C-N 122.254 -0.556 . . . . 0.0 109.623 -178.907 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -70.48 148.64 48.05 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-O 121.667 0.746 . . . . 0.0 110.379 177.792 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 23.4 mm -96.47 122.42 47.95 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.917 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.049 -179.278 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -95.31 166.07 12.07 Favored 'General case' 0 N--CA 1.436 -1.158 0 N-CA-C 109.697 -0.482 . . . . 0.0 109.697 -179.786 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . 0.41 ' CA ' ' HB3' ' A' ' 45' ' ' LYS . 11.8 p-10 -71.18 -21.04 62.21 Favored 'General case' 0 C--N 1.31 -1.121 0 CA-C-O 121.4 0.619 . . . . 0.0 110.773 -179.598 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 13.2 m-80 -98.73 4.0 47.71 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-O 121.175 0.512 . . . . 0.0 110.152 179.437 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . 0.59 ' O ' ' HB2' ' A' ' 44' ' ' LEU . 3.2 m170 -83.16 146.52 28.59 Favored 'General case' 0 CA--C 1.503 -0.862 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 -179.875 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.481 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 69.0 p -122.25 155.89 61.1 Favored Pre-proline 0 C--N 1.306 -1.308 0 C-N-CA 121.041 -0.264 . . . . 0.0 110.976 178.53 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -60.79 -41.67 44.26 Favored 'Trans proline' 0 N--CA 1.459 -0.533 0 C-N-CA 122.418 2.079 . . . . 0.0 111.01 179.619 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . 0.521 ' HG3' ' N ' ' A' ' 79' ' ' GLU . 44.6 pttt -65.28 -41.56 94.04 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.106 -178.618 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.521 ' N ' ' HG3' ' A' ' 78' ' ' LYS . 60.2 mm-40 -71.2 -36.14 71.81 Favored 'General case' 0 N--CA 1.445 -0.725 0 CA-C-O 120.999 0.428 . . . . 0.0 111.176 -177.661 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.481 ' HG ' ' O ' ' A' ' 76' ' ' THR . 5.9 mt -79.22 -6.05 55.71 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.202 0.525 . . . . 0.0 110.908 179.922 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 83.14 42.37 8.07 Favored Glycine 0 N--CA 1.454 -0.16 0 C-N-CA 121.032 -0.604 . . . . 0.0 113.027 177.855 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 61.1 mtt -103.59 165.89 10.76 Favored 'General case' 0 C--N 1.315 -0.914 0 O-C-N 122.314 -0.521 . . . . 0.0 109.885 178.775 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -137.22 -172.12 3.12 Favored 'General case' 0 C--N 1.312 -1.046 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 178.455 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -76.93 141.88 40.3 Favored 'General case' 0 N--CA 1.444 -0.743 0 C-N-CA 119.52 -0.872 . . . . 0.0 110.56 179.6 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 77.8 3.22 2.96 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 124.779 1.232 . . . . 0.0 110.71 -178.93 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -63.05 164.74 7.91 Favored 'General case' 0 C--O 1.239 0.551 0 CA-C-O 121.249 0.547 . . . . 0.0 111.035 177.874 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . 0.412 ' HA ' ' O ' ' A' ' 25' ' ' LYS . 7.9 p -128.34 145.01 36.08 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.067 0 CA-C-O 121.288 0.566 . . . . 0.0 111.338 -176.996 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 3.7 mp -113.88 153.7 15.38 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.825 0 N-CA-C 109.095 -0.705 . . . . 0.0 109.095 177.86 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -104.0 135.95 44.55 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-O 120.918 0.39 . . . . 0.0 110.545 -175.643 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . 0.501 ' HA ' ' O ' ' A' ' 63' ' ' ARG . 57.9 t -129.84 134.0 63.8 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.854 0 CA-C-O 121.391 0.615 . . . . 0.0 110.904 178.356 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 83.3 m-85 -122.78 176.0 6.22 Favored 'General case' 0 C--N 1.313 -0.994 0 CA-C-N 115.962 -0.563 . . . . 0.0 109.492 178.819 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 6.7 tp60 -101.08 146.77 27.02 Favored 'General case' 0 C--N 1.305 -1.366 0 N-CA-C 109.705 -0.48 . . . . 0.0 109.705 178.87 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -134.25 20.57 3.71 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.452 0.644 . . . . 0.0 110.454 175.695 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 98.0 mt-30 -67.96 -154.85 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.247 175.928 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 7.4 t -152.0 129.22 11.2 Favored 'General case' 0 C--N 1.316 -0.855 0 O-C-N 121.52 -0.738 . . . . 0.0 111.073 -179.661 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -132.05 -86.41 0.34 Allowed Glycine 0 N--CA 1.436 -1.33 0 CA-C-N 115.762 -0.653 . . . . 0.0 111.485 178.521 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.441 -1.029 0 CA-C-O 118.884 -0.953 . . . . 0.0 111.651 -179.598 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.5 ppp? . . . . . 0 N--CA 1.479 0.996 0 N-CA-C 111.837 0.31 . . . . 0.0 111.837 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 12.3 p -39.27 -66.23 0.31 Allowed 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.902 0.881 . . . . 0.0 111.624 179.508 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -130.22 -4.06 4.41 Favored 'General case' 0 C--N 1.304 -1.405 0 CA-C-O 122.154 0.978 . . . . 0.0 109.117 176.716 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 33.0 mt-30 -100.2 25.93 7.03 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.157 -0.928 . . . . 0.0 111.187 -176.166 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 14.1 pt-20 -70.63 149.5 46.98 Favored 'General case' 0 C--N 1.312 -1.034 0 C-N-CA 120.614 -0.434 . . . . 0.0 109.841 178.963 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -84.48 132.22 34.57 Favored 'General case' 0 C--N 1.31 -1.118 0 CA-C-O 120.925 0.393 . . . . 0.0 110.461 -178.77 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -155.23 146.09 16.36 Favored Pre-proline 0 C--N 1.319 -0.721 0 CA-C-O 120.653 0.263 . . . . 0.0 111.155 -178.504 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.529 ' HA ' ' SD ' ' A' ' 59' ' ' MET . 72.6 Cg_endo -79.14 137.97 13.96 Favored 'Trans proline' 0 C--O 1.241 0.66 0 C-N-CA 122.651 2.234 . . . . 0.0 112.758 179.818 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 30.9 p -77.55 174.11 11.25 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.21 0.529 . . . . 0.0 111.08 176.495 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 14.6 t -120.79 20.41 11.67 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 122.29 1.043 . . . . 0.0 109.405 178.799 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -100.12 166.33 11.07 Favored 'General case' 0 C--N 1.311 -1.073 0 CA-C-N 115.242 -0.89 . . . . 0.0 111.928 -177.852 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.401 ' HA ' ' OE1' ' A' ' 53' ' ' GLN . 22.6 t70 -119.77 8.27 11.14 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-O 121.974 0.892 . . . . 0.0 109.445 177.491 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -145.77 60.35 1.26 Allowed 'General case' 0 CA--C 1.484 -1.593 0 CA-C-O 122.953 1.358 . . . . 0.0 111.151 -177.834 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -77.44 31.52 1.63 Allowed Glycine 1 C--N 1.244 -4.546 0 CA-C-N 113.401 -1.727 . . . . 0.0 113.079 179.797 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -113.9 128.6 56.47 Favored 'General case' 0 C--N 1.319 -0.748 0 O-C-N 122.236 -0.567 . . . . 0.0 111.059 178.952 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 26.4 mmmt -107.66 172.72 6.67 Favored 'General case' 0 C--N 1.315 -0.91 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 -179.988 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.536 ' HD2' ' N ' ' A' ' 18' ' ' GLU . 3.9 tmmm? -61.64 150.15 37.25 Favored 'General case' 0 C--O 1.238 0.498 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 176.882 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.536 ' N ' ' HD2' ' A' ' 17' ' ' LYS . 35.3 mt-10 -136.78 -119.56 0.15 Allowed 'General case' 0 C--N 1.317 -0.812 0 CA-C-O 120.932 0.396 . . . . 0.0 111.738 -176.008 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.408 ' O ' ' HB2' ' A' ' 20' ' ' GLU . . . 100.23 117.73 4.11 Favored Glycine 0 N--CA 1.447 -0.589 0 N-CA-C 109.673 -1.371 . . . . 0.0 109.673 -176.186 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.408 ' HB2' ' O ' ' A' ' 19' ' ' GLY . 22.0 mm-40 76.05 54.8 0.05 Allowed 'General case' 0 C--N 1.346 0.452 0 N-CA-C 108.083 -1.08 . . . . 0.0 108.083 -175.802 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 37.7 p90 -119.85 176.88 5.19 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.009 -0.996 . . . . 0.0 112.507 -175.187 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . 0.509 ' HB ' ' HA ' ' A' ' 84' ' ' GLU . 19.9 pt -120.01 172.06 7.59 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.024 0 CA-C-N 114.851 -1.068 . . . . 0.0 110.566 178.833 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.487 ' HD3' ' N ' ' A' ' 23' ' ' LYS . 0.0 OUTLIER -121.51 143.44 49.27 Favored 'General case' 0 C--N 1.308 -1.201 0 N-CA-C 108.706 -0.85 . . . . 0.0 108.706 -179.489 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.4 mp -138.0 166.62 23.64 Favored 'General case' 0 C--N 1.306 -1.294 0 CA-C-O 121.256 0.551 . . . . 0.0 111.195 177.606 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 4.8 tmmm? -134.0 144.08 48.52 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.518 -179.917 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . 0.608 ' O ' ' HA ' ' A' ' 33' ' ' GLU . 0.9 OUTLIER -115.41 141.54 32.01 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.159 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.707 -179.932 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.415 HD12 ' HG2' ' A' ' 33' ' ' GLU . 35.4 mm -111.26 99.57 8.97 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.728 0 N-CA-C 108.234 -1.024 . . . . 0.0 108.234 175.827 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . 0.672 ' HA3' ' OG ' ' A' ' 32' ' ' SER . . . -71.63 172.46 45.63 Favored Glycine 0 N--CA 1.426 -2.014 0 C-N-CA 119.626 -1.274 . . . . 0.0 114.007 179.722 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.04 -18.26 65.23 Favored 'General case' 0 C--N 1.307 -1.245 0 CA-C-N 114.607 -0.797 . . . . 0.0 110.99 179.539 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -100.19 10.5 41.16 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.465 -0.788 . . . . 0.0 109.375 178.589 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 50.2 m 71.61 23.31 3.81 Favored 'General case' 0 C--N 1.342 0.275 0 CA-C-O 121.913 0.864 . . . . 0.0 109.113 -175.244 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.672 ' OG ' ' HA3' ' A' ' 28' ' ' GLY . 2.2 p -70.77 92.52 0.89 Allowed 'General case' 0 N--CA 1.42 -1.933 0 CA-C-N 114.983 -1.008 . . . . 0.0 111.403 -179.339 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.608 ' HA ' ' O ' ' A' ' 26' ' ' VAL . 31.4 mt-10 -81.52 102.08 10.35 Favored 'General case' 0 CA--C 1.505 -0.759 0 CA-C-O 121.211 0.529 . . . . 0.0 110.579 178.71 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 29.5 mm -99.73 138.97 22.45 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.718 0 N-CA-C 109.283 -0.636 . . . . 0.0 109.283 179.317 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 12.0 m170 -116.43 132.9 56.55 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 178.991 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -147.26 167.89 23.12 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-O 121.179 0.514 . . . . 0.0 111.555 -177.456 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 91.7 mttt -124.11 125.12 43.94 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.902 -0.59 . . . . 0.0 109.805 -178.963 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.526 ' HA ' ' OE2' ' A' ' 18' ' ' GLU . 24.1 m -144.72 152.77 14.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 121.048 0.451 . . . . 0.0 110.443 -179.852 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 36.5 mtpt -77.65 174.93 10.39 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-O 121.665 0.745 . . . . 0.0 111.401 177.436 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -87.02 -32.67 19.89 Favored 'General case' 0 C--N 1.31 -1.122 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.371 179.24 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 9.8 t -94.68 14.63 20.52 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.324 -177.293 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 6.4 t -105.42 167.36 9.8 Favored 'General case' 0 C--N 1.316 -0.865 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 179.903 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . 0.43 ' O ' ' HG2' ' A' ' 46' ' ' LYS . 46.4 m170 -81.9 142.41 32.51 Favored 'General case' 0 C--N 1.312 -1.022 0 CA-C-O 121.675 0.75 . . . . 0.0 111.84 -179.309 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.646 ' O ' ' HG3' ' A' ' 48' ' ' LYS . 0.2 OUTLIER -64.88 -17.68 64.52 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 114.998 -1.001 . . . . 0.0 109.893 179.296 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.738 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -51.9 -47.81 64.44 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.967 -179.043 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.43 ' HG2' ' O ' ' A' ' 43' ' ' HIS . 22.5 ptmt -58.97 -34.29 71.63 Favored 'General case' 0 C--O 1.207 -1.147 0 CA-C-O 121.077 0.465 . . . . 0.0 110.385 -179.274 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.465 ' HB3' HD11 ' A' ' 44' ' ' LEU . 8.2 tt -70.6 -47.98 57.44 Favored 'General case' 0 C--N 1.301 -1.531 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.124 -179.997 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.646 ' HG3' ' O ' ' A' ' 44' ' ' LEU . 20.8 mtpt -59.98 -49.93 75.73 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.509 -178.041 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.738 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 10.4 pt-20 -67.67 -33.89 75.83 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.441 -179.25 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' SER . . . . . 0.591 ' O ' ' HG2' ' A' ' 54' ' ' ARG . 7.5 m -66.39 -45.66 79.27 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.845 -179.659 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.455 ' CE2' ' HA ' ' A' ' 48' ' ' LYS . 2.1 p90 -76.35 -32.69 58.79 Favored 'General case' 0 N--CA 1.445 -0.677 0 C-N-CA 119.667 -0.813 . . . . 0.0 110.672 -177.775 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . 0.521 ' SG ' ' HG2' ' A' ' 59' ' ' MET . 69.2 m -61.98 -44.75 96.09 Favored 'General case' 0 C--O 1.238 0.466 0 CA-C-O 121.0 0.428 . . . . 0.0 110.793 179.083 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . 0.401 ' OE1' ' HA ' ' A' ' 12' ' ' ASP . 11.6 pt20 -67.99 -33.39 74.53 Favored 'General case' 0 N--CA 1.447 -0.601 0 C-N-CA 120.66 -0.416 . . . . 0.0 110.533 -179.922 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.591 ' HG2' ' O ' ' A' ' 50' ' ' SER . 17.8 mmt85 -57.67 -38.04 74.44 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-O 121.313 0.578 . . . . 0.0 110.832 177.531 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.428 HE21 ' HB2' ' A' ' 55' ' ' GLN . 3.4 mt-30 -81.29 -21.31 39.4 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.954 179.914 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 82.86 29.99 33.31 Favored Glycine 0 N--CA 1.446 -0.688 0 C-N-CA 120.834 -0.698 . . . . 0.0 112.325 179.224 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 35.0 m -132.17 147.63 66.55 Favored Pre-proline 0 C--N 1.324 -0.504 0 O-C-N 122.508 -0.407 . . . . 0.0 110.786 -179.042 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . 0.59 ' HG2' ' OG ' ' A' ' 61' ' ' SER . 18.8 Cg_endo -63.35 150.35 88.79 Favored 'Trans proline' 0 N--CA 1.456 -0.683 0 C-N-CA 122.33 2.02 . . . . 0.0 111.955 177.601 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.529 ' SD ' ' HA ' ' A' ' 8' ' ' PRO . 69.8 mtp -70.01 -9.16 54.33 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.77 -176.338 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.9 p-10 -92.19 -8.52 45.26 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 121.23 0.538 . . . . 0.0 110.886 -179.607 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.59 ' OG ' ' HG2' ' A' ' 58' ' ' PRO . 67.3 m -84.66 -23.36 29.49 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 121.002 0.429 . . . . 0.0 111.836 179.516 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.43 HD11 ' SG ' ' A' ' 52' ' ' CYS . 1.2 pp -125.57 169.14 12.76 Favored 'General case' 0 C--N 1.307 -1.247 0 N-CA-C 113.313 0.856 . . . . 0.0 113.313 -175.091 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.466 ' O ' ' HA ' ' A' ' 90' ' ' VAL . 52.5 mtm180 -116.16 112.42 21.65 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.176 -0.92 . . . . 0.0 110.722 -178.156 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.412 ' HB3' ' OH ' ' A' ' 51' ' ' TYR . 0.1 OUTLIER -96.91 115.12 26.88 Favored 'General case' 0 C--N 1.31 -1.131 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.522 178.466 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.462 ' C ' HD22 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -143.54 162.12 36.68 Favored 'General case' 0 N--CA 1.443 -0.792 0 CA-C-O 121.745 0.783 . . . . 0.0 111.834 -179.65 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 92.5 t80 -145.79 136.95 24.75 Favored 'General case' 0 C--N 1.309 -1.168 0 N-CA-C 108.785 -0.82 . . . . 0.0 108.785 178.564 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 48.54 29.04 1.94 Allowed 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 124.391 1.076 . . . . 0.0 112.231 -178.417 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 83.57 23.17 54.49 Favored Glycine 0 N--CA 1.447 -0.589 0 C-N-CA 120.935 -0.65 . . . . 0.0 113.26 -179.646 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 3.0 pt20 -130.47 137.41 49.77 Favored 'General case' 0 C--N 1.32 -0.711 0 O-C-N 122.212 -0.581 . . . . 0.0 109.462 179.826 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -73.07 146.62 45.69 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-O 121.704 0.764 . . . . 0.0 110.172 178.154 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 22.6 mm -92.63 119.56 40.45 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.855 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.308 -178.391 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -94.88 161.03 14.32 Favored 'General case' 0 N--CA 1.434 -1.232 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 178.841 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 66.3 m-20 -67.87 -21.18 65.18 Favored 'General case' 0 C--N 1.314 -0.964 0 CA-C-O 121.303 0.573 . . . . 0.0 111.506 -177.918 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 6.1 m-80 -100.44 6.78 44.44 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-O 121.268 0.556 . . . . 0.0 110.1 -179.437 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . 0.571 ' O ' ' HB2' ' A' ' 44' ' ' LEU . 2.2 m170 -83.27 145.84 28.88 Favored 'General case' 0 CA--C 1.5 -0.955 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 178.342 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 68.8 p -118.24 152.91 51.29 Favored Pre-proline 0 C--N 1.301 -1.53 0 C-N-CA 120.824 -0.351 . . . . 0.0 111.476 179.647 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_exo -57.3 -41.03 77.52 Favored 'Trans proline' 0 C--N 1.349 0.584 0 C-N-CA 122.597 2.198 . . . . 0.0 111.431 178.508 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . 0.538 ' HG3' ' N ' ' A' ' 79' ' ' GLU . 48.1 pttt -64.58 -40.92 96.41 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.877 -178.918 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.538 ' N ' ' HG3' ' A' ' 78' ' ' LYS . 55.6 mm-40 -73.55 -35.73 65.55 Favored 'General case' 0 N--CA 1.439 -0.99 0 CA-C-O 120.951 0.405 . . . . 0.0 111.463 -177.592 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.462 HD23 ' CG ' ' A' ' 75' ' ' HIS . 5.5 mt -80.69 -0.93 40.44 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.119 0.485 . . . . 0.0 111.253 -179.35 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 78.26 37.78 27.35 Favored Glycine 0 CA--C 1.51 -0.256 0 C-N-CA 120.872 -0.68 . . . . 0.0 112.963 177.174 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 61.0 mtt -100.18 165.26 11.58 Favored 'General case' 0 C--N 1.311 -1.082 0 N-CA-C 109.844 -0.428 . . . . 0.0 109.844 179.35 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -148.2 -171.32 3.81 Favored 'General case' 0 C--N 1.311 -1.084 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 178.151 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.509 ' HA ' ' HB ' ' A' ' 22' ' ' ILE . 15.8 pt-20 -71.19 138.39 49.5 Favored 'General case' 0 N--CA 1.443 -0.778 0 C-N-CA 120.223 -0.591 . . . . 0.0 110.928 -179.89 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 79.7 -2.29 2.1 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 124.801 1.24 . . . . 0.0 111.433 178.861 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -59.33 162.5 4.65 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-O 121.395 0.617 . . . . 0.0 111.284 179.109 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 7.1 p -129.48 143.38 41.32 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.948 0 CA-C-O 121.285 0.564 . . . . 0.0 111.33 -177.001 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 3.7 mp -114.47 153.9 15.91 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 179.642 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 11.0 tp10 -107.41 138.56 43.39 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 120.802 0.334 . . . . 0.0 110.102 -177.226 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . 0.559 ' HB ' ' HA2' ' A' ' 28' ' ' GLY . 97.1 t -130.62 134.05 62.62 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.974 0 CA-C-O 121.47 0.653 . . . . 0.0 110.922 178.863 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 89.0 m-85 -119.27 -177.36 3.33 Favored 'General case' 0 C--N 1.306 -1.284 0 CA-C-N 115.886 -0.597 . . . . 0.0 109.465 179.799 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . 0.405 ' HG3' ' H ' ' A' ' 94' ' ' GLN . 8.1 tp60 -108.31 148.26 30.3 Favored 'General case' 0 C--N 1.307 -1.263 0 O-C-N 121.934 -0.478 . . . . 0.0 110.38 -179.281 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -137.35 20.07 2.94 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.702 0.763 . . . . 0.0 110.322 174.658 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . 0.405 ' H ' ' HG3' ' A' ' 92' ' ' GLN . 98.8 mt-30 -70.39 -149.07 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.745 0 CA-C-N 115.406 -0.816 . . . . 0.0 110.663 176.825 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 11.1 t -155.21 157.02 36.68 Favored 'General case' 0 C--N 1.316 -0.864 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 -179.115 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -169.14 -152.2 7.67 Favored Glycine 0 N--CA 1.445 -0.718 0 C-N-CA 120.773 -0.727 . . . . 0.0 111.973 -179.08 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.944 0 CA-C-O 118.944 -0.92 . . . . 0.0 111.697 -179.359 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.9 tpt . . . . . 0 N--CA 1.486 1.34 0 CA-C-O 121.476 0.655 . . . . 0.0 110.762 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 15.9 m -131.99 10.34 4.59 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-O 122.356 1.074 . . . . 0.0 108.433 179.499 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -99.03 10.98 40.34 Favored 'General case' 0 C--N 1.308 -1.213 0 CA-C-N 114.507 -1.224 . . . . 0.0 109.906 -174.258 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -78.25 -25.12 46.69 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 115.539 -0.755 . . . . 0.0 111.092 -177.726 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -97.64 150.26 21.36 Favored 'General case' 0 N--CA 1.444 -0.732 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 179.517 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -85.35 121.13 27.64 Favored 'General case' 0 C--N 1.312 -1.059 0 CA-C-O 121.05 0.452 . . . . 0.0 110.325 178.138 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 15.4 ptmt -158.7 131.3 4.41 Favored Pre-proline 0 C--N 1.313 -1.011 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.579 179.891 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -85.31 -28.49 0.83 Allowed 'Trans proline' 0 N--CA 1.453 -0.877 0 C-N-CA 122.465 2.11 . . . . 0.0 112.319 179.1 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 2.3 p -99.36 115.66 29.72 Favored 'General case' 0 N--CA 1.44 -0.969 0 CA-C-O 121.058 0.456 . . . . 0.0 111.833 -177.884 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 61.0 p -46.56 155.24 0.25 Allowed 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 115.681 -0.69 . . . . 0.0 111.659 174.726 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -60.74 107.88 0.76 Allowed 'General case' 0 C--O 1.238 0.476 0 CA-C-O 121.794 0.807 . . . . 0.0 111.498 -178.639 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -147.02 153.95 40.63 Favored 'General case' 0 C--N 1.307 -1.257 0 CA-C-N 115.049 -0.978 . . . . 0.0 109.578 -178.256 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.3 pp -166.85 -178.13 4.14 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.805 0.336 . . . . 0.0 111.266 -176.962 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 158.44 72.11 0.02 OUTLIER Glycine 0 N--CA 1.449 -0.477 0 C-N-CA 120.859 -0.686 . . . . 0.0 112.678 179.884 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -118.57 29.01 7.98 Favored 'General case' 0 C--N 1.312 -1.053 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 178.23 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 28.3 mmtp -99.87 169.26 9.35 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.939 -177.011 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 4.2 mtpp -83.2 -162.73 0.64 Allowed 'General case' 0 C--O 1.237 0.404 0 CA-C-O 120.97 0.414 . . . . 0.0 111.41 179.027 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -163.73 -179.33 6.3 Favored 'General case' 0 N--CA 1.432 -1.333 0 N-CA-C 108.895 -0.78 . . . . 0.0 108.895 -174.401 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 64.5 114.6 0.01 OUTLIER Glycine 0 CA--C 1.528 0.863 0 N-CA-C 115.482 0.953 . . . . 0.0 115.482 175.481 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 4.4 mp0 66.33 37.37 4.87 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 121.361 0.6 . . . . 0.0 111.181 175.193 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 40.0 p90 -107.31 173.97 6.09 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-O 121.385 0.612 . . . . 0.0 110.857 179.777 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . 0.482 ' HB ' ' HA ' ' A' ' 84' ' ' GLU . 27.7 pt -123.45 172.18 11.26 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.205 0 CA-C-O 121.471 0.653 . . . . 0.0 110.131 179.038 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 41.1 mtmt -120.95 142.5 49.69 Favored 'General case' 0 C--N 1.296 -1.745 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 179.899 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.6 mp -135.76 160.83 37.32 Favored 'General case' 0 C--N 1.301 -1.539 0 CA-C-O 121.278 0.561 . . . . 0.0 110.755 176.708 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.424 ' O ' ' HA ' ' A' ' 87' ' ' VAL . 5.1 tmmm? -130.17 142.09 50.61 Favored 'General case' 0 C--N 1.309 -1.156 0 CA-C-O 121.37 0.605 . . . . 0.0 110.315 -178.728 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . 0.509 ' O ' ' HA ' ' A' ' 33' ' ' GLU . 0.9 OUTLIER -112.87 142.82 24.03 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.544 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.353 -179.142 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 44.4 mm -106.97 115.61 48.86 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.138 0 N-CA-C 107.463 -1.31 . . . . 0.0 107.463 174.737 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -78.13 178.31 52.66 Favored Glycine 0 N--CA 1.423 -2.202 0 C-N-CA 120.796 -0.716 . . . . 0.0 113.257 -175.054 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.807 ' H ' ' NE2' ' A' ' 29' ' ' GLN . 0.0 OUTLIER -72.72 -27.63 62.17 Favored 'General case' 0 C--N 1.3 -1.581 0 CA-C-O 122.141 0.972 . . . . 0.0 108.442 -179.02 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -102.73 16.28 26.95 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 114.705 -1.134 . . . . 0.0 108.343 178.375 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 21.3 m 73.46 15.86 4.13 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 115.267 -0.879 . . . . 0.0 111.402 179.003 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 21.6 t -68.04 110.41 3.92 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.05 179.304 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.509 ' HA ' ' O ' ' A' ' 26' ' ' VAL . 4.3 mp0 -86.65 108.48 18.65 Favored 'General case' 0 N--CA 1.445 -0.714 0 CA-C-O 121.3 0.571 . . . . 0.0 110.828 179.9 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 28.7 mm -98.59 141.28 16.61 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.212 0 N-CA-C 109.365 -0.606 . . . . 0.0 109.365 179.582 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 11.4 m170 -120.02 129.31 54.2 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 -179.898 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 1.7 p90 -147.17 162.56 38.62 Favored 'General case' 0 C--N 1.313 -0.984 0 CA-C-O 121.351 0.596 . . . . 0.0 111.625 -177.676 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 19.2 ptpt -118.69 127.61 53.73 Favored 'General case' 0 N--CA 1.445 -0.704 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.853 179.41 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 34.6 m -142.17 162.34 19.46 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 178.098 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.577 ' O ' HG23 ' A' ' 42' ' ' THR . 70.9 tttt -94.46 166.56 12.0 Favored 'General case' 0 C--N 1.305 -1.33 0 O-C-N 121.587 -0.695 . . . . 0.0 110.649 -179.426 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -76.1 -35.06 59.48 Favored 'General case' 0 C--N 1.328 -0.362 0 O-C-N 121.914 -0.491 . . . . 0.0 111.923 -177.436 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 15.1 t -90.05 16.91 7.52 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 120.996 0.426 . . . . 0.0 111.606 -177.961 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' THR . . . . . 0.577 HG23 ' O ' ' A' ' 39' ' ' LYS . 2.0 t -106.86 170.63 7.83 Favored 'General case' 0 C--N 1.321 -0.67 0 O-C-N 121.938 -0.476 . . . . 0.0 110.174 -178.624 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 44.3 m170 -85.41 147.35 26.54 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.557 0.694 . . . . 0.0 111.522 -179.75 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.535 ' HB2' ' O ' ' A' ' 75' ' ' HIS . 0.2 OUTLIER -73.77 -13.26 60.92 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.309 -179.345 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.735 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -55.75 -43.37 76.6 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.986 -178.966 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 12.0 ptmt -68.34 -29.15 67.81 Favored 'General case' 0 C--O 1.213 -0.861 0 CA-C-O 121.127 0.489 . . . . 0.0 110.596 -178.929 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.484 ' HB3' HD12 ' A' ' 44' ' ' LEU . 9.1 tt -73.23 -49.03 30.1 Favored 'General case' 0 C--N 1.305 -1.357 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.153 -179.866 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.523 ' HA ' ' CD2' ' A' ' 51' ' ' TYR . 7.7 ptmm? -63.65 -41.63 98.2 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.726 -177.563 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.735 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 8.4 pt-20 -69.71 -33.76 72.95 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 121.0 0.428 . . . . 0.0 110.426 176.992 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 4.7 m -67.83 -41.76 82.49 Favored 'General case' 0 C--O 1.236 0.354 0 N-CA-C 112.512 0.56 . . . . 0.0 112.512 -178.312 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.523 ' CD2' ' HA ' ' A' ' 48' ' ' LYS . 2.7 p90 -76.78 -32.38 57.65 Favored 'General case' 0 N--CA 1.444 -0.734 0 C-N-CA 119.436 -0.905 . . . . 0.0 110.229 -179.096 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . 0.541 ' SG ' HD13 ' A' ' 62' ' ' LEU . 98.6 m -62.34 -45.08 94.8 Favored 'General case' 0 CA--C 1.51 -0.559 0 CA-C-O 120.967 0.413 . . . . 0.0 110.646 178.857 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 10.6 pt20 -66.36 -34.67 78.48 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.159 -179.727 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.433 ' HA ' ' NE ' ' A' ' 54' ' ' ARG . 3.9 mmp_? -59.23 -39.56 83.11 Favored 'General case' 0 CA--C 1.514 -0.432 0 CA-C-O 121.023 0.44 . . . . 0.0 111.329 177.707 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.425 HE21 ' HB2' ' A' ' 55' ' ' GLN . 3.3 mt-30 -77.46 -21.28 53.17 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-O 121.137 0.494 . . . . 0.0 110.715 179.371 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 82.75 30.85 31.22 Favored Glycine 0 N--CA 1.444 -0.813 0 C-N-CA 120.937 -0.649 . . . . 0.0 112.217 179.25 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 35.6 m -133.65 148.31 68.06 Favored Pre-proline 0 C--N 1.326 -0.439 0 O-C-N 122.42 -0.459 . . . . 0.0 110.803 -179.045 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . 0.558 ' HG2' ' OG ' ' A' ' 61' ' ' SER . 18.0 Cg_endo -62.45 153.43 71.05 Favored 'Trans proline' 0 N--CA 1.461 -0.422 0 C-N-CA 122.585 2.19 . . . . 0.0 111.866 177.205 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.465 ' HG2' ' SG ' ' A' ' 52' ' ' CYS . 74.1 mtp -72.69 -8.72 56.76 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.134 0.493 . . . . 0.0 111.529 -176.356 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.9 p-10 -91.63 -8.75 46.32 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-O 121.268 0.556 . . . . 0.0 110.561 179.551 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.558 ' OG ' ' HG2' ' A' ' 58' ' ' PRO . 75.6 m -87.25 -18.03 31.2 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-O 121.095 0.474 . . . . 0.0 111.862 -179.742 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.541 HD13 ' SG ' ' A' ' 52' ' ' CYS . 1.3 pp -131.19 169.69 15.59 Favored 'General case' 0 C--N 1.31 -1.114 0 N-CA-C 113.067 0.765 . . . . 0.0 113.067 -176.999 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.434 ' O ' ' HA ' ' A' ' 90' ' ' VAL . 35.8 mtm180 -119.72 121.15 38.56 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.416 -177.748 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.427 ' HB3' ' OH ' ' A' ' 51' ' ' TYR . 0.2 OUTLIER -105.1 117.96 35.33 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-O 121.206 0.527 . . . . 0.0 111.462 179.475 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.451 ' C ' HD21 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -147.85 164.42 33.74 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 121.208 0.528 . . . . 0.0 110.471 179.606 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 77.9 t80 -144.69 135.84 25.14 Favored 'General case' 0 C--N 1.313 -0.994 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 178.134 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 50.88 26.37 2.61 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 124.117 0.967 . . . . 0.0 112.327 -179.899 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 85.04 23.27 49.73 Favored Glycine 0 N--CA 1.445 -0.726 0 C-N-CA 120.871 -0.68 . . . . 0.0 112.902 -179.38 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . 0.405 ' OE1' HD21 ' A' ' 80' ' ' LEU . 2.8 pt20 -129.92 134.39 47.45 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 178.953 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 10.8 ptt180 -65.56 148.68 51.34 Favored 'General case' 0 C--N 1.31 -1.136 0 CA-C-O 121.586 0.708 . . . . 0.0 111.113 177.824 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.438 HG12 ' HA ' ' A' ' 65' ' ' LEU . 21.0 mm -98.92 115.56 39.73 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.301 0 N-CA-C 109.629 -0.508 . . . . 0.0 109.629 177.724 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -96.34 165.99 11.93 Favored 'General case' 0 N--CA 1.437 -1.091 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 -179.237 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . 0.412 ' CA ' ' HB3' ' A' ' 45' ' ' LYS . 37.1 m-20 -69.32 -25.44 64.22 Favored 'General case' 0 C--N 1.31 -1.124 0 CA-C-O 121.518 0.675 . . . . 0.0 110.982 -178.268 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 8.5 m-80 -96.5 4.66 51.93 Favored 'General case' 0 C--N 1.311 -1.076 0 CA-C-O 121.491 0.662 . . . . 0.0 109.708 -178.026 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . 0.535 ' O ' ' HB2' ' A' ' 44' ' ' LEU . 4.5 m170 -83.77 144.75 29.11 Favored 'General case' 0 CA--C 1.503 -0.855 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 178.849 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.5 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 77.6 p -117.85 155.29 51.06 Favored Pre-proline 0 C--N 1.302 -1.499 0 N-CA-C 110.276 -0.268 . . . . 0.0 110.276 178.516 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -67.49 -30.57 35.63 Favored 'Trans proline' 0 N--CA 1.454 -0.822 0 C-N-CA 121.95 1.767 . . . . 0.0 111.043 -179.896 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . 0.462 ' HG3' ' N ' ' A' ' 79' ' ' GLU . 33.2 pttt -70.73 -38.47 73.57 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.952 0.406 . . . . 0.0 110.551 179.59 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.462 ' N ' ' HG3' ' A' ' 78' ' ' LYS . 5.0 mm-40 -74.14 -37.64 64.0 Favored 'General case' 0 N--CA 1.447 -0.623 0 CA-C-O 121.015 0.436 . . . . 0.0 111.269 -179.572 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.5 ' HG ' ' O ' ' A' ' 76' ' ' THR . 5.9 mt -77.29 -5.04 47.96 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.278 0.561 . . . . 0.0 110.872 -179.862 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 78.34 42.96 13.7 Favored Glycine 0 C--O 1.227 -0.34 0 C-N-CA 121.129 -0.558 . . . . 0.0 113.217 176.733 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 61.4 mtt -101.65 165.68 11.1 Favored 'General case' 0 C--N 1.315 -0.932 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 179.51 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -142.6 -170.72 3.27 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 110.073 -0.343 . . . . 0.0 110.073 177.104 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.482 ' HA ' ' HB ' ' A' ' 22' ' ' ILE . 14.4 pt-20 -68.7 135.94 52.11 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.97 0.414 . . . . 0.0 111.003 -179.421 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 79.07 4.41 2.33 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 124.361 1.064 . . . . 0.0 111.158 177.574 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 17.6 t0 -60.64 159.26 11.02 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-O 121.422 0.629 . . . . 0.0 110.982 178.515 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . 0.424 ' HA ' ' O ' ' A' ' 25' ' ' LYS . 7.4 p -127.05 141.48 46.14 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.243 0 CA-C-O 121.386 0.612 . . . . 0.0 111.417 -177.387 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 3.6 mp -111.33 155.91 12.61 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.743 0 CA-C-N 116.203 -0.453 . . . . 0.0 109.82 -179.379 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 6.3 tp10 -105.34 135.3 46.97 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.929 0.395 . . . . 0.0 110.227 -177.25 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . 0.434 ' HA ' ' O ' ' A' ' 63' ' ' ARG . 60.4 t -128.87 134.75 63.72 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.912 0 CA-C-O 121.119 0.485 . . . . 0.0 110.809 178.148 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 87.9 m-85 -119.05 173.9 6.63 Favored 'General case' 0 C--N 1.32 -0.713 0 N-CA-C 108.947 -0.761 . . . . 0.0 108.947 178.115 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 7.1 tp60 -102.44 146.85 27.5 Favored 'General case' 0 C--N 1.314 -0.947 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 178.633 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 23.0 pt-20 -139.12 19.91 2.61 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.165 0.507 . . . . 0.0 111.191 176.267 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -57.68 -166.12 0.0 OUTLIER 'General case' 0 CA--C 1.543 0.683 0 CA-C-O 121.645 0.736 . . . . 0.0 112.57 177.231 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 9.0 t -138.0 137.6 38.05 Favored 'General case' 0 N--CA 1.44 -0.954 0 O-C-N 121.554 -0.716 . . . . 0.0 110.377 -175.253 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -107.41 46.93 1.1 Allowed Glycine 0 N--CA 1.445 -0.767 0 N-CA-C 111.46 -0.656 . . . . 0.0 111.46 178.516 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.435 -1.375 0 CA-C-O 119.024 -0.875 . . . . 0.0 110.982 -179.149 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.475 0.788 0 CA-C-O 120.978 0.418 . . . . 0.0 111.833 . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 6.6 m -82.4 -79.92 0.17 Allowed 'General case' 0 N--CA 1.444 -0.746 0 CA-C-O 120.872 0.368 . . . . 0.0 111.675 -178.575 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 26.9 t70 175.26 129.2 0.03 OUTLIER 'General case' 0 CA--C 1.497 -1.078 0 N-CA-C 106.447 -1.686 . . . . 0.0 106.447 -178.032 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 6.8 pt20 -147.59 -37.24 0.2 Allowed 'General case' 0 C--N 1.286 -2.189 0 CA-C-O 121.286 0.565 . . . . 0.0 111.225 -174.589 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -118.75 -164.15 1.01 Allowed 'General case' 0 C--N 1.316 -0.866 0 N-CA-C 109.584 -0.524 . . . . 0.0 109.584 179.145 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -147.08 130.07 16.32 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-O 121.171 0.51 . . . . 0.0 111.266 -179.133 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 46.1 mmtm -131.03 138.05 32.11 Favored Pre-proline 0 C--N 1.311 -1.09 0 CA-C-N 115.848 -0.615 . . . . 0.0 109.493 176.944 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -80.07 102.04 1.41 Allowed 'Trans proline' 0 N--CA 1.444 -1.4 0 C-N-CA 122.564 2.176 . . . . 0.0 112.692 -177.362 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 38.3 m -87.45 143.02 27.43 Favored 'General case' 0 C--N 1.312 -1.044 0 N-CA-C 108.659 -0.867 . . . . 0.0 108.659 177.818 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 12.2 t -97.23 162.81 13.18 Favored 'General case' 0 C--N 1.314 -0.974 0 O-C-N 121.849 -0.532 . . . . 0.0 110.88 -177.197 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -151.78 151.2 31.05 Favored 'General case' 0 C--N 1.315 -0.897 0 N-CA-C 109.122 -0.695 . . . . 0.0 109.122 -179.782 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -69.61 91.99 0.62 Allowed 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.275 0.559 . . . . 0.0 110.63 178.982 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 88.2 mt -98.07 158.48 15.52 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-O 121.199 0.524 . . . . 0.0 110.246 -179.98 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 105.14 23.14 7.84 Favored Glycine 0 N--CA 1.438 -1.189 0 C-N-CA 120.61 -0.805 . . . . 0.0 111.308 -179.543 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -102.97 34.46 2.86 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 122.445 1.117 . . . . 0.0 108.925 -179.01 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 6.9 ptmm? -159.62 179.98 8.4 Favored 'General case' 0 C--N 1.31 -1.113 0 CA-C-N 114.624 -1.171 . . . . 0.0 109.106 -175.872 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.407 ' HE2' ' HB2' ' A' ' 17' ' ' LYS . 0.0 OUTLIER -134.9 150.44 50.43 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 121.459 0.647 . . . . 0.0 111.015 179.607 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -120.67 -174.96 2.92 Favored 'General case' 0 C--N 1.307 -1.247 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.92 177.395 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 120.52 124.95 3.2 Favored Glycine 0 N--CA 1.447 -0.631 0 C-N-CA 120.908 -0.663 . . . . 0.0 112.192 -177.893 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 42.8 mm-40 62.37 53.77 2.7 Favored 'General case' 0 CA--C 1.515 -0.382 0 CA-C-O 121.782 0.801 . . . . 0.0 111.56 178.851 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.528 ' CE1' ' HD3' ' A' ' 37' ' ' LYS . 44.5 p90 -127.5 171.49 11.54 Favored 'General case' 0 C--N 1.301 -1.541 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.232 179.904 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 24.5 pt -119.98 171.04 8.85 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.212 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 176.291 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 1.8 mppt? -118.44 142.84 47.16 Favored 'General case' 0 C--N 1.296 -1.74 0 N-CA-C 109.017 -0.735 . . . . 0.0 109.017 -179.508 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.5 mp -135.3 162.83 31.46 Favored 'General case' 0 C--N 1.301 -1.508 0 CA-C-O 121.197 0.523 . . . . 0.0 110.572 176.67 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.423 ' O ' ' HA ' ' A' ' 87' ' ' VAL . 5.3 tmmm? -132.5 142.55 49.26 Favored 'General case' 0 N--CA 1.434 -1.274 0 CA-C-O 121.436 0.636 . . . . 0.0 110.775 -178.775 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . 0.493 HG13 ' CD1' ' A' ' 51' ' ' TYR . 0.9 OUTLIER -115.98 141.89 31.57 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.324 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.036 -179.954 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.439 ' O ' ' HB ' ' A' ' 90' ' ' VAL . 48.3 mm -104.6 118.27 51.62 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.109 0 N-CA-C 107.425 -1.324 . . . . 0.0 107.425 174.626 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . 0.451 ' HA2' ' HB ' ' A' ' 90' ' ' VAL . . . -91.53 162.22 27.86 Favored Glycine 0 N--CA 1.423 -2.215 0 C-N-CA 120.145 -1.026 . . . . 0.0 111.32 -177.064 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.83 -24.45 62.01 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-O 121.531 0.681 . . . . 0.0 111.351 177.701 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 36.4 t70 -89.1 9.1 26.65 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-O 121.401 0.62 . . . . 0.0 110.177 178.598 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 8.6 t 70.06 16.7 7.48 Favored 'General case' 0 C--N 1.342 0.279 0 CA-C-O 122.177 0.989 . . . . 0.0 109.301 -177.458 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 5.0 t -77.13 111.56 12.86 Favored 'General case' 0 N--CA 1.444 -0.754 0 CA-C-N 114.997 -1.001 . . . . 0.0 110.195 -179.821 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.419 ' HA ' ' O ' ' A' ' 26' ' ' VAL . 41.3 mt-10 -87.15 112.08 21.59 Favored 'General case' 0 CA--C 1.507 -0.705 0 N-CA-C 109.803 -0.443 . . . . 0.0 109.803 177.861 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 32.1 mm -101.6 136.86 31.54 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.659 0 N-CA-C 109.489 -0.56 . . . . 0.0 109.489 179.681 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 11.7 m170 -117.28 134.71 54.49 Favored 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 179.397 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -147.13 159.47 43.58 Favored 'General case' 0 C--N 1.309 -1.184 0 CA-C-O 121.22 0.533 . . . . 0.0 111.332 -177.765 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.528 ' HD3' ' CE1' ' A' ' 21' ' ' TYR . 93.1 mttt -116.41 117.21 29.32 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.743 -178.712 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 32.6 m -137.74 158.39 33.83 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 N-CA-C 109.884 -0.413 . . . . 0.0 109.884 179.787 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 24.2 mtpp -81.85 175.92 10.02 Favored 'General case' 0 CA--C 1.503 -0.837 0 CA-C-O 121.497 0.665 . . . . 0.0 111.205 178.382 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -83.05 -32.39 26.86 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-N 115.712 -0.676 . . . . 0.0 111.118 178.843 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 14.8 t -97.13 15.21 23.25 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.03 0.443 . . . . 0.0 112.002 -177.351 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 4.2 t -98.71 163.99 12.41 Favored 'General case' 0 C--N 1.316 -0.852 0 O-C-N 121.87 -0.518 . . . . 0.0 110.052 -178.908 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 27.6 m170 -77.34 142.68 39.24 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.458 0.647 . . . . 0.0 111.421 179.114 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.601 ' O ' ' HG3' ' A' ' 48' ' ' LYS . 0.2 OUTLIER -70.81 -15.96 62.7 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 115.391 -0.822 . . . . 0.0 109.41 -179.878 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.65 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -55.22 -45.43 75.96 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.868 -0.605 . . . . 0.0 112.576 -177.506 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 21.9 ptmt -66.46 -28.99 69.02 Favored 'General case' 0 C--O 1.22 -0.494 0 CA-C-O 121.283 0.563 . . . . 0.0 110.407 -178.699 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.494 ' HB3' HD11 ' A' ' 44' ' ' LEU . 8.1 tt -70.16 -47.72 60.41 Favored 'General case' 0 C--N 1.312 -1.052 0 CA-C-N 115.721 -0.672 . . . . 0.0 109.668 178.726 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.601 ' HG3' ' O ' ' A' ' 44' ' ' LEU . 20.9 mtpt -57.31 -48.12 79.77 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-O 121.512 0.673 . . . . 0.0 110.434 -179.329 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.65 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 6.3 pt-20 -71.61 -32.63 68.21 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.859 -178.386 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' SER . . . . . 0.411 ' O ' ' HG2' ' A' ' 53' ' ' GLN . 28.5 t -63.87 -46.44 84.92 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-O 121.173 0.511 . . . . 0.0 110.944 -179.687 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.493 ' CD1' HG13 ' A' ' 26' ' ' VAL . 1.9 p90 -76.46 -32.55 58.46 Favored 'General case' 0 N--CA 1.44 -0.931 0 C-N-CA 119.976 -0.689 . . . . 0.0 110.564 -177.783 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . 0.509 ' SG ' HD11 ' A' ' 62' ' ' LEU . 74.7 m -63.63 -43.37 97.03 Favored 'General case' 0 CA--C 1.511 -0.537 0 CA-C-O 121.159 0.504 . . . . 0.0 110.704 179.226 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . 0.411 ' HG2' ' O ' ' A' ' 50' ' ' SER . 13.7 pt20 -67.5 -34.77 77.82 Favored 'General case' 0 N--CA 1.443 -0.786 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.271 -179.875 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.513 ' HA ' ' NE ' ' A' ' 54' ' ' ARG . 4.0 mmp_? -58.08 -38.53 76.55 Favored 'General case' 0 C--N 1.347 0.47 0 CA-C-O 121.075 0.464 . . . . 0.0 111.444 177.496 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.438 HE21 ' HB2' ' A' ' 55' ' ' GLN . 3.0 mt-30 -79.91 -21.13 44.3 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 121.218 0.533 . . . . 0.0 110.956 179.519 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 83.64 29.31 32.81 Favored Glycine 0 N--CA 1.448 -0.553 0 C-N-CA 121.005 -0.617 . . . . 0.0 112.24 178.313 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 28.8 m -130.62 151.59 78.98 Favored Pre-proline 0 C--N 1.323 -0.56 0 O-C-N 122.238 -0.566 . . . . 0.0 111.074 -177.824 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . 0.545 ' HG2' ' OG ' ' A' ' 61' ' ' SER . 19.2 Cg_endo -64.5 155.11 68.16 Favored 'Trans proline' 0 N--CA 1.455 -0.773 0 C-N-CA 122.301 2.001 . . . . 0.0 111.481 176.405 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 82.4 mtp -74.69 -8.77 57.41 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-O 121.146 0.498 . . . . 0.0 111.458 -176.101 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 29.9 p30 -91.58 -10.43 40.56 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 121.328 0.585 . . . . 0.0 110.749 -179.445 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.545 ' OG ' ' HG2' ' A' ' 58' ' ' PRO . 71.4 m -83.47 -24.8 31.64 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 121.175 0.512 . . . . 0.0 111.649 -179.106 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.509 HD11 ' SG ' ' A' ' 52' ' ' CYS . 1.4 pp -124.99 170.14 11.43 Favored 'General case' 0 C--N 1.302 -1.473 0 N-CA-C 112.685 0.624 . . . . 0.0 112.685 -175.629 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.529 ' O ' ' HA ' ' A' ' 90' ' ' VAL . 42.2 mtm180 -119.14 120.02 35.89 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.811 -0.632 . . . . 0.0 110.66 -178.223 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -102.61 114.76 29.25 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-O 121.124 0.488 . . . . 0.0 110.993 178.264 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.444 ' C ' HD23 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -143.72 162.91 34.77 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-O 121.39 0.614 . . . . 0.0 111.059 -179.854 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 85.9 t80 -144.61 134.15 23.35 Favored 'General case' 0 C--N 1.31 -1.137 0 CA-C-N 116.01 -0.541 . . . . 0.0 109.614 179.168 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 49.31 26.85 1.69 Allowed 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 124.282 1.033 . . . . 0.0 112.562 179.964 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 87.25 22.81 42.99 Favored Glycine 0 N--CA 1.446 -0.653 0 C-N-CA 121.049 -0.596 . . . . 0.0 113.471 -179.683 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -130.06 138.2 50.62 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 179.198 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -72.34 146.75 46.89 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-O 121.28 0.562 . . . . 0.0 110.031 178.065 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 23.6 mm -94.94 122.27 46.24 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.255 0 CA-C-O 121.174 0.511 . . . . 0.0 110.546 -179.016 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -96.67 160.75 14.21 Favored 'General case' 0 N--CA 1.44 -0.949 0 N-CA-C 109.468 -0.567 . . . . 0.0 109.468 179.561 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . 0.437 ' CA ' ' HB3' ' A' ' 45' ' ' LYS . 11.6 p-10 -68.94 -21.9 64.17 Favored 'General case' 0 C--N 1.311 -1.08 0 CA-C-O 121.377 0.608 . . . . 0.0 111.04 -179.323 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 4.9 m-80 -96.8 1.86 51.23 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-O 121.209 0.528 . . . . 0.0 109.63 -179.721 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . 0.557 ' O ' ' HB2' ' A' ' 44' ' ' LEU . 2.8 m170 -81.29 146.32 30.46 Favored 'General case' 0 CA--C 1.501 -0.915 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 -179.234 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.458 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 72.7 p -118.48 153.83 52.08 Favored Pre-proline 0 C--N 1.302 -1.465 0 C-N-CA 121.038 -0.265 . . . . 0.0 110.699 178.383 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 22.1 Cg_endo -62.1 -37.92 60.21 Favored 'Trans proline' 0 N--CA 1.455 -0.783 0 C-N-CA 122.197 1.931 . . . . 0.0 111.395 -179.387 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . 0.535 ' HG3' ' N ' ' A' ' 79' ' ' GLU . 36.2 pttt -66.11 -41.52 90.46 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.917 0.389 . . . . 0.0 110.797 -179.652 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.535 ' N ' ' HG3' ' A' ' 78' ' ' LYS . 49.7 mm-40 -70.33 -35.9 73.92 Favored 'General case' 0 CA--C 1.515 -0.398 0 CA-C-O 121.023 0.44 . . . . 0.0 111.305 -178.63 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.515 HD22 ' CG ' ' A' ' 75' ' ' HIS . 5.2 mt -78.15 -8.02 57.77 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 120.514 -0.474 . . . . 0.0 110.712 179.843 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 84.07 38.98 9.61 Favored Glycine 0 C--N 1.321 -0.265 0 C-N-CA 120.965 -0.636 . . . . 0.0 112.777 177.905 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 61.6 mtt -100.87 162.34 12.97 Favored 'General case' 0 C--N 1.314 -0.946 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 179.193 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . 0.427 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 4.9 pt-20 -143.4 -171.83 3.58 Favored 'General case' 0 C--N 1.306 -1.303 0 N-CA-C 109.914 -0.402 . . . . 0.0 109.914 179.953 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -69.85 136.59 50.89 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.103 0.478 . . . . 0.0 111.235 -178.777 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 75.55 5.21 4.04 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.712 1.205 . . . . 0.0 111.285 179.306 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . 0.427 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 1.9 t0 -62.78 162.48 10.85 Favored 'General case' 0 C--O 1.238 0.495 0 CA-C-O 121.347 0.594 . . . . 0.0 111.065 177.719 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . 0.423 ' HA ' ' O ' ' A' ' 25' ' ' LYS . 11.4 p -128.51 144.07 39.09 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.911 0 CA-C-O 121.383 0.611 . . . . 0.0 111.734 -176.82 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 3.6 mp -115.5 153.66 17.02 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.758 0 N-CA-C 108.728 -0.842 . . . . 0.0 108.728 178.518 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -107.85 139.44 42.44 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 121.195 0.521 . . . . 0.0 110.915 -176.836 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . 0.529 ' HA ' ' O ' ' A' ' 63' ' ' ARG . 63.3 t -128.77 133.47 66.25 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.023 0 CA-C-O 121.412 0.625 . . . . 0.0 110.949 179.844 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 86.7 m-85 -118.63 179.67 4.06 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-N 115.972 -0.558 . . . . 0.0 109.79 179.183 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 7.5 tp60 -109.47 131.84 54.69 Favored 'General case' 0 C--N 1.316 -0.871 0 O-C-N 122.267 -0.271 . . . . 0.0 110.763 179.207 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . 0.404 ' OE1' ' HG2' ' A' ' 63' ' ' ARG . 7.4 pt-20 -126.06 19.27 7.71 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-O 120.753 0.311 . . . . 0.0 110.691 177.899 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 97.7 mt-30 -54.31 -169.18 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.131 0 N-CA-C 113.128 0.788 . . . . 0.0 113.128 178.422 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 8.3 t -149.16 151.42 34.31 Favored 'General case' 0 C--N 1.315 -0.902 0 O-C-N 121.501 -0.749 . . . . 0.0 110.968 -174.928 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -146.88 44.84 0.8 Allowed Glycine 0 N--CA 1.441 -0.99 0 N-CA-C 111.389 -0.685 . . . . 0.0 111.389 -179.646 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.444 -0.814 0 CA-C-O 119.14 -0.811 . . . . 0.0 111.265 -179.763 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.626 ' HA ' ' OD2' ' A' ' 73' ' ' ASP . 79.1 mtp . . . . . 0 N--CA 1.478 0.952 0 CA-C-O 121.34 0.59 . . . . 0.0 111.13 . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 43.1 m -103.63 3.52 34.55 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-O 121.837 0.827 . . . . 0.0 110.199 -177.966 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -86.81 41.21 0.95 Allowed 'General case' 0 C--N 1.305 -1.341 0 CA-C-N 115.291 -0.868 . . . . 0.0 109.719 -178.259 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 5.7 pt20 -164.9 152.16 11.15 Favored 'General case' 0 N--CA 1.445 -0.712 0 CA-C-N 115.77 -0.65 . . . . 0.0 109.737 -176.426 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -170.29 -178.75 2.85 Favored 'General case' 0 C--N 1.317 -0.841 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 179.387 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -84.63 124.92 32.0 Favored 'General case' 0 N--CA 1.438 -1.045 0 N-CA-C 108.683 -0.858 . . . . 0.0 108.683 175.525 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 21.3 ptmt -114.96 150.04 43.49 Favored Pre-proline 0 C--N 1.301 -1.531 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.234 -176.178 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -60.3 144.97 99.5 Favored 'Trans proline' 0 N--CA 1.453 -0.897 0 C-N-CA 122.304 2.003 . . . . 0.0 111.351 -179.982 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 23.8 m 65.02 54.88 1.2 Allowed 'General case' 0 C--O 1.236 0.372 0 CA-C-O 121.608 0.718 . . . . 0.0 109.626 -177.723 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 4.7 m -71.58 136.16 47.3 Favored 'General case' 0 N--CA 1.443 -0.806 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.146 -178.76 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -137.61 96.93 3.33 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 121.201 0.524 . . . . 0.0 110.495 179.51 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -126.18 126.97 44.97 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.133 179.228 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 44.5 mt -96.75 142.5 28.69 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-O 121.549 0.69 . . . . 0.0 111.273 -176.916 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -116.81 60.59 0.43 Allowed Glycine 0 N--CA 1.439 -1.158 0 N-CA-C 111.349 -0.7 . . . . 0.0 111.349 179.242 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 42.9 m-20 -93.59 5.82 50.34 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-O 122.002 0.906 . . . . 0.0 110.588 -178.762 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.543 ' HD2' ' N ' ' A' ' 16' ' ' LYS . 0.2 OUTLIER -106.63 136.47 46.36 Favored 'General case' 0 C--N 1.303 -1.447 0 CA-C-N 115.154 -0.93 . . . . 0.0 108.892 178.619 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 22.3 mmtm -96.05 -168.57 1.78 Allowed 'General case' 0 C--N 1.31 -1.15 0 CA-C-O 121.499 0.666 . . . . 0.0 112.615 -175.984 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.551 ' HB2' ' CE1' ' A' ' 21' ' ' TYR . 10.0 pt-20 -90.16 -166.84 1.68 Allowed 'General case' 0 N--CA 1.445 -0.721 0 CA-C-N 115.481 -0.782 . . . . 0.0 111.151 -176.988 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.412 ' O ' ' HB2' ' A' ' 20' ' ' GLU . . . 117.17 130.06 4.34 Favored Glycine 0 N--CA 1.438 -1.189 0 N-CA-C 111.543 -0.623 . . . . 0.0 111.543 -177.375 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.412 ' HB2' ' O ' ' A' ' 19' ' ' GLY . 1.6 mp0 70.56 34.11 2.22 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 122.819 0.448 . . . . 0.0 110.981 178.934 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.551 ' CE1' ' HB2' ' A' ' 18' ' ' GLU . 44.4 p90 -121.62 164.03 17.98 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 121.561 0.696 . . . . 0.0 111.719 -177.818 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . 0.467 ' HB ' ' HA ' ' A' ' 84' ' ' GLU . 25.9 pt -119.99 172.37 7.16 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.214 0 CA-C-N 115.114 -0.948 . . . . 0.0 109.79 176.697 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.477 ' HE3' ' HG3' ' A' ' 85' ' ' GLU . 0.0 OUTLIER -117.43 149.03 41.24 Favored 'General case' 0 C--N 1.293 -1.872 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 -179.156 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -142.04 158.41 43.79 Favored 'General case' 0 C--N 1.3 -1.581 0 CA-C-O 121.406 0.622 . . . . 0.0 111.477 175.201 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 5.3 tmmm? -128.73 141.97 51.15 Favored 'General case' 0 N--CA 1.436 -1.158 0 CA-C-N 115.604 -0.725 . . . . 0.0 110.225 179.945 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . 0.537 ' O ' ' HA ' ' A' ' 33' ' ' GLU . 0.9 OUTLIER -112.92 142.35 25.59 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.442 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.293 -179.372 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.473 ' O ' ' HB ' ' A' ' 90' ' ' VAL . 44.6 mm -103.92 115.22 45.45 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.359 0 N-CA-C 106.83 -1.544 . . . . 0.0 106.83 173.562 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . 0.424 ' HA2' ' HB ' ' A' ' 90' ' ' VAL . . . -86.26 161.64 34.41 Favored Glycine 0 N--CA 1.422 -2.256 0 C-N-CA 120.022 -1.085 . . . . 0.0 111.185 -175.971 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.17 -24.08 62.77 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-O 121.417 0.627 . . . . 0.0 111.081 176.556 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -96.9 20.1 11.63 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 121.504 0.669 . . . . 0.0 109.658 178.774 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 43.2 m 64.28 17.61 10.83 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-O 121.84 0.829 . . . . 0.0 110.53 -179.101 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 10.6 t -76.8 108.78 10.06 Favored 'General case' 0 N--CA 1.444 -0.734 0 CA-C-N 115.152 -0.931 . . . . 0.0 110.222 -179.372 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.537 ' HA ' ' O ' ' A' ' 26' ' ' VAL . 41.9 mt-10 -87.15 109.79 19.69 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 121.363 0.602 . . . . 0.0 109.943 178.38 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 33.5 mm -100.9 139.11 23.02 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.431 0 CA-C-N 116.037 -0.529 . . . . 0.0 109.596 -178.756 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 12.2 m170 -117.34 132.4 56.6 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 109.395 -0.595 . . . . 0.0 109.395 179.851 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 1.3 p90 -147.61 163.9 35.16 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-O 121.216 0.532 . . . . 0.0 111.603 -178.668 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.481 ' HD3' ' CE2' ' A' ' 21' ' ' TYR . 88.1 mttt -119.66 119.47 33.8 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.66 -179.123 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 35.7 m -138.81 157.93 29.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-O 120.911 0.386 . . . . 0.0 110.276 178.904 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.42 ' HA ' ' HA ' ' A' ' 21' ' ' TYR . 47.5 mtpt -83.12 178.14 8.25 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-O 121.45 0.643 . . . . 0.0 111.426 179.073 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -87.26 -31.17 20.4 Favored 'General case' 0 C--N 1.313 -1.01 0 CA-C-O 121.371 0.605 . . . . 0.0 110.144 178.04 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 9.0 t -98.78 19.71 14.36 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.312 -177.268 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 10.0 t -105.54 176.01 5.31 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 178.678 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 53.0 m170 -91.76 147.34 23.06 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-O 121.432 0.634 . . . . 0.0 111.387 -179.426 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.603 ' HB2' ' O ' ' A' ' 75' ' ' HIS . 0.2 OUTLIER -74.58 -12.61 60.5 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 115.53 -0.759 . . . . 0.0 109.226 179.113 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.766 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -57.15 -45.11 83.88 Favored 'General case' 0 N--CA 1.442 -0.825 0 CA-C-N 115.563 -0.744 . . . . 0.0 111.899 -178.55 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.42 ' HG3' ' N ' ' A' ' 47' ' ' LEU . 19.4 ptpt -65.85 -32.1 73.43 Favored 'General case' 0 CA--C 1.508 -0.651 0 CA-C-O 121.695 0.759 . . . . 0.0 109.883 -178.888 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.45 ' HB3' HD12 ' A' ' 44' ' ' LEU . 8.2 tt -71.05 -51.55 24.65 Favored 'General case' 0 N--CA 1.428 -1.553 0 CA-C-N 115.197 -0.911 . . . . 0.0 110.738 -176.724 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.453 ' HA ' ' CD2' ' A' ' 51' ' ' TYR . 6.4 ptmm? -61.19 -41.01 96.04 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.721 -178.017 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.766 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 8.8 pt-20 -72.46 -30.92 65.0 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-O 121.029 0.443 . . . . 0.0 110.703 178.012 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' SER . . . . . 0.562 ' O ' ' HG2' ' A' ' 54' ' ' ARG . 32.7 t -68.71 -44.73 73.31 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.945 0.402 . . . . 0.0 111.677 -178.632 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.453 ' CD2' ' HA ' ' A' ' 48' ' ' LYS . 2.3 p90 -75.06 -32.82 61.61 Favored 'General case' 0 N--CA 1.446 -0.657 0 C-N-CA 119.512 -0.875 . . . . 0.0 110.176 -178.09 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . 0.498 ' SG ' HD11 ' A' ' 62' ' ' LEU . 83.5 m -59.8 -43.94 94.2 Favored 'General case' 0 C--O 1.238 0.454 0 CA-C-O 120.938 0.399 . . . . 0.0 110.703 177.985 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 11.9 pt20 -69.94 -33.69 72.47 Favored 'General case' 0 N--CA 1.447 -0.622 0 C-N-CA 120.769 -0.373 . . . . 0.0 110.617 -179.213 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.562 ' HG2' ' O ' ' A' ' 50' ' ' SER . 9.3 mmp_? -54.78 -40.99 69.99 Favored 'General case' 0 C--N 1.351 0.634 0 CA-C-O 121.403 0.62 . . . . 0.0 110.607 176.192 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.427 HE21 ' HB2' ' A' ' 55' ' ' GLN . 2.9 mt-30 -78.45 -21.48 49.05 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.747 179.6 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 81.74 27.48 46.4 Favored Glycine 0 N--CA 1.443 -0.887 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.223 179.276 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 33.9 m -127.18 148.1 64.62 Favored Pre-proline 0 C--N 1.321 -0.666 0 O-C-N 122.505 -0.409 . . . . 0.0 110.283 -179.145 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . 0.459 ' HG2' ' OG ' ' A' ' 61' ' ' SER . 26.0 Cg_endo -64.87 150.52 88.01 Favored 'Trans proline' 0 N--CA 1.457 -0.647 0 C-N-CA 122.278 1.985 . . . . 0.0 111.999 178.632 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.414 ' HG2' ' SG ' ' A' ' 52' ' ' CYS . 66.2 mtp -69.06 -9.11 50.97 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.231 0.538 . . . . 0.0 111.721 -176.905 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 28.8 p30 -88.82 -12.88 40.72 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-O 121.214 0.53 . . . . 0.0 111.33 -178.751 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.459 ' OG ' ' HG2' ' A' ' 58' ' ' PRO . 55.6 m -88.06 -19.08 27.59 Favored 'General case' 0 C--N 1.316 -0.878 0 N-CA-C 112.654 0.613 . . . . 0.0 112.654 -177.738 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.498 HD11 ' SG ' ' A' ' 52' ' ' CYS . 1.5 pp -132.4 159.96 37.74 Favored 'General case' 0 C--N 1.315 -0.934 0 N-CA-C 113.413 0.894 . . . . 0.0 113.413 -177.386 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.485 ' O ' ' HA ' ' A' ' 90' ' ' VAL . 50.0 mtm-85 -107.86 124.87 50.73 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 114.903 -1.044 . . . . 0.0 111.741 -177.997 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -106.09 117.26 33.56 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.545 178.329 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.466 ' C ' HD23 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -143.01 160.85 39.57 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-O 121.362 0.601 . . . . 0.0 111.161 179.951 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 90.7 t80 -141.35 134.26 28.96 Favored 'General case' 0 C--N 1.31 -1.118 0 N-CA-C 109.033 -0.729 . . . . 0.0 109.033 178.775 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 6.4 pt-20 50.04 26.75 2.19 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 124.124 0.97 . . . . 0.0 112.33 -179.16 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 85.02 25.03 42.22 Favored Glycine 0 N--CA 1.447 -0.627 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.948 -178.833 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . 0.439 ' OE1' HD21 ' A' ' 80' ' ' LEU . 3.3 pt20 -130.86 136.71 48.9 Favored 'General case' 0 C--N 1.322 -0.619 0 O-C-N 122.074 -0.663 . . . . 0.0 109.888 179.279 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . 0.428 ' HD3' ' N ' ' A' ' 70' ' ' ARG . 0.0 OUTLIER -66.72 146.88 53.98 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-O 121.336 0.588 . . . . 0.0 110.557 178.067 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.429 HG12 ' HA ' ' A' ' 65' ' ' LEU . 20.9 mm -101.45 118.05 47.64 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.133 0 CA-C-O 120.89 0.376 . . . . 0.0 110.264 -179.535 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -99.65 167.34 10.63 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-O 120.882 0.373 . . . . 0.0 110.365 -179.517 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . 0.626 ' OD2' ' HA ' ' A' ' 1' ' ' MET . 7.8 p-10 -67.92 -22.1 65.09 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-O 121.194 0.521 . . . . 0.0 111.391 -179.618 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 8.0 m-80 -98.56 1.09 46.15 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-O 121.338 0.589 . . . . 0.0 110.076 -178.324 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . 0.603 ' O ' ' HB2' ' A' ' 44' ' ' LEU . 2.1 m170 -80.8 142.71 33.46 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 -179.512 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.45 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 81.0 p -116.96 153.25 49.44 Favored Pre-proline 0 C--N 1.306 -1.302 0 CA-C-N 116.79 -0.186 . . . . 0.0 111.29 -179.949 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_exo -58.2 -39.68 82.89 Favored 'Trans proline' 0 C--N 1.347 0.484 0 C-N-CA 122.492 2.128 . . . . 0.0 111.586 178.809 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . 0.516 ' HG3' ' N ' ' A' ' 79' ' ' GLU . 32.7 pttt -67.39 -39.61 85.62 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.082 -178.379 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.516 ' N ' ' HG3' ' A' ' 78' ' ' LYS . 45.9 mm-40 -73.31 -35.66 66.11 Favored 'General case' 0 CA--C 1.511 -0.553 0 CA-C-O 121.166 0.508 . . . . 0.0 110.936 -179.206 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.491 HD22 ' CG ' ' A' ' 75' ' ' HIS . 5.4 mt -81.1 -3.93 53.6 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.074 0.464 . . . . 0.0 110.96 -179.456 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 75.45 48.1 11.32 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.972 -0.632 . . . . 0.0 112.813 177.738 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 63.5 mtt -105.64 161.13 14.65 Favored 'General case' 0 C--N 1.315 -0.929 0 N-CA-C 110.023 -0.362 . . . . 0.0 110.023 178.83 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 14.2 pt-20 -143.04 -173.03 3.8 Favored 'General case' 0 C--N 1.317 -0.841 0 N-CA-C 109.917 -0.401 . . . . 0.0 109.917 179.134 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.467 ' HA ' ' HB ' ' A' ' 22' ' ' ILE . 11.6 pt-20 -68.33 126.46 29.66 Favored 'General case' 0 N--CA 1.447 -0.584 0 CA-C-O 121.466 0.65 . . . . 0.0 111.68 -179.188 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . 0.477 ' HG3' ' HE3' ' A' ' 23' ' ' LYS . 33.5 mt-10 77.54 8.39 2.66 Favored 'General case' 0 C--N 1.322 -0.625 0 C-N-CA 124.723 1.209 . . . . 0.0 112.738 177.19 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -63.42 167.15 5.69 Favored 'General case' 0 C--O 1.239 0.539 0 CA-C-O 121.082 0.468 . . . . 0.0 110.302 174.754 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 15.0 p -125.9 143.93 37.73 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.036 0 CA-C-O 121.516 0.674 . . . . 0.0 111.752 -176.153 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 2.3 mt -111.86 152.96 13.63 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 N-CA-C 108.836 -0.801 . . . . 0.0 108.836 177.646 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.405 ' O ' HD11 ' A' ' 65' ' ' LEU . 9.5 tp10 -106.64 137.44 44.65 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-O 120.924 0.392 . . . . 0.0 110.58 -177.38 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . 0.485 ' HA ' ' O ' ' A' ' 63' ' ' ARG . 90.2 t -129.02 133.4 66.08 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-O 121.317 0.58 . . . . 0.0 111.454 178.667 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 82.1 m-85 -118.92 178.41 4.5 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.375 179.429 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 9.5 tp60 -105.15 135.95 45.54 Favored 'General case' 0 C--N 1.31 -1.124 0 O-C-N 122.241 -0.287 . . . . 0.0 110.623 -179.281 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -127.84 21.68 6.38 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.262 0.553 . . . . 0.0 110.403 176.358 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 98.1 mt-30 -55.33 -178.35 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.554 0 CA-C-N 115.745 -0.661 . . . . 0.0 111.816 176.778 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 7.1 t -85.7 133.18 34.03 Favored 'General case' 0 C--N 1.305 -1.346 0 CA-C-O 121.477 0.656 . . . . 0.0 111.27 -173.674 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -104.35 51.3 0.81 Allowed Glycine 0 N--CA 1.44 -1.043 0 C-N-CA 120.983 -0.627 . . . . 0.0 111.64 179.181 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.003 0 CA-C-O 118.645 -1.086 . . . . 0.0 111.768 -179.787 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.2 mpt? . . . . . 0 N--CA 1.48 1.071 0 CA-C-O 121.311 0.577 . . . . 0.0 110.601 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 16.9 p -95.12 7.33 46.48 Favored 'General case' 0 C--N 1.312 -1.024 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.819 -177.969 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 35.7 t70 66.0 80.43 0.22 Allowed 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 121.982 0.896 . . . . 0.0 109.544 -177.153 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 7.3 pt20 -93.99 145.52 24.59 Favored 'General case' 0 C--N 1.303 -1.443 0 CA-C-N 115.32 -0.854 . . . . 0.0 111.035 -177.113 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -82.52 -176.28 6.16 Favored 'General case' 0 C--N 1.309 -1.173 0 CA-C-O 121.368 0.604 . . . . 0.0 111.646 -177.803 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -115.57 143.83 44.76 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.837 -0.619 . . . . 0.0 109.91 -179.353 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -137.94 157.97 72.19 Favored Pre-proline 0 N--CA 1.437 -1.085 0 N-CA-C 109.919 -0.4 . . . . 0.0 109.919 -178.051 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -57.98 149.65 69.26 Favored 'Trans proline' 0 C--O 1.234 0.322 0 C-N-CA 122.718 2.279 . . . . 0.0 112.048 179.534 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 10.4 p -97.31 4.42 50.84 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-O 121.529 0.68 . . . . 0.0 111.118 -178.63 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 12.7 t -169.15 179.14 4.11 Favored 'General case' 0 C--N 1.317 -0.848 0 CA-C-N 115.886 -0.597 . . . . 0.0 109.554 178.296 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.6 tm-20 -137.79 109.38 7.01 Favored 'General case' 0 C--N 1.315 -0.902 0 N-CA-C 109.602 -0.518 . . . . 0.0 109.602 -179.464 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -145.92 164.83 30.77 Favored 'General case' 0 C--N 1.317 -0.843 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 -178.342 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 1.9 pp -158.84 158.94 34.44 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.185 0.516 . . . . 0.0 111.608 -179.767 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -142.3 49.22 0.75 Allowed Glycine 0 N--CA 1.446 -0.655 0 C-N-CA 121.094 -0.574 . . . . 0.0 112.046 178.644 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -60.06 145.14 47.6 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.213 0.53 . . . . 0.0 111.225 179.863 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 73.7 mmtt -99.27 151.52 20.94 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-O 120.933 0.397 . . . . 0.0 110.45 -178.875 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 21.1 ptmt -81.18 151.72 28.07 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 121.243 0.544 . . . . 0.0 110.823 -178.756 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -90.77 -175.24 4.32 Favored 'General case' 0 C--N 1.31 -1.127 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.726 177.644 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -150.85 -109.6 0.46 Allowed Glycine 0 N--CA 1.44 -1.045 0 C-N-CA 120.46 -0.876 . . . . 0.0 112.538 -179.861 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 22.6 mt-10 -114.44 6.79 16.08 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 121.201 0.524 . . . . 0.0 110.242 -178.354 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.461 ' CE1' ' HD3' ' A' ' 37' ' ' LYS . 35.0 p90 -89.39 166.11 13.93 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-O 121.591 0.71 . . . . 0.0 112.539 -174.458 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 24.0 pt -118.92 172.27 6.25 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.917 0 CA-C-N 115.128 -0.942 . . . . 0.0 109.395 177.284 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 45.3 mtmt -115.75 142.54 46.61 Favored 'General case' 0 C--N 1.294 -1.827 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 -179.509 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.4 mp -136.21 162.59 32.55 Favored 'General case' 0 C--N 1.302 -1.473 0 CA-C-O 121.098 0.475 . . . . 0.0 110.445 175.257 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.445 ' HE2' ' HB3' ' A' ' 25' ' ' LYS . 5.3 tmmm? -133.62 143.59 48.72 Favored 'General case' 0 C--N 1.308 -1.211 0 CA-C-O 121.403 0.621 . . . . 0.0 110.592 -178.786 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . 0.485 HG12 ' CD1' ' A' ' 51' ' ' TYR . 0.9 OUTLIER -115.0 143.33 24.98 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.454 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.046 -179.896 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.426 ' O ' ' HB ' ' A' ' 90' ' ' VAL . 45.4 mm -107.61 116.57 51.42 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.022 0 N-CA-C 107.683 -1.228 . . . . 0.0 107.683 175.392 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . 0.431 ' HA2' ' HB ' ' A' ' 90' ' ' VAL . . . -84.65 175.44 50.68 Favored Glycine 0 N--CA 1.419 -2.488 0 C-N-CA 120.158 -1.02 . . . . 0.0 111.834 -177.312 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.57 -22.18 63.55 Favored 'General case' 0 C--N 1.302 -1.476 0 CA-C-O 121.626 0.727 . . . . 0.0 110.324 179.906 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -100.57 13.73 33.71 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.693 -0.685 . . . . 0.0 109.219 178.523 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 19.3 m 71.49 15.59 6.11 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 115.376 -0.829 . . . . 0.0 111.319 179.265 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 10.9 t -72.35 114.59 10.63 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 109.697 -0.482 . . . . 0.0 109.697 179.199 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.443 ' HA ' ' O ' ' A' ' 26' ' ' VAL . 34.5 mt-10 -87.55 108.62 19.14 Favored 'General case' 0 CA--C 1.509 -0.61 0 CA-C-O 121.164 0.507 . . . . 0.0 110.42 179.187 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 38.9 mm -97.88 137.69 24.76 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.589 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 179.206 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 12.4 m170 -115.97 136.56 52.92 Favored 'General case' 0 C--N 1.315 -0.918 0 N-CA-C 109.3 -0.63 . . . . 0.0 109.3 -179.045 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -147.28 155.66 42.24 Favored 'General case' 0 C--N 1.308 -1.196 0 CA-C-O 121.309 0.576 . . . . 0.0 111.275 -178.501 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.461 ' HD3' ' CE1' ' A' ' 21' ' ' TYR . 93.4 mttt -113.67 113.37 24.92 Favored 'General case' 0 C--N 1.31 -1.13 0 CA-C-N 115.723 -0.672 . . . . 0.0 109.999 -179.177 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 28.2 m -134.91 158.18 41.28 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.768 0 CA-C-O 120.87 0.367 . . . . 0.0 110.069 -179.792 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.538 ' O ' HG22 ' A' ' 42' ' ' THR . 80.8 tttt -90.33 165.13 14.05 Favored 'General case' 0 C--N 1.311 -1.066 0 O-C-N 121.822 -0.549 . . . . 0.0 110.683 -179.021 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -70.14 -37.02 75.16 Favored 'General case' 0 N--CA 1.463 0.224 0 O-C-N 121.969 -0.457 . . . . 0.0 111.854 -177.771 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 14.5 t -97.13 19.09 13.51 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-O 120.939 0.4 . . . . 0.0 111.93 -176.471 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' THR . . . . . 0.538 HG22 ' O ' ' A' ' 39' ' ' LYS . 3.4 t -100.24 167.64 10.3 Favored 'General case' 0 C--N 1.323 -0.561 0 O-C-N 121.797 -0.564 . . . . 0.0 109.72 178.855 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 37.3 m170 -82.16 141.77 32.78 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 121.576 0.703 . . . . 0.0 111.459 179.903 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.595 ' HB2' ' O ' ' A' ' 75' ' ' HIS . 0.2 OUTLIER -70.84 -13.88 62.2 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.459 -0.791 . . . . 0.0 109.731 -179.741 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.729 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -54.59 -43.65 72.34 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 115.787 -0.642 . . . . 0.0 112.009 -179.31 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.432 ' N ' ' HD3' ' A' ' 45' ' ' LYS . 21.9 ptmt -69.23 -28.4 66.31 Favored 'General case' 0 C--O 1.201 -1.451 0 CA-C-O 120.911 0.386 . . . . 0.0 110.462 -179.158 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.51 ' HB3' HD12 ' A' ' 44' ' ' LEU . 8.4 tt -74.36 -49.34 23.14 Favored 'General case' 0 C--N 1.302 -1.459 0 CA-C-O 120.994 0.426 . . . . 0.0 110.631 -178.855 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.449 ' HZ2' ' CG ' ' A' ' 73' ' ' ASP . 6.8 ptmm? -62.6 -43.17 99.47 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.328 -0.397 . . . . 0.0 111.404 -177.555 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.729 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 8.1 pt-20 -70.8 -33.47 70.76 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-O 121.021 0.439 . . . . 0.0 110.626 178.139 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' SER . . . . . 0.652 ' O ' ' HG2' ' A' ' 54' ' ' ARG . 10.5 m -67.81 -41.87 82.42 Favored 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 -178.122 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.485 ' CD1' HG12 ' A' ' 26' ' ' VAL . 3.4 p90 -76.68 -33.09 58.27 Favored 'General case' 0 C--N 1.32 -0.707 0 C-N-CA 119.129 -1.029 . . . . 0.0 110.392 -178.532 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . 0.571 ' SG ' HD12 ' A' ' 62' ' ' LEU . 90.6 m -62.42 -44.89 95.34 Favored 'General case' 0 CA--C 1.509 -0.625 0 CA-C-O 121.296 0.57 . . . . 0.0 110.465 179.419 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . 0.411 ' HG2' ' O ' ' A' ' 50' ' ' SER . 13.8 pt20 -67.23 -33.83 76.19 Favored 'General case' 0 N--CA 1.44 -0.953 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.743 -179.392 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.652 ' HG2' ' O ' ' A' ' 50' ' ' SER . 40.4 mmt180 -56.59 -44.4 81.04 Favored 'General case' 0 C--N 1.351 0.638 0 CA-C-O 121.368 0.604 . . . . 0.0 110.434 177.002 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.424 HE21 ' HB2' ' A' ' 55' ' ' GLN . 4.0 mt-30 -73.38 -20.82 60.66 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.736 -0.666 . . . . 0.0 111.462 -179.555 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 79.66 33.37 34.5 Favored Glycine 0 N--CA 1.448 -0.547 0 C-N-CA 120.675 -0.774 . . . . 0.0 111.765 -179.758 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 29.1 m -132.93 151.28 77.72 Favored Pre-proline 0 C--O 1.24 0.565 0 O-C-N 122.532 -0.393 . . . . 0.0 110.518 -179.298 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . 0.441 ' HG2' ' OG ' ' A' ' 61' ' ' SER . 40.9 Cg_endo -69.62 148.93 67.08 Favored 'Trans proline' 0 N--CA 1.459 -0.555 0 C-N-CA 122.506 2.138 . . . . 0.0 112.307 179.065 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.52 ' HG2' ' SG ' ' A' ' 52' ' ' CYS . 72.8 mtp -71.22 -11.28 60.84 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.602 -0.726 . . . . 0.0 111.637 -177.382 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 24.7 p30 -88.02 -12.2 45.09 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-O 121.311 0.577 . . . . 0.0 111.461 -179.191 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.441 ' OG ' ' HG2' ' A' ' 58' ' ' PRO . 66.4 m -90.49 -20.85 22.23 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-O 120.928 0.394 . . . . 0.0 111.951 -179.585 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.571 HD12 ' SG ' ' A' ' 52' ' ' CYS . 2.0 pp -123.32 164.99 17.75 Favored 'General case' 0 C--N 1.313 -0.986 0 N-CA-C 113.031 0.752 . . . . 0.0 113.031 -177.796 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.529 ' O ' ' HA ' ' A' ' 90' ' ' VAL . 5.8 mtp180 -114.47 123.13 48.64 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.538 -0.755 . . . . 0.0 110.585 -178.691 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.465 ' HB3' ' OH ' ' A' ' 51' ' ' TYR . 0.2 OUTLIER -104.27 113.48 27.06 Favored 'General case' 0 C--N 1.307 -1.278 0 CA-C-O 120.986 0.422 . . . . 0.0 110.145 176.53 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.44 ' C ' HD21 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -142.79 165.13 28.21 Favored 'General case' 0 N--CA 1.438 -1.068 0 CA-C-O 121.634 0.73 . . . . 0.0 111.88 -179.144 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 92.3 t80 -145.44 134.76 23.0 Favored 'General case' 0 C--N 1.305 -1.361 0 N-CA-C 108.542 -0.91 . . . . 0.0 108.542 178.537 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 50.24 26.7 2.3 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 124.359 1.064 . . . . 0.0 112.204 -177.927 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 86.79 17.5 59.72 Favored Glycine 0 CA--C 1.519 0.287 0 C-N-CA 120.781 -0.723 . . . . 0.0 113.314 -178.803 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . 0.41 ' O ' ' HB2' ' A' ' 65' ' ' LEU . 2.9 pt20 -124.39 134.65 53.06 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 -179.74 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -70.25 146.7 50.47 Favored 'General case' 0 C--N 1.312 -1.032 0 CA-C-O 121.376 0.608 . . . . 0.0 110.301 178.017 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 22.7 mm -94.36 122.76 46.11 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.55 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.283 -178.557 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -98.79 166.75 11.16 Favored 'General case' 0 N--CA 1.439 -0.978 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 -179.499 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . 0.449 ' CG ' ' HZ2' ' A' ' 48' ' ' LYS . 6.2 m-20 -67.55 -26.0 66.09 Favored 'General case' 0 C--N 1.313 -1.001 0 CA-C-O 121.265 0.555 . . . . 0.0 111.259 -178.421 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 8.1 m-80 -97.23 4.99 50.79 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-O 121.327 0.584 . . . . 0.0 110.097 -177.799 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . 0.595 ' O ' ' HB2' ' A' ' 44' ' ' LEU . 2.5 m170 -83.68 145.94 28.51 Favored 'General case' 0 CA--C 1.507 -0.71 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 179.232 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.4 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 43.7 p -122.81 158.76 56.12 Favored Pre-proline 0 C--N 1.31 -1.119 0 C-N-CA 121.012 -0.275 . . . . 0.0 110.742 179.003 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_exo -60.81 -40.54 53.09 Favored 'Trans proline' 0 N--CA 1.457 -0.627 0 C-N-CA 122.538 2.159 . . . . 0.0 111.604 179.054 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . 0.519 ' HG3' ' N ' ' A' ' 79' ' ' GLU . 20.7 pttt -68.99 -36.75 78.18 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.947 0.404 . . . . 0.0 110.992 -177.935 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.519 ' N ' ' HG3' ' A' ' 78' ' ' LYS . 52.5 mm-40 -69.84 -40.56 75.74 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-O 120.921 0.391 . . . . 0.0 110.636 -179.243 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.422 HD23 ' CG ' ' A' ' 75' ' ' HIS . 5.4 mt -79.74 -6.71 57.78 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.25 0.548 . . . . 0.0 110.864 -178.985 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 80.45 45.14 8.17 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.967 -0.635 . . . . 0.0 113.01 177.794 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 59.5 mtt -102.7 163.33 12.28 Favored 'General case' 0 C--N 1.317 -0.806 0 N-CA-C 109.755 -0.461 . . . . 0.0 109.755 178.388 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -136.93 -172.45 3.19 Favored 'General case' 0 C--N 1.312 -1.045 0 CA-C-O 120.884 0.373 . . . . 0.0 110.01 179.113 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -70.43 141.47 52.1 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 177.738 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 73.78 1.93 4.07 Favored 'General case' 0 CA--C 1.552 1.05 0 C-N-CA 123.826 0.851 . . . . 0.0 111.283 179.868 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -63.91 161.77 15.03 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-O 121.269 0.557 . . . . 0.0 110.97 179.123 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . 0.419 ' HA ' ' O ' ' A' ' 25' ' ' LYS . 8.6 p -127.64 142.88 42.43 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.079 0 CA-C-O 121.418 0.627 . . . . 0.0 111.505 -176.302 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 3.7 mp -112.57 152.93 14.27 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.855 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 178.667 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.402 ' O ' HD13 ' A' ' 65' ' ' LEU . 7.2 tp10 -105.43 137.49 43.17 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-O 120.969 0.414 . . . . 0.0 110.484 -175.785 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . 0.529 ' HA ' ' O ' ' A' ' 63' ' ' ARG . 78.4 t -128.75 135.7 61.64 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.887 0 CA-C-O 121.259 0.552 . . . . 0.0 110.793 179.16 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 91.8 m-85 -122.71 177.84 5.28 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.201 179.155 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 9.6 tp60 -108.44 121.32 44.7 Favored 'General case' 0 C--N 1.312 -1.051 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 179.553 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . 0.463 ' HB3' ' CG ' ' A' ' 63' ' ' ARG . 9.3 pt-20 -110.26 19.74 18.56 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-O 121.022 0.439 . . . . 0.0 111.068 179.991 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . 0.416 HE21 ' HB3' ' A' ' 61' ' ' SER . 97.3 mt-30 -61.92 -166.52 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.742 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.332 175.812 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 10.1 t -149.66 133.09 16.59 Favored 'General case' 0 C--N 1.313 -1.009 0 O-C-N 120.963 -1.086 . . . . 0.0 111.615 -177.291 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -89.96 -17.32 54.21 Favored Glycine 0 N--CA 1.439 -1.142 0 N-CA-C 110.843 -0.903 . . . . 0.0 110.843 176.899 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.434 -1.436 0 CA-C-O 118.499 -1.167 . . . . 0.0 111.319 179.084 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 58.3 ttp . . . . . 0 N--CA 1.477 0.911 0 CA-C-O 120.474 0.178 . . . . 0.0 110.755 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 33.4 t 75.82 -18.26 0.47 Allowed 'General case' 0 CA--C 1.548 0.899 0 N-CA-C 113.802 1.038 . . . . 0.0 113.802 175.926 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -114.14 -6.57 13.06 Favored 'General case' 0 C--N 1.323 -0.57 0 O-C-N 121.468 -0.77 . . . . 0.0 111.742 -177.968 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 41.8 mt-30 -81.18 111.96 18.08 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.313 0.578 . . . . 0.0 111.563 -178.318 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -143.64 -170.04 3.21 Favored 'General case' 0 C--N 1.31 -1.145 0 CA-C-N 116.092 -0.504 . . . . 0.0 109.76 178.018 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -138.05 175.11 9.87 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-O 120.974 0.416 . . . . 0.0 111.045 -177.925 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -159.01 151.26 17.55 Favored Pre-proline 0 C--N 1.318 -0.773 0 CA-C-N 116.07 -0.514 . . . . 0.0 109.81 178.069 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 29.9 Cg_endo -63.97 144.95 89.28 Favored 'Trans proline' 0 N--CA 1.461 -0.412 0 C-N-CA 122.387 2.058 . . . . 0.0 111.849 179.806 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 19.8 p -126.96 -11.25 5.97 Favored 'General case' 0 C--N 1.31 -1.129 0 CA-C-O 121.358 0.599 . . . . 0.0 110.566 -179.886 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 17.0 m -154.32 130.97 10.7 Favored 'General case' 0 N--CA 1.445 -0.675 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 179.254 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -69.9 126.9 31.08 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 121.13 0.491 . . . . 0.0 109.685 177.922 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -144.05 86.67 1.86 Allowed 'General case' 0 C--N 1.313 -1.007 0 CA-C-O 121.414 0.626 . . . . 0.0 109.859 -179.501 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -71.67 156.0 39.86 Favored 'General case' 0 N--CA 1.429 -1.48 0 CA-C-N 115.56 -0.746 . . . . 0.0 110.931 179.736 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -161.76 68.31 0.24 Allowed Glycine 0 N--CA 1.431 -1.643 0 C-N-CA 120.452 -0.88 . . . . 0.0 112.344 -178.877 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 24.1 m-20 -136.12 33.58 2.85 Favored 'General case' 0 CA--C 1.506 -0.745 0 CA-C-O 121.876 0.846 . . . . 0.0 109.666 179.914 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 5.5 mtpm? -130.83 -172.38 2.8 Favored 'General case' 0 C--N 1.311 -1.096 0 CA-C-N 115.298 -0.865 . . . . 0.0 109.699 -178.248 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 20.6 ptmt -81.23 -177.85 6.65 Favored 'General case' 0 C--N 1.315 -0.923 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 174.851 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.474 ' OE2' ' HD3' ' A' ' 37' ' ' LYS . 7.4 pt-20 -169.11 162.47 10.85 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.198 0.523 . . . . 0.0 111.996 -175.593 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -173.13 170.6 43.75 Favored Glycine 0 N--CA 1.439 -1.107 0 N-CA-C 111.038 -0.825 . . . . 0.0 111.038 179.352 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 64.5 24.39 13.09 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-O 121.164 0.507 . . . . 0.0 111.547 178.603 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 54.9 p90 -109.37 175.69 5.36 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-O 120.932 0.396 . . . . 0.0 110.494 -179.387 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 23.0 pt -125.85 171.18 14.88 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.903 0 CA-C-O 121.39 0.614 . . . . 0.0 110.446 177.905 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.404 ' HE3' ' HB2' ' A' ' 23' ' ' LYS . 40.8 mtmt -119.11 142.07 48.23 Favored 'General case' 0 C--N 1.304 -1.406 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 -179.367 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.5 mp -136.04 164.11 28.77 Favored 'General case' 0 C--N 1.304 -1.411 0 CA-C-O 121.268 0.556 . . . . 0.0 110.811 176.097 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 5.6 tmmm? -136.45 145.06 44.79 Favored 'General case' 0 C--N 1.311 -1.107 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.448 -179.271 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . 0.542 ' O ' ' HA ' ' A' ' 33' ' ' GLU . 0.9 OUTLIER -115.73 142.44 28.93 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.291 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.968 -179.768 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.423 ' CD1' ' HG2' ' A' ' 33' ' ' GLU . 45.4 mm -109.17 98.15 6.66 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.874 0 N-CA-C 108.498 -0.927 . . . . 0.0 108.498 175.884 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . 0.514 ' HA2' ' HB ' ' A' ' 90' ' ' VAL . . . -67.12 166.04 41.66 Favored Glycine 0 N--CA 1.436 -1.339 0 C-N-CA 120.45 -0.881 . . . . 0.0 112.764 178.321 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.43 -16.9 40.47 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 121.129 0.49 . . . . 0.0 112.311 179.209 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -102.76 18.1 22.25 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 121.487 0.66 . . . . 0.0 109.69 178.754 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 7.3 m 69.72 17.21 7.79 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.376 -179.134 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 12.8 t -73.46 108.48 6.35 Favored 'General case' 0 N--CA 1.444 -0.766 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.698 -178.458 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.542 ' HA ' ' O ' ' A' ' 26' ' ' VAL . 40.6 mt-10 -87.09 104.29 16.19 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-O 121.111 0.481 . . . . 0.0 110.479 178.287 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 40.2 mm -97.21 136.86 26.55 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.426 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 178.103 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 12.8 m170 -114.78 134.48 55.08 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 -178.148 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 1.1 p90 -147.15 158.37 43.92 Favored 'General case' 0 C--N 1.309 -1.193 0 CA-C-O 121.397 0.618 . . . . 0.0 111.061 -178.919 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.474 ' HD3' ' OE2' ' A' ' 18' ' ' GLU . 7.3 ptpt -120.1 120.74 37.13 Favored 'General case' 0 C--N 1.307 -1.26 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.289 -178.913 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 33.4 m -139.87 162.0 25.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-O 121.352 0.596 . . . . 0.0 110.962 -178.514 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.58 ' O ' HG23 ' A' ' 42' ' ' THR . 19.1 mmmt -80.8 156.03 26.35 Favored 'General case' 0 C--N 1.312 -1.025 0 CA-C-O 121.027 0.442 . . . . 0.0 110.851 177.488 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' MET . . . . . 0.449 ' O ' ' HG2' ' A' ' 78' ' ' LYS . 0.0 OUTLIER -70.55 -35.51 73.15 Favored 'General case' 0 CA--C 1.506 -0.746 0 CA-C-O 121.404 0.621 . . . . 0.0 109.903 177.521 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 12.9 t -91.98 18.48 7.85 Favored 'General case' 0 N--CA 1.438 -1.035 0 CA-C-N 115.724 -0.671 . . . . 0.0 112.284 -176.396 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' THR . . . . . 0.58 HG23 ' O ' ' A' ' 39' ' ' LYS . 3.7 t -105.51 169.93 8.18 Favored 'General case' 0 C--N 1.323 -0.579 0 O-C-N 121.876 -0.515 . . . . 0.0 110.157 -179.705 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 40.2 m170 -81.65 141.65 33.46 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 121.561 0.696 . . . . 0.0 111.487 179.79 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.586 ' HB2' ' O ' ' A' ' 75' ' ' HIS . 0.2 OUTLIER -70.96 -12.14 61.37 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 115.303 -0.862 . . . . 0.0 109.596 179.702 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.806 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -55.65 -50.24 70.75 Favored 'General case' 0 N--CA 1.441 -0.884 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.802 -179.186 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.499 ' O ' ' HB2' ' A' ' 50' ' ' SER . 20.7 ptmt -63.31 -29.14 70.51 Favored 'General case' 0 C--O 1.218 -0.576 0 CA-C-O 121.318 0.58 . . . . 0.0 110.688 -177.928 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.491 ' HB3' HD13 ' A' ' 44' ' ' LEU . 8.4 tt -72.63 -50.86 22.36 Favored 'General case' 0 C--N 1.307 -1.265 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.766 -179.072 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.474 ' HA ' ' CD2' ' A' ' 51' ' ' TYR . 7.2 ptmm? -62.97 -41.28 99.49 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.923 0.392 . . . . 0.0 111.764 -177.537 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.806 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 7.0 pt-20 -72.25 -30.06 64.51 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-O 121.104 0.478 . . . . 0.0 110.528 177.828 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' SER . . . . . 0.666 ' O ' ' HG2' ' A' ' 54' ' ' ARG . 15.7 t -68.58 -45.69 71.37 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.414 -179.151 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.474 ' CD2' ' HA ' ' A' ' 48' ' ' LYS . 2.7 p90 -74.74 -32.93 62.25 Favored 'General case' 0 N--CA 1.448 -0.538 0 C-N-CA 119.772 -0.771 . . . . 0.0 110.48 -177.266 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . 0.481 ' SG ' ' HG2' ' A' ' 59' ' ' MET . 98.6 m -60.93 -44.27 97.47 Favored 'General case' 0 C--O 1.239 0.541 0 CA-C-O 120.879 0.371 . . . . 0.0 110.822 179.048 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 10.6 pt20 -70.52 -31.57 68.7 Favored 'General case' 0 N--CA 1.444 -0.742 0 C-N-CA 120.368 -0.533 . . . . 0.0 110.966 -179.274 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.666 ' HG2' ' O ' ' A' ' 50' ' ' SER . 34.0 mmt180 -57.41 -36.3 71.15 Favored 'General case' 0 C--N 1.351 0.64 0 CA-C-O 121.237 0.541 . . . . 0.0 110.496 176.616 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.425 HE21 ' HB2' ' A' ' 55' ' ' GLN . 2.9 mt-30 -83.61 -20.82 33.01 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.844 179.797 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 80.88 33.09 30.92 Favored Glycine 0 N--CA 1.446 -0.666 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.47 178.933 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 35.1 m -132.33 148.65 70.53 Favored Pre-proline 0 C--N 1.322 -0.594 0 O-C-N 122.481 -0.423 . . . . 0.0 110.46 -179.8 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . 0.462 ' HG2' ' OG ' ' A' ' 61' ' ' SER . 28.8 Cg_endo -65.18 149.29 88.99 Favored 'Trans proline' 0 N--CA 1.458 -0.582 0 C-N-CA 122.31 2.007 . . . . 0.0 111.705 178.136 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.481 ' HG2' ' SG ' ' A' ' 52' ' ' CYS . 66.8 mtp -71.55 -9.32 58.04 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.524 -176.312 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 33.2 p30 -87.75 -10.25 51.61 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-O 121.404 0.621 . . . . 0.0 111.029 -178.959 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.462 ' OG ' ' HG2' ' A' ' 58' ' ' PRO . 74.3 m -90.11 -24.66 21.04 Favored 'General case' 0 N--CA 1.434 -1.245 0 CA-C-N 115.936 -0.575 . . . . 0.0 112.1 -177.579 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.465 HD12 ' SG ' ' A' ' 52' ' ' CYS . 1.5 pp -123.53 167.41 13.94 Favored 'General case' 0 C--N 1.307 -1.276 0 N-CA-C 112.538 0.57 . . . . 0.0 112.538 -177.483 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.479 ' O ' ' HA ' ' A' ' 90' ' ' VAL . 74.2 mtm180 -119.18 119.27 33.65 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.095 -176.949 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -100.9 116.08 31.92 Favored 'General case' 0 C--N 1.31 -1.113 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.847 178.587 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.454 ' C ' HD23 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -144.29 164.2 31.45 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.342 0.591 . . . . 0.0 110.918 -179.925 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 87.7 t80 -145.92 134.09 21.63 Favored 'General case' 0 C--N 1.309 -1.187 0 N-CA-C 109.219 -0.66 . . . . 0.0 109.219 178.388 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 49.69 27.13 2.07 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 124.291 1.036 . . . . 0.0 112.563 -179.825 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 90.15 16.91 55.01 Favored Glycine 0 CA--C 1.521 0.411 0 C-N-CA 121.033 -0.603 . . . . 0.0 113.391 179.255 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 2.7 pt20 -127.97 133.92 49.24 Favored 'General case' 0 C--N 1.317 -0.842 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 -179.986 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -72.36 146.85 46.79 Favored 'General case' 0 C--N 1.309 -1.193 0 CA-C-O 121.588 0.709 . . . . 0.0 110.705 178.807 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 20.7 mm -93.81 117.28 37.02 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.482 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.3 -178.611 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -97.73 162.78 13.11 Favored 'General case' 0 N--CA 1.436 -1.141 0 N-CA-C 109.872 -0.418 . . . . 0.0 109.872 -179.761 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . 0.486 ' O ' ' HB3' ' A' ' 45' ' ' LYS . 7.4 p-10 -65.82 -22.46 66.56 Favored 'General case' 0 C--N 1.312 -1.039 0 CA-C-O 121.168 0.509 . . . . 0.0 111.7 -179.347 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 10.7 m-80 -96.03 2.86 53.65 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-O 121.382 0.61 . . . . 0.0 110.135 179.53 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . 0.586 ' O ' ' HB2' ' A' ' 44' ' ' LEU . 3.4 m170 -83.83 146.56 28.04 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 109.597 -0.519 . . . . 0.0 109.597 178.565 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.499 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 72.4 p -122.54 156.18 61.56 Favored Pre-proline 0 C--N 1.31 -1.147 0 O-C-N 122.307 -0.246 . . . . 0.0 111.062 178.555 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 25.0 Cg_exo -62.07 -37.45 64.01 Favored 'Trans proline' 0 C--N 1.351 0.676 0 C-N-CA 122.319 2.013 . . . . 0.0 110.999 179.243 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . 0.449 ' HG2' ' O ' ' A' ' 40' ' ' MET . 14.6 ptmt -67.26 -40.84 86.28 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.577 -179.165 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 47.4 mm-40 -75.33 -35.45 61.19 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 120.936 0.398 . . . . 0.0 111.355 -178.356 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.513 HD21 ' CG ' ' A' ' 75' ' ' HIS . 5.9 mt -79.27 -4.0 48.63 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-O 121.074 0.464 . . . . 0.0 110.688 179.762 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 74.04 47.85 17.51 Favored Glycine 0 N--CA 1.445 -0.759 0 C-N-CA 120.815 -0.707 . . . . 0.0 112.622 178.229 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 64.4 mtt -103.6 165.5 10.99 Favored 'General case' 0 C--N 1.313 -0.982 0 N-CA-C 109.516 -0.55 . . . . 0.0 109.516 178.204 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . 0.459 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 12.9 pt-20 -139.62 -172.88 3.47 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-O 120.842 0.354 . . . . 0.0 110.465 178.838 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -72.7 137.84 46.23 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-O 121.234 0.54 . . . . 0.0 111.152 -179.216 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 26.0 tt0 77.34 3.43 3.16 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.791 1.237 . . . . 0.0 111.052 179.495 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . 0.459 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 0.5 OUTLIER -60.62 162.45 6.5 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 121.366 0.603 . . . . 0.0 111.212 178.135 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 13.5 p -128.18 146.63 33.4 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.176 0 CA-C-O 121.207 0.527 . . . . 0.0 110.675 -177.677 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 3.8 mp -114.75 152.16 16.41 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.99 0 N-CA-C 108.844 -0.799 . . . . 0.0 108.844 178.536 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -104.9 138.77 40.63 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 109.931 -0.396 . . . . 0.0 109.931 -176.52 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . 0.514 ' HB ' ' HA2' ' A' ' 28' ' ' GLY . 85.5 t -128.91 134.72 63.75 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.834 0 CA-C-O 121.439 0.638 . . . . 0.0 111.302 179.312 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 75.1 m-85 -118.22 -179.73 3.86 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.93 -0.577 . . . . 0.0 109.578 179.08 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 8.5 tp60 -107.13 142.4 36.88 Favored 'General case' 0 C--N 1.313 -0.992 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 177.364 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' GLU . . . . . 0.449 ' OE2' ' HG2' ' A' ' 63' ' ' ARG . 11.1 pt-20 -131.29 18.61 4.89 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.325 0.583 . . . . 0.0 111.117 176.497 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 99.2 mt-30 -66.77 -153.85 0.01 OUTLIER 'General case' 0 CA--C 1.542 0.653 0 CA-C-N 115.703 -0.681 . . . . 0.0 111.316 177.031 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 3.5 t -97.66 131.98 43.72 Favored 'General case' 0 C--N 1.31 -1.128 0 CA-C-O 121.463 0.649 . . . . 0.0 110.237 -177.614 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -90.89 48.53 3.02 Favored Glycine 0 N--CA 1.441 -1.016 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.301 -179.039 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.435 -1.429 0 CA-C-O 118.406 -1.219 . . . . 0.0 111.173 -179.779 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 22' ' ' ILE . . . . . 0.427 ' HB ' ' HA ' ' A' ' 84' ' ' GLU . 18.3 pt . . . . . 0 N--CA 1.444 -0.729 0 CA-C-O 121.32 0.581 . . . . 0.0 110.356 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.56 ' HG2' ' HG2' ' A' ' 37' ' ' LYS . 50.9 mtmt -111.1 146.31 37.03 Favored 'General case' 0 C--N 1.305 -1.335 0 N-CA-C 109.726 -0.472 . . . . 0.0 109.726 179.756 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.9 mp -139.4 159.44 42.15 Favored 'General case' 0 C--N 1.295 -1.774 0 CA-C-O 121.095 0.474 . . . . 0.0 110.381 173.233 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.45 ' HE2' ' HB3' ' A' ' 25' ' ' LYS . 5.0 tmmm? -129.9 142.67 50.62 Favored 'General case' 0 N--CA 1.437 -1.083 0 CA-C-O 121.325 0.583 . . . . 0.0 110.426 -179.349 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.616 ' O ' ' HA ' ' A' ' 33' ' ' GLU . 0.9 OUTLIER -114.6 142.53 27.01 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.384 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.592 -179.163 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.473 HD13 ' HG2' ' A' ' 33' ' ' GLU . 47.4 mm -105.79 113.83 43.62 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.987 0 N-CA-C 107.243 -1.391 . . . . 0.0 107.243 174.691 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' GLY . . . . . 0.488 ' HA2' ' HB ' ' A' ' 90' ' ' VAL . . . -83.39 171.64 50.06 Favored Glycine 0 N--CA 1.425 -2.089 0 C-N-CA 119.998 -1.096 . . . . 0.0 111.804 -176.622 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.86 -23.61 65.28 Favored 'General case' 0 C--N 1.305 -1.363 0 CA-C-O 121.438 0.637 . . . . 0.0 111.03 178.108 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -103.34 15.32 29.42 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-O 121.578 0.704 . . . . 0.0 109.642 178.931 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 32.4 m 73.91 23.34 2.26 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-O 122.635 1.207 . . . . 0.0 108.192 -178.907 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.1 m -66.6 95.58 0.34 Allowed 'General case' 0 N--CA 1.428 -1.548 0 CA-C-N 113.285 -1.78 . . . . 0.0 111.106 -179.17 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.616 ' HA ' ' O ' ' A' ' 26' ' ' VAL . 38.6 mt-10 -83.71 106.89 15.78 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 121.533 0.682 . . . . 0.0 111.127 179.424 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.437 HG21 ' HA ' ' A' ' 51' ' ' TYR . 40.1 mm -103.62 140.42 21.83 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.431 0 CA-C-N 115.7 -0.682 . . . . 0.0 109.57 179.393 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 13.0 m170 -115.97 132.48 56.64 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 -179.625 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.557 ' HZ ' HG23 ' A' ' 26' ' ' VAL . 1.0 OUTLIER -147.24 159.33 43.77 Favored 'General case' 0 C--N 1.312 -1.031 0 CA-C-O 121.445 0.64 . . . . 0.0 112.003 -178.904 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.56 ' HG2' ' HG2' ' A' ' 23' ' ' LYS . 28.6 mtmt -120.92 119.11 31.65 Favored 'General case' 0 C--N 1.312 -1.053 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.363 -179.109 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 20.5 m -138.38 159.48 31.9 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-O 121.172 0.51 . . . . 0.0 110.947 -178.516 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.524 ' O ' HG22 ' A' ' 42' ' ' THR . 0.9 OUTLIER -74.85 154.56 38.2 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-O 121.058 0.456 . . . . 0.0 111.193 178.625 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -69.85 -37.31 76.11 Favored 'General case' 0 CA--C 1.507 -0.691 0 CA-C-O 121.22 0.533 . . . . 0.0 110.458 178.49 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 11.8 t -99.8 25.59 7.1 Favored 'General case' 0 N--CA 1.436 -1.169 0 CA-C-O 121.375 0.607 . . . . 0.0 112.424 -175.462 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' THR . . . . . 0.524 HG22 ' O ' ' A' ' 39' ' ' LYS . 6.1 t -108.17 168.26 9.43 Favored 'General case' 0 C--N 1.32 -0.713 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 176.995 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 14.8 m170 -78.26 140.35 38.87 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 121.734 0.778 . . . . 0.0 111.885 -179.125 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.65 ' HB2' ' O ' ' A' ' 75' ' ' HIS . 0.2 OUTLIER -64.98 -18.44 65.28 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.051 -0.977 . . . . 0.0 109.813 -179.911 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.722 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -51.25 -45.84 62.14 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.734 -179.212 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.446 ' HA ' ' CG ' ' A' ' 49' ' ' GLU . 21.4 ptmt -66.47 -31.82 72.81 Favored 'General case' 0 C--O 1.22 -0.498 0 CA-C-O 121.427 0.632 . . . . 0.0 110.933 -177.647 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.559 ' HB3' HD13 ' A' ' 44' ' ' LEU . 8.1 tt -67.97 -47.84 67.5 Favored 'General case' 0 C--N 1.308 -1.202 0 CA-C-O 121.6 0.714 . . . . 0.0 109.259 178.025 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.504 ' HA ' ' CE2' ' A' ' 51' ' ' TYR . 40.5 mtpt -60.63 -45.2 94.93 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.066 -0.97 . . . . 0.0 111.535 -178.763 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.722 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 3.7 pt-20 -71.03 -33.85 70.72 Favored 'General case' 0 C--N 1.312 -1.05 0 CA-C-O 120.958 0.408 . . . . 0.0 110.376 178.639 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 50' ' ' SER . . . . . 0.594 ' O ' ' HG2' ' A' ' 54' ' ' ARG . 21.9 t -64.19 -44.91 90.53 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-O 120.881 0.372 . . . . 0.0 111.257 -178.744 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.504 ' CE2' ' HA ' ' A' ' 48' ' ' LYS . 3.6 p90 -75.73 -32.39 60.0 Favored 'General case' 0 N--CA 1.443 -0.81 0 C-N-CA 119.639 -0.824 . . . . 0.0 110.659 -178.618 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 52' ' ' CYS . . . . . 0.614 ' SG ' ' HG2' ' A' ' 59' ' ' MET . 69.3 m -62.77 -43.55 98.5 Favored 'General case' 0 C--O 1.238 0.451 0 CA-C-O 120.868 0.366 . . . . 0.0 110.822 178.667 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 53' ' ' GLN . . . . . 0.404 ' HG2' ' O ' ' A' ' 49' ' ' GLU . 6.6 pt20 -66.49 -36.06 81.79 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 120.649 -0.421 . . . . 0.0 110.284 178.997 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.594 ' HG2' ' O ' ' A' ' 50' ' ' SER . 29.7 mmt180 -53.76 -45.77 70.73 Favored 'General case' 0 C--N 1.351 0.668 0 CA-C-O 121.233 0.54 . . . . 0.0 110.594 176.667 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 23.1 mt-30 -76.73 -23.43 53.05 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.881 -179.609 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 83.27 29.34 33.83 Favored Glycine 0 N--CA 1.445 -0.716 0 C-N-CA 120.565 -0.826 . . . . 0.0 112.086 178.464 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 26.6 m -128.49 153.45 79.3 Favored Pre-proline 0 C--N 1.327 -0.393 0 O-C-N 122.659 -0.318 . . . . 0.0 110.326 -178.725 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -69.01 149.14 71.31 Favored 'Trans proline' 0 C--O 1.239 0.571 0 C-N-CA 122.334 2.022 . . . . 0.0 112.188 178.226 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.614 ' HG2' ' SG ' ' A' ' 52' ' ' CYS . 75.3 mtp -71.46 -9.23 57.85 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.791 -0.64 . . . . 0.0 112.112 -176.06 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 21.0 p30 -89.72 -13.41 36.91 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-O 121.115 0.483 . . . . 0.0 111.529 -178.64 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 67.6 m -88.36 -16.1 33.88 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-O 121.164 0.507 . . . . 0.0 112.162 -179.204 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.547 HD11 ' SG ' ' A' ' 52' ' ' CYS . 1.5 pp -126.66 168.47 14.31 Favored 'General case' 0 C--N 1.309 -1.172 0 N-CA-C 112.817 0.673 . . . . 0.0 112.817 -178.457 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.555 ' O ' ' HA ' ' A' ' 90' ' ' VAL . 14.4 mtp180 -121.14 127.09 51.24 Favored 'General case' 0 CA--C 1.506 -0.73 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.658 -177.814 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -106.91 113.9 27.67 Favored 'General case' 0 C--N 1.305 -1.338 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.643 178.147 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.462 ' C ' HD22 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -141.23 162.12 36.24 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.361 0.6 . . . . 0.0 111.056 179.541 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 86.1 t80 -142.89 135.16 27.36 Favored 'General case' 0 C--N 1.311 -1.068 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 178.964 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 6.2 pt-20 48.96 29.32 2.32 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 124.23 1.012 . . . . 0.0 112.405 -179.729 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 81.77 27.65 45.63 Favored Glycine 0 N--CA 1.445 -0.709 0 C-N-CA 120.72 -0.752 . . . . 0.0 113.131 -179.273 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 6.5 pt20 -132.61 136.47 46.54 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 109.217 -0.661 . . . . 0.0 109.217 178.018 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.91 145.74 49.98 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-O 121.638 0.732 . . . . 0.0 110.672 178.292 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.448 HG12 ' HA ' ' A' ' 65' ' ' LEU . 16.8 mm -99.74 121.27 50.21 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.592 0 CA-C-O 121.161 0.505 . . . . 0.0 109.989 -179.632 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -95.86 164.58 12.68 Favored 'General case' 0 C--N 1.309 -1.153 0 N-CA-C 109.946 -0.391 . . . . 0.0 109.946 -179.382 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -65.49 -21.75 66.66 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-O 121.287 0.565 . . . . 0.0 110.584 179.411 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 6.5 m-80 -97.93 2.31 48.94 Favored 'General case' 0 CA--C 1.508 -0.653 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.162 -179.61 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' HIS . . . . . 0.65 ' O ' ' HB2' ' A' ' 44' ' ' LEU . 1.6 m170 -82.33 146.18 29.54 Favored 'General case' 0 CA--C 1.505 -0.786 0 C-N-CA 119.96 -0.696 . . . . 0.0 109.305 -179.832 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.497 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 82.1 p -120.7 155.53 56.97 Favored Pre-proline 0 C--N 1.308 -1.198 0 C-N-CA 120.961 -0.296 . . . . 0.0 111.27 179.514 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_exo -61.85 -38.71 57.23 Favored 'Trans proline' 0 C--N 1.348 0.516 0 C-N-CA 122.459 2.106 . . . . 0.0 111.161 179.335 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' LYS . . . . . 0.521 ' HG3' ' N ' ' A' ' 79' ' ' GLU . 47.0 pttt -67.22 -39.58 86.3 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.801 -178.835 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 79' ' ' GLU . . . . . 0.521 ' N ' ' HG3' ' A' ' 78' ' ' LYS . 4.3 mm-40 -75.26 -33.57 61.3 Favored 'General case' 0 N--CA 1.44 -0.974 0 CA-C-O 120.947 0.404 . . . . 0.0 111.614 -177.31 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.497 ' HG ' ' O ' ' A' ' 76' ' ' THR . 6.5 mt -82.8 -1.32 51.43 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.214 0.53 . . . . 0.0 110.78 179.573 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 76.3 46.43 12.61 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 121.133 -0.556 . . . . 0.0 113.114 177.248 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 60.7 mtt -107.04 167.72 9.7 Favored 'General case' 0 C--N 1.313 -1.021 0 N-CA-C 109.627 -0.509 . . . . 0.0 109.627 178.569 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -148.42 -171.3 3.81 Favored 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 109.938 -0.393 . . . . 0.0 109.938 178.168 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.427 ' HA ' ' HB ' ' A' ' 22' ' ' ILE . 7.0 pt-20 -66.29 135.31 54.23 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.531 0.681 . . . . 0.0 111.659 -178.48 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 74.63 6.74 4.48 Favored 'General case' 0 C--N 1.324 -0.539 0 C-N-CA 124.816 1.246 . . . . 0.0 112.558 178.746 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -62.27 162.54 9.64 Favored 'General case' 0 C--O 1.238 0.491 0 CA-C-O 121.093 0.473 . . . . 0.0 110.081 175.87 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 87' ' ' VAL . . . . . 0.438 ' HA ' ' O ' ' A' ' 25' ' ' LYS . 7.3 p -127.56 142.19 44.3 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.264 0 CA-C-O 121.537 0.684 . . . . 0.0 111.925 -176.392 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 3.7 mp -114.4 153.62 15.89 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 179.699 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -104.67 135.53 45.9 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 121.046 0.451 . . . . 0.0 109.994 -176.401 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 90' ' ' VAL . . . . . 0.555 ' HA ' ' O ' ' A' ' 63' ' ' ARG . 96.7 t -128.57 134.74 64.03 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.904 0 CA-C-O 121.268 0.556 . . . . 0.0 110.825 179.039 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 80.7 m-85 -121.24 179.07 4.53 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-N 116.213 -0.449 . . . . 0.0 109.858 179.43 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 8.7 tp60 -108.22 128.23 54.53 Favored 'General case' 0 C--N 1.313 -1.005 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 179.54 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 93' ' ' GLU . . . . . 0.403 ' HB3' ' CD ' ' A' ' 63' ' ' ARG . 9.8 pt-20 . . . . . 0 C--N 1.326 -0.433 0 CA-C-O 121.316 0.579 . . . . 0.0 111.037 178.209 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' ILE . . . . . 0.457 ' HB ' ' HA ' ' A' ' 84' ' ' GLU . 22.3 pt . . . . . 0 N--CA 1.444 -0.768 0 CA-C-O 121.569 0.699 . . . . 0.0 110.25 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 14.2 mtmt -117.63 146.69 43.49 Favored 'General case' 0 C--N 1.298 -1.636 0 N-CA-C 109.058 -0.719 . . . . 0.0 109.058 -179.071 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.6 mp -141.35 161.48 37.79 Favored 'General case' 0 C--N 1.303 -1.434 0 CA-C-O 121.337 0.589 . . . . 0.0 111.473 174.957 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.415 ' HE2' ' HB3' ' A' ' 25' ' ' LYS . 5.5 tmmm? -133.34 142.88 48.65 Favored 'General case' 0 N--CA 1.436 -1.16 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.463 -178.993 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.498 HG23 ' HZ ' ' A' ' 36' ' ' PHE . 0.9 OUTLIER -114.46 141.72 29.83 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.341 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.247 -179.701 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.436 ' O ' ' HB ' ' A' ' 90' ' ' VAL . 45.5 mm -105.11 117.74 51.31 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.971 0 N-CA-C 107.685 -1.228 . . . . 0.0 107.685 175.652 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' GLY . . . . . 0.415 ' HA2' ' HB ' ' A' ' 90' ' ' VAL . . . -87.56 168.1 37.75 Favored Glycine 0 N--CA 1.421 -2.359 0 C-N-CA 120.372 -0.918 . . . . 0.0 111.845 -177.316 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.04 -22.59 66.96 Favored 'General case' 0 C--N 1.305 -1.348 0 CA-C-O 121.592 0.711 . . . . 0.0 110.704 178.832 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -97.99 12.18 35.07 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.663 -0.699 . . . . 0.0 109.555 179.672 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 15.1 m 71.54 16.56 5.86 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.337 -178.961 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 9.6 t -76.09 115.94 16.3 Favored 'General case' 0 N--CA 1.444 -0.737 0 CA-C-N 115.551 -0.749 . . . . 0.0 110.234 -179.731 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.478 ' HA ' ' O ' ' A' ' 26' ' ' VAL . 40.9 mt-10 -89.15 112.68 23.74 Favored 'General case' 0 CA--C 1.509 -0.598 0 CA-C-O 120.942 0.401 . . . . 0.0 110.415 178.678 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 30.6 mm -99.48 135.53 34.45 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.515 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 177.193 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 11.9 m170 -116.13 132.74 56.57 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 109.549 -0.537 . . . . 0.0 109.549 -178.52 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.498 ' HZ ' HG23 ' A' ' 26' ' ' VAL . 1.4 p90 -147.22 166.77 26.0 Favored 'General case' 0 C--N 1.314 -0.972 0 CA-C-O 121.424 0.63 . . . . 0.0 111.6 -178.164 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 89.9 mttt -125.17 121.34 33.91 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.835 -178.79 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 28.1 m -139.15 156.97 28.08 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 CA-C-O 120.949 0.404 . . . . 0.0 110.165 179.455 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.528 ' O ' HG22 ' A' ' 42' ' ' THR . 80.4 tttt -84.21 167.25 16.85 Favored 'General case' 0 C--N 1.311 -1.072 0 O-C-N 121.98 -0.45 . . . . 0.0 110.654 179.832 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -73.39 -36.28 66.02 Favored 'General case' 0 N--CA 1.464 0.269 0 N-CA-C 112.907 0.706 . . . . 0.0 112.907 -176.931 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 11.3 t -96.18 15.72 20.16 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 112.02 0.378 . . . . 0.0 112.02 -177.182 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' THR . . . . . 0.528 HG22 ' O ' ' A' ' 39' ' ' LYS . 5.3 t -93.58 171.62 8.78 Favored 'General case' 0 C--N 1.319 -0.742 0 O-C-N 121.627 -0.67 . . . . 0.0 109.917 -179.604 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' HIS . . . . . 0.405 ' O ' ' HG2' ' A' ' 46' ' ' LYS . 51.6 m170 -88.39 141.23 28.71 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 121.381 0.61 . . . . 0.0 111.188 -179.535 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.631 ' HB2' ' O ' ' A' ' 75' ' ' HIS . 0.2 OUTLIER -69.49 -15.22 63.22 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.571 -0.74 . . . . 0.0 110.033 -179.815 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.778 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -54.75 -44.98 74.1 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-N 115.756 -0.656 . . . . 0.0 111.934 -179.225 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.459 ' N ' ' HD3' ' A' ' 45' ' ' LYS . 21.4 ptmt -69.49 -29.12 66.7 Favored 'General case' 0 C--O 1.218 -0.602 0 CA-C-O 121.286 0.565 . . . . 0.0 110.482 -178.233 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.579 ' HB3' HD13 ' A' ' 44' ' ' LEU . 8.0 tt -72.55 -49.83 29.89 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.498 -179.653 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.501 ' HG2' ' O ' ' A' ' 44' ' ' LEU . 8.3 ptmm? -61.76 -41.76 98.1 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.418 -178.306 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.778 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 8.2 pt-20 -72.16 -30.49 65.05 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-O 121.021 0.439 . . . . 0.0 110.716 177.841 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 50' ' ' SER . . . . . 0.594 ' O ' ' HG2' ' A' ' 53' ' ' GLN . 29.3 t -68.57 -43.7 76.01 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.431 -0.35 . . . . 0.0 111.5 -178.75 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.462 ' CD1' HG11 ' A' ' 26' ' ' VAL . 2.5 p90 -75.66 -32.46 60.19 Favored 'General case' 0 N--CA 1.446 -0.658 0 C-N-CA 119.531 -0.868 . . . . 0.0 110.206 -178.619 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 52' ' ' CYS . . . . . 0.512 ' SG ' HD11 ' A' ' 62' ' ' LEU . 98.9 m -65.14 -42.75 93.55 Favored 'General case' 0 CA--C 1.504 -0.807 0 CA-C-O 121.236 0.541 . . . . 0.0 110.601 179.765 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 53' ' ' GLN . . . . . 0.594 ' HG2' ' O ' ' A' ' 50' ' ' SER . 25.4 pt20 -67.37 -35.89 80.25 Favored 'General case' 0 N--CA 1.434 -1.271 0 CA-C-N 115.97 -0.559 . . . . 0.0 109.596 -179.728 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.41 ' NE ' ' HA ' ' A' ' 54' ' ' ARG . 1.0 OUTLIER -56.91 -39.35 74.28 Favored 'General case' 0 C--N 1.355 0.832 0 CA-C-O 121.315 0.578 . . . . 0.0 111.279 178.831 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 34.6 mt-30 -77.7 -20.91 52.81 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.888 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 80.86 33.63 29.57 Favored Glycine 0 N--CA 1.447 -0.615 0 C-N-CA 120.787 -0.721 . . . . 0.0 111.88 179.899 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 31.2 m -133.8 150.67 75.27 Favored Pre-proline 0 C--O 1.238 0.488 0 O-C-N 122.606 -0.349 . . . . 0.0 110.743 -178.685 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' PRO . . . . . 0.546 ' HG2' ' OG ' ' A' ' 61' ' ' SER . 29.9 Cg_endo -65.37 149.57 88.03 Favored 'Trans proline' 0 N--CA 1.455 -0.739 0 C-N-CA 122.558 2.172 . . . . 0.0 111.479 176.829 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.483 ' HG2' ' SG ' ' A' ' 52' ' ' CYS . 68.5 mtp -73.5 -8.38 55.69 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 121.246 0.546 . . . . 0.0 111.52 -176.686 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 60' ' ' ASN . . . . . 0.423 ' OD1' ' HB2' ' A' ' 58' ' ' PRO . 2.0 p-10 -90.82 -10.19 43.67 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-O 121.272 0.558 . . . . 0.0 111.046 -179.124 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.546 ' OG ' ' HG2' ' A' ' 58' ' ' PRO . 67.1 m -87.59 -19.22 28.12 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 121.08 0.467 . . . . 0.0 111.59 179.766 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.512 HD11 ' SG ' ' A' ' 52' ' ' CYS . 1.8 pp -127.66 170.31 12.83 Favored 'General case' 0 C--N 1.317 -0.829 0 N-CA-C 112.948 0.721 . . . . 0.0 112.948 -177.949 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.443 ' O ' ' HA ' ' A' ' 90' ' ' VAL . 44.2 mtm180 -120.18 119.4 33.14 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.606 -0.724 . . . . 0.0 110.824 -176.686 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.449 ' HB3' ' OH ' ' A' ' 51' ' ' TYR . 0.2 OUTLIER -102.33 116.11 31.96 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-O 121.085 0.469 . . . . 0.0 111.034 178.458 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.467 ' C ' HD22 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -143.3 162.52 35.45 Favored 'General case' 0 N--CA 1.444 -0.755 0 CA-C-O 121.395 0.616 . . . . 0.0 111.285 179.412 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.417 ' CB ' HD11 ' A' ' 71' ' ' ILE . 90.2 t80 -143.64 134.48 25.29 Favored 'General case' 0 C--N 1.306 -1.287 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 179.432 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.445 ' HG2' HE21 ' A' ' 69' ' ' GLN . 6.4 pt-20 49.34 27.34 1.9 Allowed 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 124.006 0.923 . . . . 0.0 112.354 -179.071 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 87.19 19.94 54.02 Favored Glycine 0 N--CA 1.449 -0.463 0 C-N-CA 121.079 -0.582 . . . . 0.0 113.687 -179.541 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' GLN . . . . . 0.445 HE21 ' HG2' ' A' ' 67' ' ' GLU . 3.3 pt20 -128.68 137.3 51.55 Favored 'General case' 0 C--N 1.319 -0.737 0 O-C-N 122.058 -0.672 . . . . 0.0 109.486 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -68.8 146.64 52.72 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-O 121.292 0.567 . . . . 0.0 110.225 178.241 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.508 HG21 HD12 ' A' ' 44' ' ' LEU . 24.5 mm -93.15 119.09 40.3 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.54 0 CA-C-O 120.931 0.396 . . . . 0.0 110.161 -179.613 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -96.96 163.54 12.91 Favored 'General case' 0 N--CA 1.437 -1.095 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 -179.505 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' ASP . . . . . 0.463 ' CA ' ' HB3' ' A' ' 45' ' ' LYS . 13.8 m-20 -65.02 -28.17 69.31 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-O 121.563 0.697 . . . . 0.0 110.769 -178.901 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 6.2 m-80 -95.36 4.13 53.7 Favored 'General case' 0 C--N 1.313 -0.981 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.994 -176.443 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' HIS . . . . . 0.631 ' O ' ' HB2' ' A' ' 44' ' ' LEU . 1.7 m170 -80.29 141.69 35.25 Favored 'General case' 0 CA--C 1.509 -0.629 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 179.974 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.418 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 69.7 p -116.57 154.11 49.1 Favored Pre-proline 0 C--N 1.308 -1.236 0 C-N-CA 120.829 -0.348 . . . . 0.0 111.286 178.942 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -58.64 -40.6 72.02 Favored 'Trans proline' 0 C--N 1.349 0.594 0 C-N-CA 122.624 2.216 . . . . 0.0 111.602 179.264 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' LYS . . . . . 0.483 ' HG3' ' N ' ' A' ' 79' ' ' GLU . 17.3 pttt -68.66 -35.52 77.36 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.05 0.452 . . . . 0.0 111.114 -178.146 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 79' ' ' GLU . . . . . 0.483 ' N ' ' HG3' ' A' ' 78' ' ' LYS . 32.8 mm-40 -76.24 -32.74 59.04 Favored 'General case' 0 CA--C 1.508 -0.672 0 CA-C-O 120.854 0.359 . . . . 0.0 111.233 -179.29 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.469 HD21 ' CG ' ' A' ' 75' ' ' HIS . 5.5 mt -83.27 -2.76 56.43 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.417 0.627 . . . . 0.0 110.361 178.954 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 75.06 44.52 23.28 Favored Glycine 0 N--CA 1.449 -0.456 0 CA-C-N 115.852 -0.613 . . . . 0.0 112.552 177.696 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 63.0 mtt -101.65 162.02 13.21 Favored 'General case' 0 C--N 1.316 -0.874 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 178.745 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -139.85 -172.76 3.46 Favored 'General case' 0 C--N 1.309 -1.181 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 178.471 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.457 ' HA ' ' HB ' ' A' ' 22' ' ' ILE . 10.0 pt-20 -73.34 136.23 44.41 Favored 'General case' 0 N--CA 1.443 -0.813 0 C-N-CA 119.843 -0.743 . . . . 0.0 110.836 179.443 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 85' ' ' GLU . . . . . 0.405 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 42.9 mt-10 76.04 5.06 3.8 Favored 'General case' 0 C--N 1.321 -0.644 0 C-N-CA 124.612 1.165 . . . . 0.0 111.557 -179.114 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 1.8 t0 -63.22 163.84 9.69 Favored 'General case' 0 C--O 1.238 0.488 0 CA-C-O 121.007 0.432 . . . . 0.0 110.309 176.435 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 9.1 p -126.92 143.14 41.37 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.267 0 CA-C-O 121.421 0.629 . . . . 0.0 111.713 -175.934 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 3.4 mp -113.2 152.19 14.96 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.746 0 N-CA-C 108.611 -0.885 . . . . 0.0 108.611 178.134 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -105.42 137.24 43.55 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-O 121.182 0.515 . . . . 0.0 110.754 -175.89 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 90' ' ' VAL . . . . . 0.443 ' HA ' ' O ' ' A' ' 63' ' ' ARG . 58.3 t -130.02 134.97 62.01 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.843 0 CA-C-O 121.398 0.618 . . . . 0.0 110.74 178.68 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 95.7 m-85 -123.33 -178.79 4.09 Favored 'General case' 0 C--N 1.307 -1.276 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 178.645 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 8.0 tp60 -104.65 152.75 22.09 Favored 'General case' 0 C--N 1.305 -1.344 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 179.332 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 . . . . . 0 C--N 1.325 -0.463 0 CA-C-O 121.424 0.63 . . . . 0.0 110.329 175.207 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 22' ' ' ILE . . . . . 0.422 ' HB ' ' HA ' ' A' ' 84' ' ' GLU . 21.1 pt . . . . . 0 N--CA 1.445 -0.72 0 CA-C-O 121.261 0.553 . . . . 0.0 110.391 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -117.17 143.0 46.32 Favored 'General case' 0 C--N 1.303 -1.427 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 -179.68 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.4 mp -135.21 162.02 33.71 Favored 'General case' 0 C--N 1.309 -1.177 0 CA-C-O 121.202 0.525 . . . . 0.0 110.863 176.778 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.569 ' HG3' ' NE2' ' A' ' 35' ' ' HIS . 2.9 tmmt? -133.22 144.02 49.52 Favored 'General case' 0 N--CA 1.439 -1.002 0 CA-C-O 121.391 0.615 . . . . 0.0 111.186 -178.648 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.561 HG23 ' HZ ' ' A' ' 36' ' ' PHE . 1.0 OUTLIER -118.54 139.03 47.31 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.314 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.231 178.904 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.442 ' CD1' ' HG2' ' A' ' 33' ' ' GLU . 40.1 mm -107.19 99.13 7.95 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.01 0 N-CA-C 108.525 -0.917 . . . . 0.0 108.525 175.039 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' GLY . . . . . 0.59 ' HA2' ' HB ' ' A' ' 90' ' ' VAL . . . -69.8 161.9 52.68 Favored Glycine 0 N--CA 1.42 -2.396 0 C-N-CA 120.27 -0.966 . . . . 0.0 112.943 178.382 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.417 ' HG3' ' H ' ' A' ' 29' ' ' GLN . 0.0 OUTLIER -54.62 -28.55 47.54 Favored 'General case' 0 C--N 1.306 -1.293 0 C-N-CA 123.675 0.79 . . . . 0.0 112.01 176.914 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -88.49 14.88 8.82 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-O 121.249 0.547 . . . . 0.0 110.362 179.597 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 55.6 m 67.62 14.56 9.57 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-O 121.76 0.791 . . . . 0.0 110.353 -177.639 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 2.2 t -72.82 101.48 3.15 Favored 'General case' 0 N--CA 1.438 -1.07 0 CA-C-N 115.238 -0.892 . . . . 0.0 110.4 -179.664 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.442 ' HG2' ' CD1' ' A' ' 27' ' ' ILE . 23.9 mt-10 -79.7 103.61 9.72 Favored 'General case' 0 N--CA 1.444 -0.749 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 177.569 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.417 HG21 ' HA ' ' A' ' 51' ' ' TYR . 23.0 mm -97.33 130.97 45.21 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.587 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 -178.918 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' HIS . . . . . 0.569 ' NE2' ' HG3' ' A' ' 25' ' ' LYS . 12.1 m170 -115.95 123.77 48.87 Favored 'General case' 0 CA--C 1.505 -0.768 0 N-CA-C 109.646 -0.501 . . . . 0.0 109.646 -178.953 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.561 ' HZ ' HG23 ' A' ' 26' ' ' VAL . 1.3 p90 -138.15 147.28 43.73 Favored 'General case' 0 C--N 1.301 -1.534 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.763 -177.156 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 96.2 mttt -109.7 117.92 35.17 Favored 'General case' 0 C--N 1.311 -1.068 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.022 -179.333 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.412 HG21 HD12 ' A' ' 47' ' ' LEU . 24.6 m -137.17 167.04 24.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.351 -178.433 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.423 ' HG2' ' N ' ' A' ' 40' ' ' MET . 81.7 tttt -90.76 160.03 16.01 Favored 'General case' 0 C--N 1.318 -0.8 0 O-C-N 121.782 -0.574 . . . . 0.0 110.695 -179.769 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' MET . . . . . 0.423 ' N ' ' HG2' ' A' ' 39' ' ' LYS . 0.0 OUTLIER -66.21 -37.85 86.56 Favored 'General case' 0 CA--C 1.517 -0.317 0 N-CA-C 112.594 0.591 . . . . 0.0 112.594 -177.466 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 11.0 t -98.84 17.87 18.44 Favored 'General case' 0 C--N 1.312 -1.032 0 CA-C-O 120.952 0.406 . . . . 0.0 111.741 -175.739 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 1.1 t -95.16 165.73 12.26 Favored 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 120.205 -0.598 . . . . 0.0 109.788 179.069 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 18.3 m170 -81.28 137.52 35.79 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-O 121.498 0.666 . . . . 0.0 112.029 -179.917 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.598 ' HB2' ' O ' ' A' ' 75' ' ' HIS . 0.4 OUTLIER -65.71 -14.39 61.19 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.034 -0.984 . . . . 0.0 110.968 179.784 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.748 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -51.01 -54.45 24.45 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.505 0.557 . . . . 0.0 112.505 -178.432 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.432 ' HD3' ' N ' ' A' ' 47' ' ' LEU . 0.1 OUTLIER -66.85 -25.27 66.34 Favored 'General case' 0 C--O 1.218 -0.573 0 CA-C-O 121.289 0.566 . . . . 0.0 111.491 -178.192 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.463 ' HB3' HD13 ' A' ' 44' ' ' LEU . 8.2 tt -73.51 -51.34 17.4 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.708 178.93 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.49 ' HG2' ' O ' ' A' ' 44' ' ' LEU . 8.7 ptmm? -62.39 -40.27 95.95 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.904 0.383 . . . . 0.0 111.522 -177.566 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.748 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 11.5 pt-20 -72.57 -31.29 65.12 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-O 120.909 0.385 . . . . 0.0 110.632 177.838 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 50' ' ' SER . . . . . 0.408 ' HB2' ' O ' ' A' ' 46' ' ' LYS . 38.1 t -65.86 -44.33 85.73 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-O 120.932 0.396 . . . . 0.0 111.226 -179.292 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.54 ' CD1' HG11 ' A' ' 26' ' ' VAL . 1.2 p90 -76.49 -33.17 58.66 Favored 'General case' 0 N--CA 1.443 -0.78 0 C-N-CA 119.676 -0.81 . . . . 0.0 110.266 -177.78 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 84.5 m -61.81 -44.75 96.24 Favored 'General case' 0 CA--C 1.512 -0.513 0 CA-C-O 121.174 0.512 . . . . 0.0 110.57 179.727 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 12.9 pt20 -69.63 -32.5 71.23 Favored 'General case' 0 N--CA 1.444 -0.727 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.552 -179.022 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.557 ' NE ' ' HA ' ' A' ' 54' ' ' ARG . 6.9 mmp_? -59.61 -29.41 67.97 Favored 'General case' 0 C--N 1.344 0.337 0 CA-C-O 121.13 0.491 . . . . 0.0 111.465 177.319 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 34.0 mt-30 -89.36 -21.09 23.27 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-O 121.04 0.448 . . . . 0.0 111.046 179.57 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 84.8 28.58 31.48 Favored Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 120.855 -0.688 . . . . 0.0 112.272 179.476 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 27.3 m -133.05 153.37 80.88 Favored Pre-proline 0 C--N 1.324 -0.542 0 O-C-N 122.375 -0.486 . . . . 0.0 110.948 -178.656 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' PRO . . . . . 0.433 ' HB2' ' OD1' ' A' ' 60' ' ' ASN . 59.1 Cg_endo -77.6 164.57 28.14 Favored 'Trans proline' 0 N--CA 1.457 -0.63 0 C-N-CA 122.631 2.221 . . . . 0.0 112.417 177.864 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 42.0 mtt -69.75 -8.67 49.99 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-N 116.184 -0.462 . . . . 0.0 112.111 -177.415 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' ASN . . . . . 0.433 ' OD1' ' HB2' ' A' ' 58' ' ' PRO . 1.4 p-10 -92.7 -11.74 33.26 Favored 'General case' 0 C--N 1.312 -1.037 0 CA-C-O 121.319 0.581 . . . . 0.0 111.023 -177.649 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 50.0 m -88.43 -22.67 23.6 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-O 121.275 0.56 . . . . 0.0 111.314 -179.114 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -135.27 165.09 26.23 Favored 'General case' 0 C--N 1.307 -1.257 0 CA-C-O 121.372 0.606 . . . . 0.0 112.401 -176.954 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.568 ' O ' ' HA ' ' A' ' 90' ' ' VAL . 9.8 mtp180 -116.27 118.88 33.99 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.256 -178.123 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.501 ' HB3' ' OH ' ' A' ' 51' ' ' TYR . 0.2 OUTLIER -96.72 112.36 24.14 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-O 121.064 0.459 . . . . 0.0 110.671 177.515 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.455 ' C ' HD22 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -143.12 164.7 29.44 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-O 121.614 0.721 . . . . 0.0 111.928 -179.258 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 91.8 t80 -145.41 135.14 23.46 Favored 'General case' 0 C--N 1.31 -1.116 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 179.056 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.466 ' HG2' HE21 ' A' ' 69' ' ' GLN . 6.8 pt-20 49.19 27.81 1.95 Allowed 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 124.214 1.006 . . . . 0.0 112.292 -179.19 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 85.59 23.21 47.78 Favored Glycine 0 CA--C 1.523 0.591 0 C-N-CA 120.885 -0.674 . . . . 0.0 113.312 -178.817 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' GLN . . . . . 0.466 HE21 ' HG2' ' A' ' 67' ' ' GLU . 3.0 pt20 -131.75 134.27 45.68 Favored 'General case' 0 C--N 1.321 -0.655 0 O-C-N 122.191 -0.594 . . . . 0.0 109.452 179.341 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.499 ' CD ' ' H ' ' A' ' 70' ' ' ARG . 0.1 OUTLIER -73.58 145.03 45.78 Favored 'General case' 0 C--N 1.31 -1.131 0 CA-C-O 121.695 0.76 . . . . 0.0 110.497 178.113 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 23.0 mm -91.58 126.82 44.19 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.516 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.78 -176.671 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -102.15 165.49 11.12 Favored 'General case' 0 N--CA 1.44 -0.934 0 N-CA-C 109.891 -0.411 . . . . 0.0 109.891 179.906 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -69.22 -21.66 63.93 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-O 121.288 0.566 . . . . 0.0 111.562 -178.951 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 12.0 m-80 -98.26 1.45 47.23 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-O 121.369 0.604 . . . . 0.0 109.863 -179.803 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' HIS . . . . . 0.598 ' O ' ' HB2' ' A' ' 44' ' ' LEU . 5.2 m170 -79.85 142.32 35.36 Favored 'General case' 0 CA--C 1.505 -0.765 0 CA-C-N 116.14 -0.482 . . . . 0.0 109.948 179.933 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.447 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 66.7 p -118.51 154.5 52.36 Favored Pre-proline 0 C--N 1.304 -1.391 0 CA-C-N 116.751 -0.204 . . . . 0.0 110.637 178.514 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 24.9 Cg_exo -62.33 -37.51 60.51 Favored 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 122.429 2.086 . . . . 0.0 110.917 179.457 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' LYS . . . . . 0.544 ' HG3' ' N ' ' A' ' 79' ' ' GLU . 41.3 pttt -65.56 -43.22 90.51 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.794 -179.501 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 79' ' ' GLU . . . . . 0.544 ' N ' ' HG3' ' A' ' 78' ' ' LYS . 5.9 mm-40 -70.59 -40.32 73.33 Favored 'General case' 0 CA--C 1.509 -0.628 0 CA-C-O 120.902 0.382 . . . . 0.0 111.475 -177.919 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.447 ' HG ' ' O ' ' A' ' 76' ' ' THR . 5.2 mt -74.63 -10.47 59.57 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.328 0.585 . . . . 0.0 110.282 179.971 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 81.78 44.18 7.91 Favored Glycine 0 N--CA 1.45 -0.417 0 CA-C-N 115.887 -0.597 . . . . 0.0 113.246 176.698 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 57.2 mtt -100.99 166.31 10.88 Favored 'General case' 0 C--N 1.314 -0.94 0 N-CA-C 109.489 -0.559 . . . . 0.0 109.489 178.514 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 83' ' ' GLU . . . . . 0.445 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 12.8 pt-20 -135.31 -169.76 2.45 Favored 'General case' 0 C--N 1.311 -1.066 0 N-CA-C 109.662 -0.496 . . . . 0.0 109.662 177.162 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.422 ' HA ' ' HB ' ' A' ' 22' ' ' ILE . 11.3 pt-20 -73.64 143.29 46.35 Favored 'General case' 0 N--CA 1.445 -0.717 0 C-N-CA 120.306 -0.557 . . . . 0.0 110.156 179.183 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 70.25 8.91 6.84 Favored 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 123.437 0.695 . . . . 0.0 111.497 -179.935 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 86' ' ' ASP . . . . . 0.445 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 3.2 t0 -65.71 162.11 19.24 Favored 'General case' 0 C--O 1.24 0.562 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.155 175.893 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 11.6 p -127.54 142.81 42.59 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.443 0 CA-C-O 121.653 0.739 . . . . 0.0 111.48 -177.049 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 88' ' ' ILE . . . . . 0.48 ' HB ' HG22 ' A' ' 26' ' ' VAL . 3.6 mp -112.63 149.82 15.02 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.213 0 N-CA-C 107.885 -1.154 . . . . 0.0 107.885 178.288 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 20.3 tp10 -106.84 141.38 38.17 Favored 'General case' 0 C--N 1.308 -1.205 0 CA-C-O 120.958 0.409 . . . . 0.0 110.39 -175.144 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 90' ' ' VAL . . . . . 0.59 ' HB ' ' HA2' ' A' ' 28' ' ' GLY . 77.4 t -130.93 133.82 62.5 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.188 0 CA-C-O 120.986 0.422 . . . . 0.0 110.413 178.811 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 82.2 m-85 -117.86 173.29 6.84 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-O 120.753 0.311 . . . . 0.0 110.376 -178.566 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 92' ' ' GLN . . . . . 0.407 ' NE2' ' HG2' ' A' ' 29' ' ' GLN . 7.5 tp60 -103.41 133.39 48.55 Favored 'General case' 0 C--N 1.311 -1.074 0 CA-C-O 120.915 0.388 . . . . 0.0 110.966 -179.752 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 . . . . . 0 C--N 1.323 -0.579 0 CA-C-O 121.481 0.658 . . . . 0.0 110.201 176.137 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 22.4 pt . . . . . 0 N--CA 1.457 -0.124 0 CA-C-O 121.434 0.635 . . . . 0.0 110.607 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.421 ' HE3' ' HB2' ' A' ' 23' ' ' LYS . 31.5 mtmt -117.83 139.0 51.71 Favored 'General case' 0 C--N 1.308 -1.203 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.328 -178.106 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.4 mp -134.94 163.74 29.17 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-O 121.163 0.506 . . . . 0.0 110.816 176.704 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.478 ' NZ ' HD11 ' A' ' 27' ' ' ILE . 2.3 tmmt? -132.94 144.88 50.44 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-O 121.164 0.507 . . . . 0.0 110.344 179.878 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.615 HG23 ' HZ ' ' A' ' 36' ' ' PHE . 0.9 OUTLIER -114.83 142.3 28.16 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.286 0 CA-C-O 121.091 0.472 . . . . 0.0 111.351 179.121 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.478 HD11 ' NZ ' ' A' ' 25' ' ' LYS . 45.9 mm -104.89 112.69 39.55 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.213 0 N-CA-C 107.634 -1.247 . . . . 0.0 107.634 175.274 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -79.28 171.87 55.01 Favored Glycine 0 N--CA 1.424 -2.158 0 C-N-CA 120.447 -0.882 . . . . 0.0 112.565 -176.198 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.563 ' H ' ' CD ' ' A' ' 29' ' ' GLN . 0.0 OUTLIER -67.5 -23.01 65.42 Favored 'General case' 0 C--N 1.309 -1.183 0 CA-C-O 121.739 0.78 . . . . 0.0 109.573 179.082 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -97.83 12.42 34.01 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.315 -0.857 . . . . 0.0 109.362 177.465 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 49.5 m 70.24 15.81 7.42 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.809 -178.906 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 21.9 t -71.19 116.3 11.34 Favored 'General case' 0 N--CA 1.445 -0.677 0 CA-C-N 115.416 -0.811 . . . . 0.0 109.846 178.901 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.443 ' HA ' ' O ' ' A' ' 26' ' ' VAL . 32.4 mt-10 -89.4 108.69 19.78 Favored 'General case' 0 N--CA 1.445 -0.725 0 CA-C-O 121.226 0.536 . . . . 0.0 109.988 179.268 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 34.4 mm -97.79 138.79 21.59 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.371 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 179.4 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 13.3 m170 -116.95 129.6 56.15 Favored 'General case' 0 C--N 1.317 -0.829 0 N-CA-C 109.511 -0.551 . . . . 0.0 109.511 -178.387 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.615 ' HZ ' HG23 ' A' ' 26' ' ' VAL . 1.9 p90 -147.02 158.02 43.8 Favored 'General case' 0 C--N 1.307 -1.25 0 CA-C-O 121.477 0.656 . . . . 0.0 110.603 -179.158 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 47.1 mtmt -126.17 116.31 21.14 Favored 'General case' 0 C--N 1.301 -1.502 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.652 -178.593 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.426 HG21 HD12 ' A' ' 47' ' ' LEU . 17.6 m -132.81 163.85 36.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.525 -176.74 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.455 ' O ' HG22 ' A' ' 42' ' ' THR . 84.9 tttt -85.67 160.33 19.59 Favored 'General case' 0 C--N 1.316 -0.857 0 O-C-N 121.923 -0.486 . . . . 0.0 111.413 -178.279 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -70.39 -37.18 74.45 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.031 0.444 . . . . 0.0 112.154 -177.625 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 14.5 t -90.51 9.35 29.69 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.531 -177.79 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' THR . . . . . 0.455 HG22 ' O ' ' A' ' 39' ' ' LYS . 1.2 t -92.06 167.73 11.87 Favored 'General case' 0 C--N 1.322 -0.591 0 C-N-CA 120.03 -0.668 . . . . 0.0 110.298 -178.482 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' HIS . . . . . 0.53 ' HB3' ' HG2' ' A' ' 45' ' ' LYS . 31.9 m170 -87.93 141.65 28.41 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-O 121.51 0.671 . . . . 0.0 111.589 -179.26 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.515 ' HB2' ' O ' ' A' ' 75' ' ' HIS . 0.6 OUTLIER -65.68 -19.26 65.83 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.554 -0.748 . . . . 0.0 111.515 179.944 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.53 ' HG2' ' HB3' ' A' ' 43' ' ' HIS . 7.5 ptpt -50.82 -49.24 59.08 Favored 'General case' 0 N--CA 1.463 0.188 0 N-CA-C 112.018 0.377 . . . . 0.0 112.018 -179.167 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.6 -29.67 69.06 Favored 'General case' 0 C--O 1.207 -1.162 0 CA-C-O 120.893 0.378 . . . . 0.0 111.239 -178.847 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.426 HD12 HG21 ' A' ' 38' ' ' VAL . 8.3 tt -70.71 -47.83 57.76 Favored 'General case' 0 C--N 1.311 -1.106 0 CA-C-O 121.3 0.571 . . . . 0.0 109.608 178.29 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.519 ' HD3' ' HA ' ' A' ' 45' ' ' LYS . 30.9 mtpt -58.82 -45.9 88.88 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.204 -179.718 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.87 -30.56 65.54 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 121.282 0.563 . . . . 0.0 110.713 -179.383 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 5.6 m -68.67 -44.43 74.09 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-N 115.984 -0.553 . . . . 0.0 112.089 -179.754 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.464 ' CE2' ' HA ' ' A' ' 48' ' ' LYS . 3.0 p90 -74.59 -33.55 62.66 Favored 'General case' 0 C--N 1.324 -0.541 0 C-N-CA 119.551 -0.86 . . . . 0.0 110.178 -178.936 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 52' ' ' CYS . . . . . 0.586 ' SG ' HD11 ' A' ' 62' ' ' LEU . 84.2 m -59.22 -46.87 87.31 Favored 'General case' 0 C--O 1.238 0.454 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.09 178.658 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 7.1 pt20 -68.06 -32.68 73.19 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 120.526 -0.469 . . . . 0.0 110.95 -179.217 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 1.6 mmp_? -59.42 -34.58 72.66 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-O 121.062 0.458 . . . . 0.0 111.662 177.669 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 32.4 mt-30 -81.81 -20.4 39.18 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-O 121.372 0.606 . . . . 0.0 110.286 179.034 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 82.2 28.9 39.04 Favored Glycine 0 N--CA 1.443 -0.872 0 CA-C-N 115.823 -0.626 . . . . 0.0 112.02 -179.994 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 33.9 m -131.45 145.95 59.83 Favored Pre-proline 0 C--N 1.326 -0.443 0 O-C-N 122.548 -0.384 . . . . 0.0 110.74 -179.313 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' PRO . . . . . 0.446 ' HG2' ' OG ' ' A' ' 61' ' ' SER . 28.0 Cg_endo -65.05 150.49 87.88 Favored 'Trans proline' 0 C--O 1.24 0.599 0 C-N-CA 122.513 2.142 . . . . 0.0 112.228 178.505 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.524 ' HG2' ' SG ' ' A' ' 52' ' ' CYS . 77.8 mtp -66.16 -13.66 60.57 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.851 -177.849 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 30.7 p30 -84.39 -12.78 53.85 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 121.507 0.67 . . . . 0.0 110.929 -178.456 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.446 ' OG ' ' HG2' ' A' ' 58' ' ' PRO . 70.6 m -87.79 -20.42 26.15 Favored 'General case' 0 C--N 1.309 -1.176 0 N-CA-C 112.407 0.521 . . . . 0.0 112.407 -178.072 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.586 HD11 ' SG ' ' A' ' 52' ' ' CYS . 1.4 pp -127.05 171.98 10.9 Favored 'General case' 0 C--N 1.309 -1.187 0 N-CA-C 113.487 0.921 . . . . 0.0 113.487 -176.327 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.468 ' O ' ' HA ' ' A' ' 90' ' ' VAL . 46.6 mtm180 -122.88 122.45 38.66 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.25 -0.886 . . . . 0.0 110.55 -177.358 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -105.5 118.63 37.07 Favored 'General case' 0 C--N 1.313 -1.007 0 CA-C-O 121.173 0.511 . . . . 0.0 111.248 179.561 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.464 ' HA ' HG12 ' A' ' 71' ' ' ILE . 0.0 OUTLIER -146.26 164.58 31.87 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 121.41 0.624 . . . . 0.0 111.034 179.613 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 88.1 t80 -142.88 134.92 27.12 Favored 'General case' 0 C--N 1.31 -1.143 0 N-CA-C 108.978 -0.749 . . . . 0.0 108.978 179.455 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 49.95 26.94 2.19 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 123.96 0.904 . . . . 0.0 112.268 -178.968 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 85.1 21.5 55.02 Favored Glycine 0 CA--C 1.523 0.534 0 C-N-CA 120.99 -0.624 . . . . 0.0 113.57 -178.598 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 6.0 pt20 -128.23 134.91 49.07 Favored 'General case' 0 C--N 1.322 -0.622 0 O-C-N 122.245 -0.562 . . . . 0.0 109.548 179.69 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -64.52 145.01 56.78 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-O 121.677 0.751 . . . . 0.0 111.09 177.473 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.464 HG12 ' HA ' ' A' ' 65' ' ' LEU . 22.3 mm -97.15 118.11 42.99 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.29 0 CA-C-O 121.142 0.496 . . . . 0.0 110.117 179.634 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -89.67 162.55 15.54 Favored 'General case' 0 N--CA 1.437 -1.116 0 N-CA-C 109.457 -0.572 . . . . 0.0 109.457 -179.83 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' ASP . . . . . 0.441 ' HB3' ' HB3' ' A' ' 45' ' ' LYS . 67.4 m-20 -65.47 -25.43 67.49 Favored 'General case' 0 C--N 1.313 -0.993 0 CA-C-O 121.609 0.719 . . . . 0.0 110.318 179.093 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 7.4 m-80 -97.46 9.21 42.99 Favored 'General case' 0 C--N 1.312 -1.041 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.178 -179.254 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' HIS . . . . . 0.515 ' O ' ' HB2' ' A' ' 44' ' ' LEU . 2.2 m170 -84.54 141.2 30.9 Favored 'General case' 0 CA--C 1.504 -0.798 0 N-CA-C 109.398 -0.593 . . . . 0.0 109.398 179.234 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.411 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 70.7 p -118.65 154.64 52.65 Favored Pre-proline 0 C--N 1.306 -1.324 0 C-N-CA 121.099 -0.24 . . . . 0.0 110.435 -179.891 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_exo -59.99 -39.47 70.34 Favored 'Trans proline' 0 N--CA 1.457 -0.637 0 C-N-CA 122.37 2.047 . . . . 0.0 111.459 179.861 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' LYS . . . . . 0.511 ' HG3' ' N ' ' A' ' 79' ' ' GLU . 37.6 pttt -68.96 -38.53 79.45 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 120.974 0.416 . . . . 0.0 111.163 -178.463 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 79' ' ' GLU . . . . . 0.511 ' N ' ' HG3' ' A' ' 78' ' ' LYS . 11.1 mm-40 -72.4 -34.07 67.61 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-O 120.994 0.426 . . . . 0.0 110.896 -178.266 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.437 HD21 ' CG ' ' A' ' 75' ' ' HIS . 5.8 mt -84.63 2.11 43.07 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.24 0.543 . . . . 0.0 111.021 179.624 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 73.84 41.2 42.5 Favored Glycine 0 C--O 1.237 0.335 0 C-N-CA 120.99 -0.624 . . . . 0.0 112.964 177.199 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 63.9 mtt -100.01 164.88 11.8 Favored 'General case' 0 C--N 1.313 -1.012 0 N-CA-C 109.233 -0.654 . . . . 0.0 109.233 178.857 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 83' ' ' GLU . . . . . 0.413 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 11.5 pt-20 -144.23 -170.4 3.35 Favored 'General case' 0 C--N 1.31 -1.12 0 N-CA-C 110.096 -0.335 . . . . 0.0 110.096 178.606 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -64.44 141.53 58.74 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 120.707 0.289 . . . . 0.0 110.372 178.926 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 73.42 1.2 3.9 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 123.558 0.743 . . . . 0.0 112.211 176.814 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 86' ' ' ASP . . . . . 0.413 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 1.5 t70 -61.89 160.87 11.35 Favored 'General case' 0 N--CA 1.476 0.871 0 CA-C-O 121.364 0.602 . . . . 0.0 111.521 -179.546 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 87' ' ' VAL . . . . . 0.411 ' HA ' ' O ' ' A' ' 25' ' ' LYS . 7.8 p -128.45 143.91 39.57 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.953 0 CA-C-O 121.429 0.633 . . . . 0.0 111.494 -177.09 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 88' ' ' ILE . . . . . 0.436 ' HB ' HG22 ' A' ' 26' ' ' VAL . 3.7 mp -113.2 151.92 15.0 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.802 0 N-CA-C 109.245 -0.65 . . . . 0.0 109.245 179.144 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 89' ' ' GLU . . . . . 0.424 ' O ' HD13 ' A' ' 65' ' ' LEU . 6.2 tp10 -104.69 137.06 43.07 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.947 0.403 . . . . 0.0 110.47 -176.531 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 90' ' ' VAL . . . . . 0.468 ' HA ' ' O ' ' A' ' 63' ' ' ARG . 95.2 t -128.54 132.45 67.9 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.852 0 CA-C-O 121.282 0.563 . . . . 0.0 111.482 179.088 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 77.1 m-85 -115.0 179.17 4.03 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 178.663 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 7.9 tp60 -106.65 144.61 33.06 Favored 'General case' 0 C--N 1.311 -1.096 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 178.614 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 93' ' ' GLU . . . . . 0.416 ' HB3' ' HG3' ' A' ' 63' ' ' ARG . 7.4 pt-20 . . . . . 0 C--N 1.324 -0.515 0 CA-C-O 121.103 0.478 . . . . 0.0 110.706 176.253 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' ILE . . . . . 0.408 ' HB ' ' HA ' ' A' ' 84' ' ' GLU . 18.5 pt . . . . . 0 N--CA 1.445 -0.722 0 CA-C-O 121.6 0.714 . . . . 0.0 110.427 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 31.5 mtmt -116.98 142.37 47.03 Favored 'General case' 0 C--N 1.299 -1.618 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 -179.04 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.0 mp -136.79 164.71 27.63 Favored 'General case' 0 C--N 1.308 -1.198 0 CA-C-O 121.187 0.518 . . . . 0.0 110.713 175.218 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.407 ' HE2' ' HB3' ' A' ' 25' ' ' LYS . 5.3 tmmm? -136.79 143.18 43.05 Favored 'General case' 0 C--N 1.313 -1.003 0 CA-C-O 121.254 0.55 . . . . 0.0 110.544 -178.982 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.558 HG23 ' HZ ' ' A' ' 36' ' ' PHE . 1.0 OUTLIER -114.62 142.16 28.42 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.251 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.651 -179.647 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.45 HD13 ' HG2' ' A' ' 33' ' ' GLU . 32.9 mm -111.05 97.59 5.94 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.007 0 N-CA-C 108.117 -1.068 . . . . 0.0 108.117 175.752 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' GLY . . . . . 0.592 ' HA2' ' HB ' ' A' ' 90' ' ' VAL . . . -65.86 167.74 33.76 Favored Glycine 0 N--CA 1.437 -1.286 0 C-N-CA 120.506 -0.854 . . . . 0.0 113.127 178.924 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.22 -18.8 28.8 Favored 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 112.586 0.587 . . . . 0.0 112.586 177.753 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -102.76 13.49 34.28 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-O 121.519 0.676 . . . . 0.0 109.932 179.861 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 49.7 m 73.68 21.38 2.81 Favored 'General case' 0 CA--C 1.509 -0.617 0 CA-C-O 122.629 1.204 . . . . 0.0 108.39 -178.508 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -67.68 96.14 0.53 Allowed 'General case' 0 N--CA 1.424 -1.745 0 CA-C-N 113.362 -1.744 . . . . 0.0 111.474 -178.641 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.483 ' HA ' ' O ' ' A' ' 26' ' ' VAL . 15.0 mt-10 -78.74 104.32 9.28 Favored 'General case' 0 CA--C 1.496 -1.107 0 CA-C-O 121.138 0.494 . . . . 0.0 110.69 177.447 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.532 HG21 ' HA ' ' A' ' 51' ' ' TYR . 33.1 mm -97.67 132.58 42.14 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.319 0 N-CA-C 108.159 -1.052 . . . . 0.0 108.159 175.457 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 12.4 m170 -116.92 121.95 42.91 Favored 'General case' 0 C--N 1.317 -0.823 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 -176.958 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.558 ' HZ ' HG23 ' A' ' 26' ' ' VAL . 1.5 p90 -137.93 162.26 34.5 Favored 'General case' 0 C--N 1.308 -1.225 0 CA-C-O 121.379 0.609 . . . . 0.0 111.292 -177.38 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 15.5 mtpt -124.38 115.84 21.61 Favored 'General case' 0 C--N 1.313 -0.979 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.646 -178.793 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 32.8 m -134.03 166.48 28.75 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.435 0 CA-C-O 121.073 0.463 . . . . 0.0 110.735 -178.296 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.515 ' O ' HG22 ' A' ' 42' ' ' THR . 84.2 tttt -89.65 167.85 12.59 Favored 'General case' 0 C--N 1.313 -1.021 0 O-C-N 122.035 -0.416 . . . . 0.0 110.538 -178.541 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -79.11 -37.12 39.48 Favored 'General case' 0 N--CA 1.464 0.26 0 N-CA-C 112.626 0.602 . . . . 0.0 112.626 -178.131 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 13.5 t -93.84 19.86 8.36 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-O 121.079 0.466 . . . . 0.0 111.688 -176.682 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' THR . . . . . 0.515 HG22 ' O ' ' A' ' 39' ' ' LYS . 6.7 t -99.76 173.28 6.77 Favored 'General case' 0 C--N 1.32 -0.708 0 O-C-N 122.006 -0.434 . . . . 0.0 109.961 179.844 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 5.6 m-70 -88.04 142.31 27.88 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-O 121.491 0.662 . . . . 0.0 111.354 179.116 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.599 ' O ' ' HG3' ' A' ' 48' ' ' LYS . 0.2 OUTLIER -69.92 -18.34 63.37 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.54 -0.755 . . . . 0.0 109.725 -179.19 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.676 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -53.89 -44.71 70.71 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-N 115.849 -0.614 . . . . 0.0 112.305 -177.932 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.484 ' N ' ' HD3' ' A' ' 45' ' ' LYS . 21.8 ptmt -67.41 -28.17 67.69 Favored 'General case' 0 CA--C 1.517 -0.29 0 CA-C-O 121.449 0.643 . . . . 0.0 110.538 -178.156 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.538 ' HB3' HD13 ' A' ' 44' ' ' LEU . 7.9 tt -72.08 -47.44 51.39 Favored 'General case' 0 C--N 1.313 -1.01 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.886 179.083 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.599 ' HG3' ' O ' ' A' ' 44' ' ' LEU . 29.5 mtpt -58.69 -48.3 81.59 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.419 -179.233 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.676 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 5.6 pt-20 -68.83 -31.9 71.21 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.709 -179.281 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 50' ' ' SER . . . . . 0.401 ' O ' ' HG2' ' A' ' 54' ' ' ARG . 28.8 t -67.44 -46.11 74.07 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-O 121.028 0.442 . . . . 0.0 111.234 -178.998 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.532 ' HA ' HG21 ' A' ' 34' ' ' ILE . 2.0 p90 -75.83 -32.78 59.95 Favored 'General case' 0 N--CA 1.445 -0.683 0 C-N-CA 119.801 -0.76 . . . . 0.0 110.544 -177.217 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 52' ' ' CYS . . . . . 0.547 ' SG ' ' HG2' ' A' ' 59' ' ' MET . 86.8 m -62.58 -44.41 96.38 Favored 'General case' 0 C--O 1.238 0.489 0 CA-C-O 120.85 0.357 . . . . 0.0 110.792 179.163 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 11.8 pt20 -67.96 -32.97 73.77 Favored 'General case' 0 N--CA 1.447 -0.585 0 C-N-CA 120.668 -0.413 . . . . 0.0 110.527 -179.828 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.401 ' HG2' ' O ' ' A' ' 50' ' ' SER . 15.9 mmt180 -57.78 -45.07 86.49 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-O 121.292 0.568 . . . . 0.0 111.115 177.433 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 32.8 mt-30 -71.36 -20.62 62.14 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.629 179.441 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 79.98 30.51 42.52 Favored Glycine 0 N--CA 1.441 -1.03 0 C-N-CA 120.861 -0.685 . . . . 0.0 111.558 -179.774 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 25.9 m -129.21 152.79 80.01 Favored Pre-proline 0 C--N 1.323 -0.555 0 O-C-N 122.502 -0.411 . . . . 0.0 110.723 -178.592 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' PRO . . . . . 0.431 ' HG2' ' OG ' ' A' ' 61' ' ' SER . 43.2 Cg_endo -71.45 150.61 58.27 Favored 'Trans proline' 0 N--CA 1.455 -0.772 0 C-N-CA 122.347 2.031 . . . . 0.0 111.903 177.538 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.547 ' HG2' ' SG ' ' A' ' 52' ' ' CYS . 79.8 mtp -70.37 -9.93 57.63 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.451 -177.443 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 33.6 p30 -84.52 -16.4 42.46 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.241 0.543 . . . . 0.0 111.365 -179.244 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.431 ' OG ' ' HG2' ' A' ' 58' ' ' PRO . 69.2 m -89.72 -20.63 23.36 Favored 'General case' 0 C--N 1.311 -1.101 0 N-CA-C 112.877 0.695 . . . . 0.0 112.877 -175.367 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.475 HD11 ' SG ' ' A' ' 52' ' ' CYS . 1.4 pp -124.09 170.95 10.17 Favored 'General case' 0 C--N 1.306 -1.309 0 N-CA-C 112.945 0.72 . . . . 0.0 112.945 -177.446 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.479 ' O ' ' HA ' ' A' ' 90' ' ' VAL . 47.2 mtm180 -121.66 120.76 35.67 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.674 -0.693 . . . . 0.0 110.844 -177.099 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -102.64 115.33 30.36 Favored 'General case' 0 C--N 1.311 -1.105 0 CA-C-O 121.084 0.469 . . . . 0.0 111.024 179.166 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.462 ' C ' HD22 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -144.38 164.15 31.67 Favored 'General case' 0 N--CA 1.445 -0.688 0 CA-C-O 121.469 0.652 . . . . 0.0 111.238 -179.769 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 83.2 t80 -143.62 134.15 24.88 Favored 'General case' 0 C--N 1.309 -1.192 0 N-CA-C 109.565 -0.532 . . . . 0.0 109.565 179.192 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.417 ' HG2' HE21 ' A' ' 69' ' ' GLN . 6.9 pt-20 49.91 26.86 2.13 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 124.214 1.006 . . . . 0.0 112.75 -179.99 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 87.45 20.89 50.44 Favored Glycine 0 N--CA 1.447 -0.613 0 C-N-CA 120.949 -0.643 . . . . 0.0 113.211 -179.596 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' GLN . . . . . 0.417 HE21 ' HG2' ' A' ' 67' ' ' GLU . 2.9 pt20 -128.55 134.34 48.62 Favored 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 108.766 -0.827 . . . . 0.0 108.766 179.181 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.443 ' HE ' ' HB2' ' A' ' 70' ' ' ARG . 0.0 OUTLIER -72.44 144.95 47.94 Favored 'General case' 0 C--N 1.309 -1.157 0 O-C-N 121.66 -0.65 . . . . 0.0 110.706 179.349 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.417 HG21 HD12 ' A' ' 44' ' ' LEU . 22.3 mm -91.44 121.61 42.06 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.243 0 CA-C-O 121.321 0.582 . . . . 0.0 110.791 -178.276 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.423 ' O ' ' HB2' ' A' ' 75' ' ' HIS . . . -94.47 162.2 13.91 Favored 'General case' 0 N--CA 1.435 -1.18 0 N-CA-C 109.384 -0.598 . . . . 0.0 109.384 179.185 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 46.4 m-20 -69.42 -26.28 64.54 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-O 121.435 0.636 . . . . 0.0 110.558 -178.986 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 5.5 m-80 -93.19 4.72 53.52 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-O 121.311 0.577 . . . . 0.0 109.655 -178.763 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' HIS . . . . . 0.598 ' O ' ' HB2' ' A' ' 44' ' ' LEU . 8.4 m170 -83.13 146.22 28.78 Favored 'General case' 0 CA--C 1.496 -1.099 0 CA-C-N 116.222 -0.444 . . . . 0.0 109.906 -179.349 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 57.3 p -120.86 154.42 57.58 Favored Pre-proline 0 C--N 1.304 -1.412 0 C-N-CA 120.815 -0.354 . . . . 0.0 111.209 178.894 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -58.93 -39.72 78.38 Favored 'Trans proline' 0 C--N 1.348 0.508 0 C-N-CA 122.673 2.249 . . . . 0.0 111.758 179.334 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' LYS . . . . . 0.493 ' HG3' ' N ' ' A' ' 79' ' ' GLU . 29.0 pttt -68.92 -36.37 77.92 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.208 0.528 . . . . 0.0 110.792 -178.301 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 79' ' ' GLU . . . . . 0.493 ' N ' ' HG3' ' A' ' 78' ' ' LYS . 33.5 mm-40 -72.38 -41.16 66.64 Favored 'General case' 0 N--CA 1.444 -0.74 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.903 -179.124 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 5.5 mt -78.35 -3.51 43.43 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.084 0.468 . . . . 0.0 111.402 -179.011 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 78.14 45.0 10.63 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 121.001 -0.619 . . . . 0.0 112.858 177.153 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 61.0 mtt -105.05 164.98 11.4 Favored 'General case' 0 C--N 1.313 -1.019 0 N-CA-C 110.008 -0.367 . . . . 0.0 110.008 179.162 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -145.21 -169.64 3.25 Favored 'General case' 0 C--N 1.314 -0.97 0 N-CA-C 109.915 -0.402 . . . . 0.0 109.915 177.54 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.408 ' HA ' ' HB ' ' A' ' 22' ' ' ILE . 13.9 pt-20 -70.54 139.67 51.6 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 121.117 0.484 . . . . 0.0 110.98 -179.63 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 75.43 2.46 3.84 Favored 'General case' 0 C--O 1.239 0.531 0 C-N-CA 124.487 1.115 . . . . 0.0 111.266 179.969 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 7.9 t0 -62.34 157.54 19.57 Favored 'General case' 0 C--O 1.239 0.51 0 CA-C-O 121.37 0.605 . . . . 0.0 110.639 177.9 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 7.7 p -125.45 142.94 40.7 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.231 0 CA-C-O 121.457 0.646 . . . . 0.0 111.533 -176.485 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 3.6 mp -113.15 152.05 14.93 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.924 0 N-CA-C 108.809 -0.811 . . . . 0.0 108.809 178.704 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 89' ' ' GLU . . . . . 0.4 ' O ' HD13 ' A' ' 65' ' ' LEU . 13.8 tp10 -106.61 139.3 41.28 Favored 'General case' 0 C--N 1.314 -0.962 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 -176.4 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 90' ' ' VAL . . . . . 0.592 ' HB ' ' HA2' ' A' ' 28' ' ' GLY . 88.0 t -130.61 136.08 59.07 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.084 0 CA-C-O 121.358 0.599 . . . . 0.0 110.747 178.694 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 88.2 m-85 -120.39 -178.9 3.8 Favored 'General case' 0 C--N 1.311 -1.099 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 178.813 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 7.5 tp60 -105.76 148.96 26.89 Favored 'General case' 0 C--N 1.307 -1.247 0 N-CA-C 109.512 -0.551 . . . . 0.0 109.512 178.559 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 . . . . . 0 N--CA 1.469 0.52 0 CA-C-O 121.053 0.454 . . . . 0.0 111.076 175.975 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 22' ' ' ILE . . . . . 0.455 ' HB ' ' HA ' ' A' ' 84' ' ' GLU . 18.6 pt . . . . . 0 N--CA 1.436 -1.145 0 CA-C-O 121.305 0.574 . . . . 0.0 109.775 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 9.1 mtmt -118.27 140.57 49.61 Favored 'General case' 0 C--N 1.298 -1.667 0 N-CA-C 109.152 -0.684 . . . . 0.0 109.152 -178.387 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.5 mp -137.04 162.28 33.75 Favored 'General case' 0 C--N 1.305 -1.36 0 CA-C-O 121.354 0.597 . . . . 0.0 110.827 176.375 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.47 ' HG3' ' CD2' ' A' ' 35' ' ' HIS . 3.7 tmmt? -134.68 143.73 47.39 Favored 'General case' 0 C--N 1.308 -1.235 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.396 179.974 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.608 HG11 ' CD1' ' A' ' 51' ' ' TYR . 0.9 OUTLIER -114.29 141.13 31.71 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.538 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.3 178.576 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 32.0 mm -111.43 99.22 8.24 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.025 0 N-CA-C 108.403 -0.962 . . . . 0.0 108.403 175.414 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' GLY . . . . . 0.56 ' HA2' ' HB ' ' A' ' 90' ' ' VAL . . . -66.0 164.24 40.11 Favored Glycine 0 N--CA 1.424 -2.162 0 C-N-CA 120.63 -0.795 . . . . 0.0 113.625 179.124 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.41 ' HG3' ' H ' ' A' ' 29' ' ' GLN . 0.0 OUTLIER -62.06 -23.72 66.65 Favored 'General case' 0 C--N 1.308 -1.207 0 C-N-CA 123.785 0.834 . . . . 0.0 110.528 177.902 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -91.78 11.55 24.31 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.279 -0.873 . . . . 0.0 109.518 179.197 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 48.0 m 70.17 14.98 7.63 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-O 121.785 0.802 . . . . 0.0 110.319 -179.254 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 8.4 t -73.34 103.86 4.16 Favored 'General case' 0 N--CA 1.443 -0.801 0 CA-C-N 115.082 -0.963 . . . . 0.0 110.469 179.397 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.46 ' HA ' ' O ' ' A' ' 26' ' ' VAL . 1.3 mp0 -85.11 107.47 17.21 Favored 'General case' 0 CA--C 1.511 -0.543 0 CA-C-O 121.246 0.546 . . . . 0.0 109.981 178.834 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.423 HG21 ' HA ' ' A' ' 51' ' ' TYR . 29.8 mm -100.42 138.75 23.71 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.283 0 N-CA-C 109.72 -0.474 . . . . 0.0 109.72 -179.194 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' HIS . . . . . 0.47 ' CD2' ' HG3' ' A' ' 25' ' ' LYS . 11.6 m170 -118.38 131.38 56.3 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 -179.305 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.508 ' HZ ' HG23 ' A' ' 26' ' ' VAL . 1.1 p90 -146.91 151.08 36.46 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-O 121.207 0.527 . . . . 0.0 111.305 -177.38 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 41.9 mmtm -108.78 119.61 40.05 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 -179.558 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 35.6 m -137.37 161.04 35.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-O 121.397 0.618 . . . . 0.0 111.331 -179.167 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.481 ' O ' HG22 ' A' ' 42' ' ' THR . 10.5 mmmt -83.28 161.12 21.56 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.78 178.896 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -74.71 -36.27 62.71 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-O 121.001 0.429 . . . . 0.0 111.319 179.833 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 8.5 t -94.19 10.76 32.65 Favored 'General case' 0 N--CA 1.443 -0.803 0 CA-C-O 121.405 0.621 . . . . 0.0 111.766 -177.085 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' THR . . . . . 0.481 HG22 ' O ' ' A' ' 39' ' ' LYS . 2.0 t -92.48 169.09 10.82 Favored 'General case' 0 C--N 1.323 -0.55 0 O-C-N 121.688 -0.633 . . . . 0.0 109.862 -178.857 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 27.9 m170 -82.77 141.89 32.0 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-O 121.483 0.659 . . . . 0.0 111.821 -179.795 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.645 ' O ' ' HG3' ' A' ' 48' ' ' LYS . 0.2 OUTLIER -70.48 -18.14 62.97 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 115.421 -0.808 . . . . 0.0 109.922 -179.662 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.669 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -52.32 -45.31 65.55 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.068 -0.514 . . . . 0.0 112.117 -178.467 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.42 ' N ' ' HD3' ' A' ' 45' ' ' LYS . 16.3 ptmt -65.63 -29.59 70.18 Favored 'General case' 0 C--O 1.218 -0.581 0 CA-C-O 121.42 0.629 . . . . 0.0 110.47 -178.066 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.599 ' HB3' HD13 ' A' ' 44' ' ' LEU . 7.9 tt -73.86 -45.7 49.42 Favored 'General case' 0 C--N 1.309 -1.188 0 CA-C-N 115.481 -0.781 . . . . 0.0 109.716 179.939 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.645 ' HG3' ' O ' ' A' ' 44' ' ' LEU . 26.9 mtpt -58.7 -50.17 74.86 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-O 121.38 0.609 . . . . 0.0 110.156 -179.15 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.669 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 8.3 pt-20 -68.33 -33.76 74.89 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.865 -178.294 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 31.3 t -65.46 -46.74 78.65 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-O 121.201 0.524 . . . . 0.0 111.341 -178.674 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.608 ' CD1' HG11 ' A' ' 26' ' ' VAL . 1.6 p90 -76.43 -33.14 58.79 Favored 'General case' 0 N--CA 1.441 -0.878 0 C-N-CA 120.061 -0.656 . . . . 0.0 110.541 -176.836 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 52' ' ' CYS . . . . . 0.502 ' SG ' HD11 ' A' ' 62' ' ' LEU . 88.1 m -62.36 -45.36 93.53 Favored 'General case' 0 CA--C 1.509 -0.609 0 CA-C-O 121.098 0.475 . . . . 0.0 110.674 -179.97 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 13.5 pt20 -69.49 -32.36 71.19 Favored 'General case' 0 N--CA 1.441 -0.908 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.545 -179.269 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 30.8 mmt180 -57.2 -40.48 77.52 Favored 'General case' 0 C--N 1.342 0.278 0 CA-C-O 121.25 0.548 . . . . 0.0 110.834 176.937 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 30.9 mt-30 -78.25 -21.04 50.5 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.874 179.616 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 80.73 34.03 28.94 Favored Glycine 0 N--CA 1.443 -0.883 0 C-N-CA 120.946 -0.645 . . . . 0.0 112.163 179.705 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 34.7 m -134.25 150.44 74.07 Favored Pre-proline 0 C--N 1.325 -0.469 0 O-C-N 122.567 -0.373 . . . . 0.0 110.553 -179.918 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' PRO . . . . . 0.49 ' HG2' ' OG ' ' A' ' 61' ' ' SER . 37.1 Cg_endo -66.8 150.18 83.37 Favored 'Trans proline' 0 C--O 1.239 0.56 0 C-N-CA 122.496 2.131 . . . . 0.0 112.354 179.243 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.469 ' HG2' ' SG ' ' A' ' 52' ' ' CYS . 78.2 mtp -70.39 -14.32 62.51 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.396 -177.163 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 2.0 p-10 -88.73 -9.16 52.91 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-O 121.031 0.443 . . . . 0.0 111.899 -178.547 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.49 ' OG ' ' HG2' ' A' ' 58' ' ' PRO . 73.1 m -94.2 -16.51 23.61 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 112.195 0.442 . . . . 0.0 112.195 179.67 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.502 HD11 ' SG ' ' A' ' 52' ' ' CYS . 1.3 pp -125.44 162.49 24.72 Favored 'General case' 0 C--N 1.315 -0.896 0 N-CA-C 113.056 0.762 . . . . 0.0 113.056 -178.796 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.555 ' HB2' ' HB2' ' A' ' 91' ' ' TYR . 3.2 mmp_? -109.19 118.4 36.64 Favored 'General case' 0 C--N 1.311 -1.07 0 CA-C-N 115.078 -0.965 . . . . 0.0 110.801 -177.876 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.432 ' HB3' ' OH ' ' A' ' 51' ' ' TYR . 0.2 OUTLIER -102.54 113.05 26.08 Favored 'General case' 0 C--N 1.304 -1.372 0 CA-C-O 121.102 0.477 . . . . 0.0 110.388 176.044 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.454 ' C ' HD22 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -142.67 163.6 32.38 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-O 121.555 0.693 . . . . 0.0 111.231 -179.226 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 89.7 t80 -143.41 134.48 25.64 Favored 'General case' 0 C--N 1.309 -1.173 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 179.323 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 49.25 27.59 1.92 Allowed 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 124.04 0.936 . . . . 0.0 112.421 -179.51 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 85.64 22.28 50.88 Favored Glycine 0 CA--C 1.521 0.461 0 C-N-CA 121.069 -0.586 . . . . 0.0 113.167 -179.676 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 5.3 pt20 -129.81 135.67 48.69 Favored 'General case' 0 C--N 1.323 -0.556 0 O-C-N 122.235 -0.567 . . . . 0.0 109.697 179.887 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -64.8 148.31 51.51 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-O 121.55 0.691 . . . . 0.0 110.988 177.764 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.459 HG21 HD12 ' A' ' 44' ' ' LEU . 22.6 mm -100.0 117.3 44.98 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.407 0 CA-C-O 121.101 0.476 . . . . 0.0 109.954 178.435 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.432 ' O ' ' HB2' ' A' ' 75' ' ' HIS . . . -93.79 163.77 13.39 Favored 'General case' 0 N--CA 1.436 -1.137 0 N-CA-C 109.755 -0.461 . . . . 0.0 109.755 -179.898 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 26.4 m-20 -69.82 -24.52 63.48 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-O 121.354 0.597 . . . . 0.0 111.064 -178.141 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 7.1 m-80 -95.38 5.56 51.31 Favored 'General case' 0 C--N 1.313 -1.001 0 CA-C-O 121.414 0.626 . . . . 0.0 109.42 -179.802 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' HIS . . . . . 0.56 ' O ' ' HB2' ' A' ' 44' ' ' LEU . 2.3 m170 -84.08 147.28 27.46 Favored 'General case' 0 CA--C 1.503 -0.853 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 -179.874 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.466 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 68.7 p -123.07 155.15 64.7 Favored Pre-proline 0 C--N 1.306 -1.316 0 CA-C-O 120.548 0.213 . . . . 0.0 110.949 179.255 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_exo -59.96 -38.62 77.43 Favored 'Trans proline' 0 N--CA 1.458 -0.581 0 C-N-CA 122.435 2.09 . . . . 0.0 111.277 178.724 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' LYS . . . . . 0.519 ' HG3' ' N ' ' A' ' 79' ' ' GLU . 33.7 pttt -67.09 -40.1 86.89 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.232 -178.663 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 79' ' ' GLU . . . . . 0.519 ' N ' ' HG3' ' A' ' 78' ' ' LYS . 65.7 mm-40 -72.88 -36.85 67.43 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-O 121.178 0.513 . . . . 0.0 110.937 -178.763 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.466 ' HG ' ' O ' ' A' ' 76' ' ' THR . 5.4 mt -79.64 -3.02 45.31 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.198 0.523 . . . . 0.0 110.895 -179.651 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 75.51 42.16 27.97 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 121.145 -0.55 . . . . 0.0 112.9 177.635 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 64.0 mtt -99.78 162.75 12.81 Favored 'General case' 0 C--N 1.312 -1.054 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 179.111 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 83' ' ' GLU . . . . . 0.525 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 11.3 pt-20 -142.42 -170.42 3.18 Favored 'General case' 0 C--N 1.31 -1.115 0 N-CA-C 109.975 -0.38 . . . . 0.0 109.975 177.641 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.455 ' HA ' ' HB ' ' A' ' 22' ' ' ILE . 11.3 pt-20 -70.65 143.84 51.29 Favored 'General case' 0 N--CA 1.441 -0.886 0 C-N-CA 120.121 -0.631 . . . . 0.0 110.644 -179.132 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 74.51 3.0 4.22 Favored 'General case' 0 C--N 1.322 -0.587 0 C-N-CA 124.078 0.951 . . . . 0.0 111.192 178.818 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 86' ' ' ASP . . . . . 0.525 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 1.8 t0 -63.11 158.48 19.64 Favored 'General case' 0 CA--C 1.513 -0.463 0 CA-C-O 121.325 0.584 . . . . 0.0 110.727 178.452 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 9.3 p -127.66 144.25 38.1 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.539 0 CA-C-O 121.351 0.595 . . . . 0.0 111.077 -177.496 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 88' ' ' ILE . . . . . 0.444 ' HB ' HG22 ' A' ' 26' ' ' VAL . 3.6 mp -112.24 149.91 14.66 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.066 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 178.129 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 89' ' ' GLU . . . . . 0.419 ' O ' HD13 ' A' ' 65' ' ' LEU . 8.9 tp10 -104.72 137.52 42.41 Favored 'General case' 0 C--N 1.312 -1.041 0 N-CA-C 109.611 -0.514 . . . . 0.0 109.611 -176.001 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 90' ' ' VAL . . . . . 0.56 ' HB ' ' HA2' ' A' ' 28' ' ' GLY . 65.3 t -126.12 131.9 71.13 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.895 0 CA-C-O 121.186 0.517 . . . . 0.0 111.08 178.81 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 91' ' ' TYR . . . . . 0.555 ' HB2' ' HB2' ' A' ' 63' ' ' ARG . 67.3 m-85 -114.18 176.15 5.16 Favored 'General case' 0 C--N 1.315 -0.909 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 179.644 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 10.4 tp60 -109.19 130.49 55.49 Favored 'General case' 0 C--N 1.304 -1.392 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 179.513 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 . . . . . 0 C--N 1.32 -0.709 0 CA-C-O 121.207 0.527 . . . . 0.0 110.45 178.038 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 22' ' ' ILE . . . . . 0.426 ' HB ' ' HA ' ' A' ' 84' ' ' GLU . 23.4 pt . . . . . 0 N--CA 1.447 -0.619 0 CA-C-O 121.212 0.529 . . . . 0.0 110.13 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.5 ' HD3' ' N ' ' A' ' 23' ' ' LYS . 0.0 OUTLIER -121.14 143.07 49.3 Favored 'General case' 0 C--N 1.305 -1.35 0 N-CA-C 108.815 -0.809 . . . . 0.0 108.815 -178.751 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.5 mp -136.28 159.34 42.06 Favored 'General case' 0 C--N 1.3 -1.559 0 CA-C-O 121.194 0.521 . . . . 0.0 110.982 176.662 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.42 ' O ' ' HA ' ' A' ' 87' ' ' VAL . 5.3 tmmm? -126.82 142.45 51.54 Favored 'General case' 0 N--CA 1.439 -0.999 0 CA-C-O 121.513 0.673 . . . . 0.0 110.458 -179.404 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.501 HG11 ' CD1' ' A' ' 51' ' ' TYR . 0.9 OUTLIER -117.57 142.23 32.72 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.458 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.975 -179.581 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.506 ' O ' ' HB ' ' A' ' 90' ' ' VAL . 48.5 mm -103.68 118.63 51.07 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.289 0 N-CA-C 107.164 -1.421 . . . . 0.0 107.164 174.318 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' GLY . . . . . 0.444 ' HA2' ' HB ' ' A' ' 90' ' ' VAL . . . -90.71 162.94 29.37 Favored Glycine 0 N--CA 1.419 -2.462 0 C-N-CA 120.049 -1.072 . . . . 0.0 111.717 -176.021 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.87 -25.32 64.97 Favored 'General case' 0 C--N 1.309 -1.153 0 CA-C-O 121.653 0.74 . . . . 0.0 110.72 176.356 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -82.0 1.44 35.57 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.199 177.451 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 9.7 m 73.52 13.18 4.53 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 122.216 1.008 . . . . 0.0 109.017 -175.413 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 2.9 t -76.91 116.46 17.59 Favored 'General case' 0 N--CA 1.44 -0.93 0 CA-C-N 114.46 -1.246 . . . . 0.0 110.475 -178.978 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.407 ' HG2' ' CD1' ' A' ' 27' ' ' ILE . 45.1 mt-10 -89.49 110.78 21.58 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.286 0.565 . . . . 0.0 109.857 177.638 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.416 HG21 ' HA ' ' A' ' 51' ' ' TYR . 39.1 mm -99.8 137.76 26.28 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.44 0 N-CA-C 109.724 -0.472 . . . . 0.0 109.724 -178.928 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 12.5 m170 -117.91 132.41 56.41 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 108.648 -0.871 . . . . 0.0 108.648 179.514 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.472 ' HZ ' HG23 ' A' ' 26' ' ' VAL . 1.3 p90 -145.39 168.0 21.56 Favored 'General case' 0 C--N 1.31 -1.11 0 CA-C-O 121.025 0.441 . . . . 0.0 111.026 -178.485 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 88.9 mttt -126.93 115.86 19.92 Favored 'General case' 0 N--CA 1.445 -0.677 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.542 -177.013 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 33.1 m -134.54 162.52 38.74 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 CA-C-O 120.964 0.411 . . . . 0.0 110.153 179.517 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.547 ' O ' HG22 ' A' ' 42' ' ' THR . 81.6 tttt -89.01 165.78 14.33 Favored 'General case' 0 C--N 1.31 -1.128 0 O-C-N 122.011 -0.431 . . . . 0.0 110.859 -179.155 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -73.45 -36.79 65.94 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 112.675 0.62 . . . . 0.0 112.675 -177.156 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 10.1 t -93.34 13.64 20.84 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 120.926 0.393 . . . . 0.0 111.814 -177.695 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' THR . . . . . 0.547 HG22 ' O ' ' A' ' 39' ' ' LYS . 3.4 t -95.37 173.14 7.67 Favored 'General case' 0 C--N 1.321 -0.664 0 C-N-CA 120.11 -0.636 . . . . 0.0 110.366 -179.248 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 11.7 m-70 -92.39 141.65 28.3 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-O 121.432 0.634 . . . . 0.0 111.699 -178.854 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.476 ' HB2' ' O ' ' A' ' 75' ' ' HIS . 0.8 OUTLIER -63.87 -18.27 64.01 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.437 -0.801 . . . . 0.0 111.279 179.31 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.461 ' HA ' ' HD3' ' A' ' 48' ' ' LYS . 0.0 OUTLIER -51.07 -40.43 58.32 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.801 -179.751 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.612 ' O ' ' HG3' ' A' ' 49' ' ' GLU . 19.2 mtpp -66.88 -46.0 76.3 Favored 'General case' 0 CA--C 1.488 -1.417 0 CA-C-O 121.95 0.881 . . . . 0.0 109.286 178.253 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.431 ' HB3' HD13 ' A' ' 44' ' ' LEU . 9.0 tt -60.14 -49.68 76.68 Favored 'General case' 0 C--N 1.291 -1.948 0 CA-C-N 114.616 -1.175 . . . . 0.0 110.11 -176.044 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.526 ' HA ' ' CE2' ' A' ' 51' ' ' TYR . 29.9 mtpt -59.26 -46.51 88.32 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.745 -0.661 . . . . 0.0 111.018 179.46 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.612 ' HG3' ' O ' ' A' ' 46' ' ' LYS . 1.4 pp20? -71.92 -30.68 65.59 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 121.336 0.589 . . . . 0.0 110.406 -178.346 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 50' ' ' SER . . . . . 0.406 ' O ' ' HG2' ' A' ' 53' ' ' GLN . 17.8 m -70.42 -42.64 71.35 Favored 'General case' 0 N--CA 1.44 -0.954 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.943 -179.338 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.526 ' CE2' ' HA ' ' A' ' 48' ' ' LYS . 3.0 p90 -76.3 -32.87 58.98 Favored 'General case' 0 C--N 1.321 -0.649 0 C-N-CA 119.3 -0.96 . . . . 0.0 110.102 179.182 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 52' ' ' CYS . . . . . 0.574 ' SG ' HD11 ' A' ' 62' ' ' LEU . 47.4 m -60.82 -44.08 97.39 Favored 'General case' 0 CA--C 1.512 -0.483 0 CA-C-O 120.975 0.417 . . . . 0.0 110.691 177.749 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' GLN . . . . . 0.406 ' HG2' ' O ' ' A' ' 50' ' ' SER . 12.3 pt20 -66.76 -35.06 79.21 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.58 179.463 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 2.5 mmm180 -59.02 -30.12 67.77 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-O 121.006 0.432 . . . . 0.0 111.246 177.024 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 34.4 mt-30 -90.4 -21.74 21.8 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 120.953 0.406 . . . . 0.0 110.844 179.602 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 78.85 34.03 35.5 Favored Glycine 0 N--CA 1.444 -0.772 0 C-N-CA 120.492 -0.861 . . . . 0.0 111.897 179.722 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 33.4 m -134.02 150.18 73.64 Favored Pre-proline 0 C--N 1.327 -0.401 0 O-C-N 122.543 -0.386 . . . . 0.0 110.417 -179.213 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' PRO . . . . . 0.513 ' HG2' ' OG ' ' A' ' 61' ' ' SER . 28.6 Cg_endo -64.12 150.9 87.39 Favored 'Trans proline' 0 N--CA 1.46 -0.498 0 C-N-CA 122.681 2.254 . . . . 0.0 112.269 179.199 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.436 ' HG2' ' SG ' ' A' ' 52' ' ' CYS . 74.4 mtp -73.07 -10.32 59.67 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.12 -178.142 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 60' ' ' ASN . . . . . 0.421 ' OD1' ' HB2' ' A' ' 58' ' ' PRO . 2.2 p-10 -91.87 -9.68 42.43 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.232 -179.457 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.513 ' OG ' ' HG2' ' A' ' 58' ' ' PRO . 68.4 m -93.87 -12.89 27.94 Favored 'General case' 0 C--N 1.317 -0.807 0 N-CA-C 113.127 0.788 . . . . 0.0 113.127 -179.406 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.574 HD11 ' SG ' ' A' ' 52' ' ' CYS . 1.3 pp -128.26 165.56 20.28 Favored 'General case' 0 C--N 1.308 -1.213 0 O-C-N 121.638 -0.664 . . . . 0.0 112.726 -179.349 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.586 ' HB2' ' HB2' ' A' ' 91' ' ' TYR . 3.7 mmp_? -111.95 118.12 34.61 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.814 -177.361 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -103.06 113.75 27.48 Favored 'General case' 0 C--N 1.302 -1.461 0 CA-C-O 120.94 0.4 . . . . 0.0 110.559 176.026 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.461 ' C ' HD22 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -142.25 161.21 38.61 Favored 'General case' 0 N--CA 1.445 -0.685 0 CA-C-O 121.605 0.716 . . . . 0.0 111.438 -179.455 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 93.7 t80 -144.63 136.73 26.1 Favored 'General case' 0 C--N 1.311 -1.093 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 179.061 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.465 ' HG2' HE21 ' A' ' 69' ' ' GLN . 7.7 pt-20 48.88 27.06 1.48 Allowed 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 124.358 1.063 . . . . 0.0 112.631 -179.368 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 84.62 25.43 42.42 Favored Glycine 0 N--CA 1.447 -0.593 0 C-N-CA 120.806 -0.712 . . . . 0.0 113.025 -179.112 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' GLN . . . . . 0.465 HE21 ' HG2' ' A' ' 67' ' ' GLU . 3.4 pt20 -131.95 137.66 48.02 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 178.896 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -74.31 145.36 44.0 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-O 121.324 0.583 . . . . 0.0 109.747 178.492 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.403 HG21 HD12 ' A' ' 44' ' ' LEU . 23.6 mm -90.36 119.93 38.33 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.606 0 CA-C-O 121.15 0.5 . . . . 0.0 110.622 -178.508 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -90.64 163.46 14.53 Favored 'General case' 0 N--CA 1.437 -1.075 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 179.636 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' ASP . . . . . 0.446 ' HB3' ' HB3' ' A' ' 45' ' ' LYS . 59.6 m-20 -71.17 -21.38 62.17 Favored 'General case' 0 C--N 1.313 -1.007 0 CA-C-O 121.627 0.727 . . . . 0.0 110.362 -179.818 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 9.0 m-80 -97.73 6.83 47.4 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.735 -0.666 . . . . 0.0 109.504 179.528 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' HIS . . . . . 0.476 ' O ' ' HB2' ' A' ' 44' ' ' LEU . 3.4 m170 -82.81 140.74 32.78 Favored 'General case' 0 CA--C 1.508 -0.664 0 N-CA-C 109.538 -0.542 . . . . 0.0 109.538 178.858 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.425 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 67.0 p -117.73 154.77 51.08 Favored Pre-proline 0 C--N 1.309 -1.154 0 CA-C-O 120.45 0.166 . . . . 0.0 110.703 179.601 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -59.57 -39.79 71.74 Favored 'Trans proline' 0 N--CA 1.458 -0.576 0 C-N-CA 122.439 2.093 . . . . 0.0 111.43 179.129 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 78' ' ' LYS . . . . . 0.489 ' HG3' ' N ' ' A' ' 79' ' ' GLU . 28.2 pttt -67.77 -38.92 84.06 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.225 -178.013 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 79' ' ' GLU . . . . . 0.489 ' N ' ' HG3' ' A' ' 78' ' ' LYS . 9.4 mm-40 -73.32 -36.26 66.18 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.929 0.395 . . . . 0.0 110.953 -178.291 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.447 HD21 ' CG ' ' A' ' 75' ' ' HIS . 5.8 mt -82.3 2.72 30.72 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.212 0.529 . . . . 0.0 110.996 -179.704 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 72.62 39.6 55.58 Favored Glycine 0 N--CA 1.453 -0.188 0 C-N-CA 120.962 -0.637 . . . . 0.0 112.618 177.745 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 65.0 mtt -98.55 162.5 13.11 Favored 'General case' 0 C--N 1.312 -1.046 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 179.514 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -143.59 -170.74 3.37 Favored 'General case' 0 C--N 1.306 -1.293 0 CA-C-O 120.803 0.335 . . . . 0.0 110.201 -179.563 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.426 ' HA ' ' HB ' ' A' ' 22' ' ' ILE . 5.6 pt-20 -70.84 136.01 48.44 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 120.994 0.426 . . . . 0.0 110.829 179.875 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 16.1 mm-40 74.25 5.58 4.64 Favored 'General case' 0 C--O 1.238 0.485 0 C-N-CA 124.008 0.923 . . . . 0.0 111.813 178.356 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 6.2 t0 -60.54 160.37 9.09 Favored 'General case' 0 C--O 1.238 0.453 0 CA-C-O 121.271 0.558 . . . . 0.0 110.874 176.109 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 87' ' ' VAL . . . . . 0.42 ' HA ' ' O ' ' A' ' 25' ' ' LYS . 7.5 p -126.54 143.62 39.42 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.002 0 CA-C-O 121.255 0.55 . . . . 0.0 111.443 -177.238 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 88' ' ' ILE . . . . . 0.419 ' HB ' HG22 ' A' ' 26' ' ' VAL . 3.7 mp -116.1 153.72 17.68 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 179.063 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -106.11 138.76 41.73 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.923 0.392 . . . . 0.0 110.37 -176.737 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 90' ' ' VAL . . . . . 0.561 ' HA ' ' O ' ' A' ' 63' ' ' ARG . 89.4 t -128.33 134.38 64.96 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-O 121.389 0.614 . . . . 0.0 111.475 178.987 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 91' ' ' TYR . . . . . 0.586 ' HB2' ' HB2' ' A' ' 63' ' ' ARG . 70.4 m-85 -116.31 176.24 5.19 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.85 -0.614 . . . . 0.0 109.693 178.536 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 9.3 tp60 -108.41 129.58 55.25 Favored 'General case' 0 C--N 1.31 -1.109 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 178.429 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 . . . . . 0 C--N 1.323 -0.576 0 CA-C-O 121.079 0.466 . . . . 0.0 110.629 178.177 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 22' ' ' ILE . . . . . 0.436 ' HB ' ' HA ' ' A' ' 84' ' ' GLU . 27.9 pt . . . . . 0 N--CA 1.442 -0.859 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 6.8 mtmt -112.37 145.9 39.28 Favored 'General case' 0 C--N 1.289 -2.055 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 -178.914 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.6 mp -140.84 160.29 40.37 Favored 'General case' 0 C--N 1.302 -1.459 0 CA-C-O 121.21 0.529 . . . . 0.0 110.797 173.799 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.407 ' O ' ' HA ' ' A' ' 87' ' ' VAL . 5.1 tmmm? -132.74 142.69 49.16 Favored 'General case' 0 C--N 1.312 -1.039 0 CA-C-O 121.391 0.615 . . . . 0.0 110.721 -179.088 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.556 HG23 ' HZ ' ' A' ' 36' ' ' PHE . 0.9 OUTLIER -117.27 141.18 36.94 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.439 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.608 -179.991 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.462 ' O ' ' HB ' ' A' ' 90' ' ' VAL . 43.7 mm -104.24 114.77 44.72 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.037 0 N-CA-C 107.409 -1.33 . . . . 0.0 107.409 174.378 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' GLY . . . . . 0.473 ' HA2' ' HB ' ' A' ' 90' ' ' VAL . . . -87.01 162.84 34.21 Favored Glycine 0 N--CA 1.423 -2.207 0 C-N-CA 119.856 -1.164 . . . . 0.0 111.241 -177.337 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.68 -30.07 30.02 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-O 121.116 0.484 . . . . 0.0 112.258 177.175 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -93.55 13.62 21.34 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-O 121.272 0.558 . . . . 0.0 110.193 -179.301 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 23.6 m 74.65 21.01 2.28 Favored 'General case' 0 CA--C 1.504 -0.811 0 CA-C-O 122.623 1.201 . . . . 0.0 108.396 -178.91 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' SER . . . . . 0.443 ' HB2' HE21 ' A' ' 55' ' ' GLN . 2.5 m -68.78 94.57 0.61 Allowed 'General case' 0 N--CA 1.425 -1.721 0 CA-C-N 113.295 -1.775 . . . . 0.0 111.763 -179.164 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.494 ' HA ' ' O ' ' A' ' 26' ' ' VAL . 37.9 mt-10 -82.33 104.08 12.38 Favored 'General case' 0 CA--C 1.506 -0.746 0 C-N-CA 120.369 -0.532 . . . . 0.0 110.265 176.968 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.478 HG21 ' HA ' ' A' ' 51' ' ' TYR . 36.8 mm -100.18 133.73 42.21 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.767 0 N-CA-C 108.963 -0.755 . . . . 0.0 108.963 178.419 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 12.5 m170 -113.34 128.81 56.58 Favored 'General case' 0 C--N 1.316 -0.854 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 -179.43 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.556 ' HZ ' HG23 ' A' ' 26' ' ' VAL . 1.1 p90 -140.91 149.08 41.43 Favored 'General case' 0 C--N 1.306 -1.301 0 CA-C-O 121.488 0.661 . . . . 0.0 111.311 -177.937 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 96.3 mttt -113.97 105.65 13.49 Favored 'General case' 0 C--N 1.31 -1.117 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.859 -178.691 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.496 ' HB ' HG21 ' A' ' 42' ' ' THR . 14.6 m -129.88 162.58 37.29 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.277 -177.592 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 46.3 mtpt -79.46 178.32 8.2 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-O 121.731 0.777 . . . . 0.0 112.093 -178.779 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -87.59 -31.03 20.06 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.538 -0.756 . . . . 0.0 109.91 178.3 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 10.2 t -92.87 13.0 21.76 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 115.617 -0.719 . . . . 0.0 111.465 -177.631 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' THR . . . . . 0.496 HG21 ' HB ' ' A' ' 38' ' ' VAL . 6.4 t -94.56 162.83 13.64 Favored 'General case' 0 C--N 1.318 -0.795 0 O-C-N 122.029 -0.419 . . . . 0.0 109.974 -178.371 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' HIS . . . . . 0.516 ' O ' ' HG3' ' A' ' 46' ' ' LYS . 24.5 m170 -85.37 141.15 30.21 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-O 121.033 0.444 . . . . 0.0 110.149 177.838 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.643 ' O ' ' HG3' ' A' ' 48' ' ' LYS . 0.5 OUTLIER -63.76 -20.28 65.64 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.888 -179.898 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.702 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -50.7 -47.29 59.04 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 112.173 0.435 . . . . 0.0 112.173 -178.476 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.516 ' HG3' ' O ' ' A' ' 43' ' ' HIS . 0.0 OUTLIER -68.84 -30.11 68.59 Favored 'General case' 0 C--O 1.222 -0.363 0 CA-C-O 121.165 0.507 . . . . 0.0 110.964 -178.872 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.462 HD12 HG21 ' A' ' 38' ' ' VAL . 7.8 tt -72.19 -48.53 42.53 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.549 178.559 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.643 ' HG3' ' O ' ' A' ' 44' ' ' LEU . 24.4 mtpt -57.16 -46.6 82.63 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-O 121.374 0.607 . . . . 0.0 110.46 -178.463 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.702 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 8.3 pt-20 -71.95 -32.94 67.79 Favored 'General case' 0 C--N 1.312 -1.052 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.692 -179.166 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' SER . . . . . 0.556 ' O ' ' HG2' ' A' ' 54' ' ' ARG . 23.2 t -62.18 -46.23 89.88 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-O 121.01 0.433 . . . . 0.0 110.699 -179.178 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.487 ' CD1' HG11 ' A' ' 26' ' ' VAL . 2.4 p90 -75.39 -33.0 60.96 Favored 'General case' 0 N--CA 1.441 -0.924 0 C-N-CA 119.744 -0.783 . . . . 0.0 110.701 -178.064 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 52' ' ' CYS . . . . . 0.552 ' SG ' ' HG2' ' A' ' 59' ' ' MET . 97.0 m -63.08 -45.89 90.0 Favored 'General case' 0 CA--C 1.509 -0.615 0 CA-C-O 121.08 0.467 . . . . 0.0 110.644 179.607 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -66.8 -34.45 77.85 Favored 'General case' 0 N--CA 1.442 -0.847 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.476 -179.499 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.556 ' HG2' ' O ' ' A' ' 50' ' ' SER . 40.0 mmt180 -57.23 -40.44 77.56 Favored 'General case' 0 C--N 1.349 0.572 0 CA-C-O 121.105 0.478 . . . . 0.0 111.153 176.813 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 55' ' ' GLN . . . . . 0.443 HE21 ' HB2' ' A' ' 32' ' ' SER . 30.0 mt-30 -77.24 -21.45 53.73 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.028 0.442 . . . . 0.0 110.982 -179.335 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 80.63 38.28 17.41 Favored Glycine 0 N--CA 1.443 -0.863 0 C-N-CA 120.674 -0.774 . . . . 0.0 111.793 -179.908 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 29.9 m -140.67 149.19 55.98 Favored Pre-proline 0 C--N 1.327 -0.392 0 N-CA-C 110.172 -0.307 . . . . 0.0 110.172 -179.952 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' PRO . . . . . 0.406 ' HG2' ' OG ' ' A' ' 61' ' ' SER . 30.3 Cg_endo -66.07 150.7 85.1 Favored 'Trans proline' 0 C--O 1.241 0.674 0 C-N-CA 122.325 2.016 . . . . 0.0 111.964 178.529 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.552 ' HG2' ' SG ' ' A' ' 52' ' ' CYS . 81.2 mtp -69.19 -8.87 49.66 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.95 -176.845 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 22.8 p30 -91.94 -12.46 33.36 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-O 121.134 0.492 . . . . 0.0 111.534 -178.476 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.406 ' OG ' ' HG2' ' A' ' 58' ' ' PRO . 75.3 m -84.28 -23.14 30.46 Favored 'General case' 0 N--CA 1.442 -0.831 0 CA-C-O 121.225 0.536 . . . . 0.0 111.391 179.848 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.532 HD11 ' SG ' ' A' ' 52' ' ' CYS . 2.0 pp -131.82 151.96 51.32 Favored 'General case' 0 C--N 1.309 -1.183 0 CA-C-O 121.549 0.69 . . . . 0.0 112.204 -178.231 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.441 ' HG3' ' HB2' ' A' ' 91' ' ' TYR . 1.1 ptp180 -109.97 139.96 44.51 Favored 'General case' 0 C--N 1.312 -1.06 0 CA-C-O 121.5 0.667 . . . . 0.0 112.657 -179.417 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -112.3 119.71 39.23 Favored 'General case' 0 C--N 1.311 -1.077 0 CA-C-N 114.96 -1.018 . . . . 0.0 110.726 -177.969 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.455 ' C ' HD22 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -142.79 164.23 30.65 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-O 121.327 0.584 . . . . 0.0 111.101 178.955 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 88.4 t80 -145.68 134.12 21.94 Favored 'General case' 0 C--N 1.312 -1.053 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 179.091 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.431 ' HG2' HE21 ' A' ' 69' ' ' GLN . 6.5 pt-20 49.1 28.08 1.98 Allowed 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 124.155 0.982 . . . . 0.0 112.102 -179.351 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 84.55 25.26 43.37 Favored Glycine 0 N--CA 1.447 -0.571 0 C-N-CA 120.848 -0.692 . . . . 0.0 113.195 -178.906 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' GLN . . . . . 0.431 HE21 ' HG2' ' A' ' 67' ' ' GLU . 3.0 pt20 -131.63 134.68 46.25 Favored 'General case' 0 C--N 1.32 -0.695 0 O-C-N 122.21 -0.582 . . . . 0.0 109.893 178.681 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.451 ' H ' ' HD3' ' A' ' 70' ' ' ARG . 0.0 OUTLIER -65.77 144.1 57.09 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-O 121.553 0.692 . . . . 0.0 110.43 176.767 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 23.3 mm -94.5 119.79 42.98 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.573 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 179.471 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -98.02 162.9 13.0 Favored 'General case' 0 N--CA 1.438 -1.031 0 CA-C-O 120.909 0.385 . . . . 0.0 110.0 -178.237 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' ASP . . . . . 0.488 ' HB3' ' HB3' ' A' ' 45' ' ' LYS . 62.0 m-20 -67.65 -23.75 65.37 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-O 121.375 0.607 . . . . 0.0 111.381 -178.511 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 3.1 m-80 -97.25 4.93 50.77 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-O 121.433 0.635 . . . . 0.0 109.69 -178.719 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' HIS . . . . . 0.527 ' O ' ' HB2' ' A' ' 44' ' ' LEU . 5.9 m170 -84.72 142.69 29.67 Favored 'General case' 0 CA--C 1.504 -0.826 0 CA-C-N 116.187 -0.46 . . . . 0.0 109.768 179.908 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 81.8 p -117.29 154.0 50.13 Favored Pre-proline 0 C--N 1.304 -1.401 0 CA-C-N 116.631 -0.259 . . . . 0.0 110.792 179.177 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_exo -60.33 -37.71 80.16 Favored 'Trans proline' 0 N--CA 1.456 -0.68 0 C-N-CA 122.435 2.09 . . . . 0.0 111.204 179.298 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 78' ' ' LYS . . . . . 0.464 ' HG3' ' N ' ' A' ' 79' ' ' GLU . 34.5 pttt -68.93 -35.88 77.32 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.14 -178.279 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 79' ' ' GLU . . . . . 0.464 ' N ' ' HG3' ' A' ' 78' ' ' LYS . 14.4 mm-40 -76.61 -37.35 56.57 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-O 121.039 0.447 . . . . 0.0 111.322 -178.898 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.458 HD21 ' CG ' ' A' ' 75' ' ' HIS . 5.2 mt -78.72 -5.16 52.42 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.241 0.543 . . . . 0.0 110.627 179.626 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 78.73 43.43 11.72 Favored Glycine 0 N--CA 1.45 -0.368 0 CA-C-N 115.884 -0.598 . . . . 0.0 112.883 176.99 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 61.1 mtt -101.89 162.29 13.02 Favored 'General case' 0 C--N 1.312 -1.025 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 178.652 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -138.14 -170.98 2.92 Favored 'General case' 0 C--N 1.313 -1.016 0 N-CA-C 110.04 -0.356 . . . . 0.0 110.04 179.506 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.436 ' HA ' ' HB ' ' A' ' 22' ' ' ILE . 8.8 pt-20 -70.11 129.38 39.25 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-O 121.273 0.559 . . . . 0.0 111.049 179.755 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 76.25 11.98 2.78 Favored 'General case' 0 C--N 1.316 -0.865 0 C-N-CA 124.312 1.045 . . . . 0.0 112.399 178.216 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -66.11 167.24 10.34 Favored 'General case' 0 C--O 1.239 0.551 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.107 174.332 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 87' ' ' VAL . . . . . 0.407 ' HA ' ' O ' ' A' ' 25' ' ' LYS . 8.8 p -129.39 145.27 35.99 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.105 0 CA-C-O 121.298 0.57 . . . . 0.0 111.751 -176.928 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 3.8 mp -115.82 153.71 17.37 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.741 0 N-CA-C 108.63 -0.878 . . . . 0.0 108.63 178.824 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -106.35 137.66 43.92 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 120.981 0.42 . . . . 0.0 110.491 -176.149 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 90' ' ' VAL . . . . . 0.473 ' HB ' ' HA2' ' A' ' 28' ' ' GLY . 97.9 t -129.61 135.89 60.43 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.909 0 CA-C-O 121.254 0.55 . . . . 0.0 110.821 178.971 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 91' ' ' TYR . . . . . 0.441 ' HB2' ' HG3' ' A' ' 63' ' ' ARG . 84.5 m-85 -122.77 171.75 8.95 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.065 179.853 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 9.0 tp60 -97.49 135.83 38.78 Favored 'General case' 0 C--N 1.308 -1.205 0 N-CA-C 109.779 -0.452 . . . . 0.0 109.779 179.482 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 . . . . . 0 C--N 1.321 -0.667 0 CA-C-O 121.306 0.574 . . . . 0.0 110.764 176.994 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 29.0 pt . . . . . 0 N--CA 1.448 -0.559 0 CA-C-O 121.785 0.803 . . . . 0.0 110.632 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.422 ' HE3' ' HG3' ' A' ' 85' ' ' GLU . 11.2 mtmt -115.57 145.86 42.28 Favored 'General case' 0 C--N 1.295 -1.781 0 CA-C-N 115.791 -0.641 . . . . 0.0 109.54 -178.356 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.0 mp -141.03 163.48 32.85 Favored 'General case' 0 C--N 1.306 -1.289 0 CA-C-O 121.213 0.53 . . . . 0.0 111.335 174.25 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.538 ' NZ ' HD11 ' A' ' 27' ' ' ILE . 3.1 tmmt? -135.52 144.26 46.21 Favored 'General case' 0 N--CA 1.445 -0.71 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.568 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.559 ' O ' ' HA ' ' A' ' 33' ' ' GLU . 0.9 OUTLIER -114.41 142.48 26.97 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.121 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.891 179.886 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.538 HD11 ' NZ ' ' A' ' 25' ' ' LYS . 41.4 mm -110.94 97.71 6.09 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.842 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 176.079 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' GLY . . . . . 0.565 ' HA2' ' HB ' ' A' ' 90' ' ' VAL . . . -66.21 165.06 39.71 Favored Glycine 0 N--CA 1.434 -1.476 0 C-N-CA 120.646 -0.787 . . . . 0.0 113.918 178.691 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.407 ' HG3' ' H ' ' A' ' 29' ' ' GLN . 0.0 OUTLIER -56.91 -19.48 18.04 Favored 'General case' 0 C--N 1.315 -0.933 0 C-N-CA 124.286 1.034 . . . . 0.0 112.411 178.906 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.406 ' O ' ' HB2' ' A' ' 31' ' ' SER . 23.4 t70 -106.9 13.4 27.76 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.521 0.677 . . . . 0.0 110.03 -179.039 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' SER . . . . . 0.406 ' HB2' ' O ' ' A' ' 30' ' ' ASP . 62.6 m 74.72 23.6 1.78 Allowed 'General case' 0 CA--C 1.506 -0.742 0 CA-C-O 122.768 1.271 . . . . 0.0 108.076 -178.076 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 9.6 m -71.09 91.51 0.91 Allowed 'General case' 0 N--CA 1.426 -1.655 0 CA-C-N 113.384 -1.734 . . . . 0.0 110.411 179.096 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.559 ' HA ' ' O ' ' A' ' 26' ' ' VAL . 24.8 mt-10 -83.09 107.33 15.59 Favored 'General case' 0 CA--C 1.511 -0.555 0 CA-C-O 121.279 0.561 . . . . 0.0 110.887 -179.816 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 28.2 mm -103.65 138.12 29.43 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.242 0 N-CA-C 109.147 -0.686 . . . . 0.0 109.147 178.637 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' HIS . . . . . 0.42 ' CD2' ' HG3' ' A' ' 25' ' ' LYS . 12.3 m170 -115.45 133.64 55.84 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 -179.915 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.535 ' HZ ' HG23 ' A' ' 26' ' ' VAL . 0.9 OUTLIER -146.6 165.31 29.89 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-O 121.141 0.496 . . . . 0.0 111.035 -177.997 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 64.7 mmtt -123.79 115.33 21.18 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.14 -0.482 . . . . 0.0 109.912 -177.683 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.407 ' HB ' HG21 ' A' ' 42' ' ' THR . 20.3 m -136.79 154.5 31.85 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-O 120.91 0.386 . . . . 0.0 110.346 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.55 ' O ' HG22 ' A' ' 42' ' ' THR . 83.4 tttt -81.14 163.03 23.4 Favored 'General case' 0 C--N 1.314 -0.955 0 O-C-N 121.837 -0.54 . . . . 0.0 111.07 -178.663 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' MET . . . . . 0.47 ' O ' ' HG2' ' A' ' 78' ' ' LYS . 0.0 OUTLIER -68.64 -39.59 80.68 Favored 'General case' 0 N--CA 1.466 0.327 0 O-C-N 121.905 -0.497 . . . . 0.0 111.986 -177.785 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 14.9 t -93.23 13.39 21.37 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-O 121.167 0.508 . . . . 0.0 111.742 -175.777 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' THR . . . . . 0.55 HG22 ' O ' ' A' ' 39' ' ' LYS . 2.2 t -92.95 164.37 13.32 Favored 'General case' 0 C--N 1.323 -0.57 0 O-C-N 121.833 -0.542 . . . . 0.0 110.34 -179.031 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' HIS . . . . . 0.498 ' O ' ' HG2' ' A' ' 46' ' ' LYS . 17.2 m170 -77.12 139.55 39.99 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.42 0.628 . . . . 0.0 111.146 178.93 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.626 ' HB2' ' O ' ' A' ' 75' ' ' HIS . 0.2 OUTLIER -70.03 -17.6 63.27 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 115.68 -0.691 . . . . 0.0 109.516 -179.224 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.754 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -53.94 -45.64 71.31 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.963 -178.456 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.498 ' HG2' ' O ' ' A' ' 43' ' ' HIS . 13.6 ptmm? -63.5 -30.15 71.32 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 121.563 0.697 . . . . 0.0 110.61 -178.649 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.591 ' HB3' HD13 ' A' ' 44' ' ' LEU . 8.2 tt -72.44 -48.91 37.42 Favored 'General case' 0 C--N 1.31 -1.139 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.085 179.37 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.589 ' HD3' ' HA ' ' A' ' 45' ' ' LYS . 27.0 mtpt -58.57 -46.84 86.07 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 121.321 0.581 . . . . 0.0 110.619 -178.292 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.754 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 5.9 pt-20 -70.3 -31.55 68.94 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.683 -179.167 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 26.6 t -67.28 -45.85 75.39 Favored 'General case' 0 N--CA 1.455 -0.193 0 CA-C-O 121.102 0.477 . . . . 0.0 111.32 -179.129 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.453 ' CD1' HG11 ' A' ' 26' ' ' VAL . 2.1 p90 -76.03 -32.53 59.4 Favored 'General case' 0 N--CA 1.443 -0.784 0 C-N-CA 119.613 -0.835 . . . . 0.0 110.359 -176.992 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 52' ' ' CYS . . . . . 0.506 ' SG ' ' HG2' ' A' ' 59' ' ' MET . 85.1 m -63.01 -43.65 98.19 Favored 'General case' 0 CA--C 1.513 -0.449 0 CA-C-O 120.969 0.414 . . . . 0.0 110.864 178.878 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 12.7 pt20 -68.74 -33.58 74.15 Favored 'General case' 0 N--CA 1.448 -0.546 0 C-N-CA 120.513 -0.475 . . . . 0.0 110.419 -179.638 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.483 ' CZ ' ' HA ' ' A' ' 54' ' ' ARG . 3.2 mmp_? -57.79 -43.45 85.62 Favored 'General case' 0 C--N 1.341 0.236 0 CA-C-O 121.233 0.54 . . . . 0.0 111.117 177.319 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 30.9 mt-30 -75.33 -20.24 59.16 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 121.222 0.534 . . . . 0.0 110.814 179.299 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 79.94 29.39 47.02 Favored Glycine 0 N--CA 1.446 -0.698 0 C-N-CA 121.056 -0.592 . . . . 0.0 112.044 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 34.7 m -129.47 148.99 71.57 Favored Pre-proline 0 C--N 1.322 -0.607 0 O-C-N 122.48 -0.423 . . . . 0.0 110.981 -178.527 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' PRO . . . . . 0.518 ' HG2' ' OG ' ' A' ' 61' ' ' SER . 33.5 Cg_endo -66.99 150.87 82.82 Favored 'Trans proline' 0 N--CA 1.456 -0.728 0 C-N-CA 122.459 2.106 . . . . 0.0 112.296 178.713 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.506 ' HG2' ' SG ' ' A' ' 52' ' ' CYS . 75.8 mtp -70.61 -8.83 54.57 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.589 -177.086 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 60' ' ' ASN . . . . . 0.42 ' OD1' ' HB2' ' A' ' 58' ' ' PRO . 1.8 p-10 -92.37 -9.74 40.68 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.662 -179.466 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.518 ' OG ' ' HG2' ' A' ' 58' ' ' PRO . 70.0 m -89.64 -22.78 22.13 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-O 121.016 0.436 . . . . 0.0 111.703 -179.182 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 1.2 pp -126.05 171.15 11.05 Favored 'General case' 0 C--N 1.314 -0.978 0 O-C-N 121.965 -0.46 . . . . 0.0 111.996 -178.69 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.507 ' CG ' ' HB3' ' A' ' 93' ' ' GLU . 57.1 mtp180 -122.38 122.8 39.88 Favored 'General case' 0 CA--C 1.506 -0.744 0 CA-C-O 120.967 0.413 . . . . 0.0 110.663 -177.698 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -100.83 115.01 29.33 Favored 'General case' 0 C--N 1.304 -1.384 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.614 177.671 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.458 ' C ' HD22 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -143.87 162.01 37.21 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-O 121.46 0.648 . . . . 0.0 111.396 179.728 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 87.1 t80 -143.18 135.56 27.28 Favored 'General case' 0 C--N 1.306 -1.304 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 179.002 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.445 ' HG2' HE21 ' A' ' 69' ' ' GLN . 9.9 pt-20 49.62 31.12 3.98 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.057 0.943 . . . . 0.0 112.166 -179.564 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 84.94 14.24 70.13 Favored Glycine 0 N--CA 1.447 -0.612 0 CA-C-N 116.019 -0.537 . . . . 0.0 113.447 179.025 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' GLN . . . . . 0.445 HE21 ' HG2' ' A' ' 67' ' ' GLU . 2.7 pt20 -122.25 135.16 54.71 Favored 'General case' 0 C--N 1.317 -0.807 0 O-C-N 122.139 -0.624 . . . . 0.0 109.505 -178.737 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.46 140.57 48.35 Favored 'General case' 0 C--N 1.313 -1.005 0 CA-C-O 121.44 0.638 . . . . 0.0 109.961 178.843 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.451 HG21 HD12 ' A' ' 44' ' ' LEU . 22.8 mm -86.74 121.76 38.04 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.517 0 CA-C-O 121.075 0.464 . . . . 0.0 110.344 -178.338 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.416 ' O ' ' HB2' ' A' ' 75' ' ' HIS . . . -95.75 161.15 14.14 Favored 'General case' 0 N--CA 1.434 -1.246 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 179.667 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 48.5 m-20 -66.01 -27.89 68.46 Favored 'General case' 0 C--N 1.311 -1.108 0 CA-C-O 121.352 0.596 . . . . 0.0 110.925 -178.689 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 8.0 m-80 -91.92 1.64 57.05 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-O 121.107 0.48 . . . . 0.0 109.97 -178.793 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' HIS . . . . . 0.626 ' O ' ' HB2' ' A' ' 44' ' ' LEU . 7.6 m170 -81.02 146.75 30.5 Favored 'General case' 0 CA--C 1.498 -1.033 0 N-CA-C 109.778 -0.453 . . . . 0.0 109.778 -179.381 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.431 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 80.5 p -122.13 155.69 60.98 Favored Pre-proline 0 C--N 1.303 -1.44 0 C-N-CA 121.086 -0.245 . . . . 0.0 111.072 178.897 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_exo -60.79 -36.91 82.02 Favored 'Trans proline' 0 N--CA 1.46 -0.46 0 C-N-CA 122.385 2.056 . . . . 0.0 111.086 178.962 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' LYS . . . . . 0.47 ' HG2' ' O ' ' A' ' 40' ' ' MET . 16.4 ptmt -67.47 -38.92 85.13 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.848 -0.614 . . . . 0.0 111.376 -179.306 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -77.96 -32.71 51.58 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.602 -178.317 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.438 HD21 ' CG ' ' A' ' 75' ' ' HIS . 5.5 mt -83.16 0.92 43.05 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.137 0.494 . . . . 0.0 110.733 179.27 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 72.86 44.45 37.66 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 121.158 -0.544 . . . . 0.0 112.975 176.746 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 62.9 mtt -102.52 166.33 10.59 Favored 'General case' 0 C--N 1.313 -0.998 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 179.285 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 83' ' ' GLU . . . . . 0.435 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 11.3 pt-20 -140.8 -171.28 3.21 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-O 120.717 0.294 . . . . 0.0 110.65 178.829 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -69.15 126.91 31.27 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-O 121.687 0.756 . . . . 0.0 111.698 -177.948 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 85' ' ' GLU . . . . . 0.422 ' HG3' ' HE3' ' A' ' 23' ' ' LYS . 44.0 mt-10 76.2 13.34 2.61 Favored 'General case' 0 C--N 1.316 -0.859 0 C-N-CA 124.745 1.218 . . . . 0.0 111.498 178.03 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 86' ' ' ASP . . . . . 0.435 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 4.3 t0 -59.43 162.05 5.19 Favored 'General case' 0 C--O 1.239 0.549 0 CA-C-N 115.456 -0.793 . . . . 0.0 109.842 173.965 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 12.1 p -125.78 143.76 38.22 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.467 0 CA-C-O 121.342 0.591 . . . . 0.0 111.086 -176.415 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 3.8 mp -113.4 153.26 14.98 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.994 0 N-CA-C 109.087 -0.708 . . . . 0.0 109.087 179.207 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -105.72 138.7 41.47 Favored 'General case' 0 C--N 1.314 -0.946 0 CA-C-O 120.992 0.425 . . . . 0.0 109.932 -176.652 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 90' ' ' VAL . . . . . 0.565 ' HB ' ' HA2' ' A' ' 28' ' ' GLY . 91.4 t -131.04 134.73 61.14 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.066 0 CA-C-O 121.382 0.611 . . . . 0.0 110.733 179.394 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 92.0 m-85 -121.87 -178.92 3.97 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-N 115.913 -0.585 . . . . 0.0 109.511 179.543 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 8.1 tp60 -103.32 144.94 30.7 Favored 'General case' 0 C--N 1.307 -1.275 0 N-CA-C 109.747 -0.464 . . . . 0.0 109.747 179.135 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 93' ' ' GLU . . . . . 0.507 ' HB3' ' CG ' ' A' ' 63' ' ' ARG . 10.1 pt-20 . . . . . 0 C--N 1.326 -0.414 0 CA-C-O 121.322 0.582 . . . . 0.0 110.684 176.12 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' ILE . . . . . 0.409 ' HB ' ' HA ' ' A' ' 84' ' ' GLU . 28.2 pt . . . . . 0 N--CA 1.44 -0.958 0 CA-C-O 121.325 0.583 . . . . 0.0 110.365 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 1.5 mppt? -119.12 145.41 45.98 Favored 'General case' 0 C--N 1.298 -1.638 0 N-CA-C 108.744 -0.835 . . . . 0.0 108.744 -179.356 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.4 mp -138.36 164.59 28.92 Favored 'General case' 0 C--N 1.303 -1.444 0 CA-C-O 121.332 0.587 . . . . 0.0 111.089 176.19 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.426 ' O ' ' HA ' ' A' ' 87' ' ' VAL . 5.5 tmmm? -133.26 143.02 48.82 Favored 'General case' 0 N--CA 1.434 -1.228 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.358 -178.965 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.532 ' O ' ' HA ' ' A' ' 33' ' ' GLU . 0.9 OUTLIER -114.4 142.68 26.24 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.377 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.039 -179.261 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.432 HD13 ' HG2' ' A' ' 33' ' ' GLU . 46.5 mm -105.04 115.16 46.37 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.028 0 N-CA-C 107.505 -1.295 . . . . 0.0 107.505 175.042 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' GLY . . . . . 0.433 ' HA2' ' HB ' ' A' ' 90' ' ' VAL . . . -82.77 166.9 45.54 Favored Glycine 0 N--CA 1.42 -2.37 0 C-N-CA 120.202 -0.999 . . . . 0.0 111.748 -176.58 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.38 -23.07 65.53 Favored 'General case' 0 C--N 1.305 -1.343 0 CA-C-O 121.527 0.68 . . . . 0.0 111.023 178.395 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -103.4 15.36 29.26 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.429 0.633 . . . . 0.0 109.493 178.704 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 29.2 t 73.12 16.85 4.2 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 123.771 0.828 . . . . 0.0 111.139 179.526 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 12.5 t -73.45 111.57 8.71 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 116.154 -0.476 . . . . 0.0 109.822 179.477 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.532 ' HA ' ' O ' ' A' ' 26' ' ' VAL . 43.9 mt-10 -88.37 108.64 19.45 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 121.376 0.607 . . . . 0.0 110.701 179.768 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 27.0 mm -98.37 137.22 26.51 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.269 0 N-CA-C 109.233 -0.654 . . . . 0.0 109.233 179.741 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 12.8 m170 -115.75 133.1 56.37 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 -179.846 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.513 ' HZ ' HG23 ' A' ' 26' ' ' VAL . 1.2 p90 -147.79 165.13 31.48 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-O 121.147 0.499 . . . . 0.0 111.552 -178.428 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 9.4 ptpp? -119.91 125.23 47.94 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.173 0.511 . . . . 0.0 110.94 179.713 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 33.9 m -140.56 154.94 22.45 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 178.773 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.439 ' O ' HG22 ' A' ' 42' ' ' THR . 83.9 tttt -87.87 162.81 16.73 Favored 'General case' 0 C--N 1.306 -1.29 0 O-C-N 121.796 -0.565 . . . . 0.0 111.442 -178.02 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -78.45 15.26 1.02 Allowed 'General case' 0 N--CA 1.479 1.018 0 O-C-N 121.856 -0.527 . . . . 0.0 112.25 -177.03 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 14.4 t -138.66 3.34 2.28 Favored 'General case' 0 C--N 1.308 -1.236 0 CA-C-O 121.23 0.538 . . . . 0.0 110.784 -177.162 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' THR . . . . . 0.439 HG22 ' O ' ' A' ' 39' ' ' LYS . 7.3 t -96.84 166.22 11.73 Favored 'General case' 0 N--CA 1.44 -0.97 0 CA-C-O 120.913 0.387 . . . . 0.0 110.357 -175.355 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 43' ' ' HIS . . . . . 0.401 ' HB3' ' O ' ' A' ' 73' ' ' ASP . 63.4 m170 -84.63 144.12 28.81 Favored 'General case' 0 C--N 1.314 -0.974 0 CA-C-O 121.498 0.666 . . . . 0.0 111.276 -178.896 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.543 ' O ' ' HG2' ' A' ' 48' ' ' LYS . 0.9 OUTLIER -65.7 -15.0 62.39 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.423 -0.808 . . . . 0.0 111.129 178.975 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.677 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -52.07 -48.37 64.71 Favored 'General case' 0 C--O 1.222 -0.391 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.803 -179.481 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 20.5 ptmt -67.03 -31.65 72.33 Favored 'General case' 0 C--O 1.208 -1.117 0 CA-C-O 120.894 0.378 . . . . 0.0 110.892 -179.943 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.408 ' HB3' HD13 ' A' ' 44' ' ' LEU . 8.6 tt -71.19 -49.97 38.02 Favored 'General case' 0 C--N 1.307 -1.241 0 CA-C-O 121.021 0.438 . . . . 0.0 110.766 -178.834 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.543 ' HG2' ' O ' ' A' ' 44' ' ' LEU . 6.1 ptmm? -62.41 -41.16 98.47 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.657 -178.207 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.677 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 8.7 pt-20 -72.04 -34.2 68.59 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-O 121.09 0.472 . . . . 0.0 110.417 178.072 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 5.4 m -65.06 -43.53 91.97 Favored 'General case' 0 C--O 1.234 0.262 0 N-CA-C 112.296 0.48 . . . . 0.0 112.296 -178.118 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.483 ' CD1' HG11 ' A' ' 26' ' ' VAL . 2.1 p90 -76.03 -33.38 59.63 Favored 'General case' 0 N--CA 1.444 -0.767 0 C-N-CA 119.326 -0.95 . . . . 0.0 110.189 -178.951 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 52' ' ' CYS . . . . . 0.509 ' SG ' HD11 ' A' ' 62' ' ' LEU . 91.6 m -62.42 -44.91 95.31 Favored 'General case' 0 CA--C 1.511 -0.544 0 CA-C-O 121.199 0.523 . . . . 0.0 110.611 179.556 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 13.2 pt20 -67.35 -34.79 78.04 Favored 'General case' 0 N--CA 1.443 -0.78 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.533 -179.032 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 2.3 mmp_? -56.3 -43.06 78.52 Favored 'General case' 0 C--N 1.346 0.427 0 CA-C-O 121.045 0.45 . . . . 0.0 111.232 177.331 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 29.5 mt-30 -73.86 -21.46 60.1 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.127 0.489 . . . . 0.0 110.931 179.631 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 84.68 28.12 33.19 Favored Glycine 0 N--CA 1.444 -0.769 0 C-N-CA 120.814 -0.707 . . . . 0.0 112.247 179.501 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 31.4 m -128.83 150.2 74.36 Favored Pre-proline 0 C--N 1.327 -0.405 0 O-C-N 122.418 -0.46 . . . . 0.0 110.753 -178.706 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' PRO . . . . . 0.478 ' HG2' ' OG ' ' A' ' 61' ' ' SER . 28.8 Cg_endo -65.39 153.96 75.83 Favored 'Trans proline' 0 N--CA 1.456 -0.715 0 C-N-CA 122.216 1.944 . . . . 0.0 111.5 177.115 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.459 ' HG2' ' SG ' ' A' ' 52' ' ' CYS . 77.3 mtp -74.97 -8.63 57.07 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.437 -176.201 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 24.2 p30 -90.55 -12.13 38.03 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-O 121.102 0.477 . . . . 0.0 111.596 -178.225 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.478 ' OG ' ' HG2' ' A' ' 58' ' ' PRO . 64.3 m -83.95 -21.08 31.93 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-O 121.24 0.543 . . . . 0.0 111.275 -179.234 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.509 HD11 ' SG ' ' A' ' 52' ' ' CYS . 1.2 pp -129.9 173.04 11.06 Favored 'General case' 0 C--N 1.309 -1.179 0 CA-C-O 121.479 0.657 . . . . 0.0 112.667 -176.932 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.47 ' HG3' ' HB2' ' A' ' 91' ' ' TYR . 1.1 ptp180 -129.35 132.64 47.12 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 115.53 -0.759 . . . . 0.0 111.741 -179.659 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.481 ' CZ ' ' HE2' ' A' ' 48' ' ' LYS . 0.1 OUTLIER -107.66 120.29 41.82 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-N 115.187 -0.915 . . . . 0.0 110.758 -177.662 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.465 ' C ' HD22 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -145.51 163.91 33.24 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-O 121.491 0.662 . . . . 0.0 111.173 179.72 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 80.3 t80 -146.29 135.59 22.84 Favored 'General case' 0 C--N 1.307 -1.267 0 N-CA-C 109.199 -0.667 . . . . 0.0 109.199 178.503 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.417 ' HG2' HE21 ' A' ' 69' ' ' GLN . 7.2 pt-20 49.89 28.57 2.89 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 124.126 0.971 . . . . 0.0 112.387 179.525 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 85.03 22.69 51.83 Favored Glycine 0 N--CA 1.445 -0.742 0 C-N-CA 121.146 -0.55 . . . . 0.0 112.96 179.596 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' GLN . . . . . 0.417 HE21 ' HG2' ' A' ' 67' ' ' GLU . 2.6 pt20 -130.15 134.41 47.3 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 179.085 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 1.3 ppt_? -71.98 148.39 45.98 Favored 'General case' 0 C--N 1.31 -1.142 0 CA-C-O 121.298 0.57 . . . . 0.0 110.252 178.303 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 23.4 mm -95.39 123.23 47.46 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.226 0 O-C-N 121.919 -0.488 . . . . 0.0 110.901 -177.757 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -99.46 164.56 12.05 Favored 'General case' 0 N--CA 1.447 -0.596 0 N-CA-C 110.168 -0.308 . . . . 0.0 110.168 179.704 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' ASP . . . . . 0.401 ' O ' ' HB3' ' A' ' 43' ' ' HIS . 31.7 m-20 -64.87 -28.06 69.29 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.239 0.542 . . . . 0.0 111.015 -179.298 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 3.3 m-80 -96.12 5.59 50.75 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 121.097 0.475 . . . . 0.0 110.06 -177.373 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' HIS . . . . . 0.475 ' CG ' HD21 ' A' ' 80' ' ' LEU . 3.4 m170 -83.17 140.52 32.53 Favored 'General case' 0 CA--C 1.502 -0.896 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 179.788 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.439 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 59.9 p -119.08 155.7 53.0 Favored Pre-proline 0 C--N 1.306 -1.311 0 C-N-CA 120.985 -0.286 . . . . 0.0 110.936 179.469 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_exo -61.82 -37.87 63.73 Favored 'Trans proline' 0 N--CA 1.46 -0.461 0 C-N-CA 122.465 2.11 . . . . 0.0 111.341 179.808 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' LYS . . . . . 0.476 ' HG3' ' N ' ' A' ' 79' ' ' GLU . 34.1 pttt -68.04 -36.01 79.19 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.621 -179.344 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 79' ' ' GLU . . . . . 0.476 ' N ' ' HG3' ' A' ' 78' ' ' LYS . 11.2 mm-40 -74.01 -42.5 60.25 Favored 'General case' 0 CA--C 1.512 -0.511 0 CA-C-O 121.18 0.514 . . . . 0.0 111.01 -179.576 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.475 HD21 ' CG ' ' A' ' 75' ' ' HIS . 5.7 mt -76.19 -6.45 51.35 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.037 0.446 . . . . 0.0 111.237 -178.246 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 80.57 46.9 7.08 Favored Glycine 0 N--CA 1.447 -0.575 0 C-N-CA 120.862 -0.685 . . . . 0.0 112.744 177.885 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 59.3 mtt -106.64 164.32 12.18 Favored 'General case' 0 C--N 1.314 -0.942 0 O-C-N 122.51 -0.406 . . . . 0.0 109.982 178.437 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -138.18 -169.35 2.55 Favored 'General case' 0 C--N 1.313 -0.987 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 178.256 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.429 ' O ' ' HB2' ' A' ' 85' ' ' GLU . 11.5 pt-20 -78.44 134.32 37.38 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-O 121.545 0.688 . . . . 0.0 111.719 -178.893 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 85' ' ' GLU . . . . . 0.429 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 37.7 mt-10 78.97 8.22 1.97 Allowed 'General case' 0 C--N 1.325 -0.468 0 C-N-CA 125.104 1.361 . . . . 0.0 111.539 -179.426 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 4.6 t0 -63.26 166.52 6.15 Favored 'General case' 0 C--O 1.239 0.539 0 CA-C-N 115.734 -0.667 . . . . 0.0 110.472 175.687 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 87' ' ' VAL . . . . . 0.426 ' HA ' ' O ' ' A' ' 25' ' ' LYS . 8.3 p -129.08 143.63 40.65 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.076 0 CA-C-O 121.358 0.599 . . . . 0.0 111.654 -176.754 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 3.5 mp -113.58 154.87 14.9 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 179.18 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 11.0 tp10 -107.88 138.9 43.32 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-O 121.032 0.444 . . . . 0.0 110.686 -176.262 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 90' ' ' VAL . . . . . 0.433 ' HB ' ' HA2' ' A' ' 28' ' ' GLY . 97.6 t -129.92 135.29 61.44 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.92 0 CA-C-O 121.362 0.601 . . . . 0.0 110.883 178.872 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 91' ' ' TYR . . . . . 0.47 ' HB2' ' HG3' ' A' ' 63' ' ' ARG . 81.2 m-85 -121.78 173.91 7.18 Favored 'General case' 0 C--N 1.31 -1.147 0 CA-C-N 116.115 -0.493 . . . . 0.0 109.915 178.856 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 9.5 tp60 -101.09 148.83 24.61 Favored 'General case' 0 C--N 1.306 -1.315 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 179.903 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 . . . . . 0 C--N 1.321 -0.637 0 CA-C-O 121.075 0.464 . . . . 0.0 110.998 177.419 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 22' ' ' ILE . . . . . 0.475 ' HB ' ' HA ' ' A' ' 84' ' ' GLU . 23.9 pt . . . . . 0 N--CA 1.439 -1.021 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.494 ' HG2' ' HG2' ' A' ' 37' ' ' LYS . 34.6 mtmt -110.66 148.85 31.39 Favored 'General case' 0 C--N 1.298 -1.635 0 N-CA-C 109.75 -0.463 . . . . 0.0 109.75 179.739 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.6 mp -140.53 154.22 46.47 Favored 'General case' 0 C--N 1.3 -1.58 0 CA-C-O 121.345 0.593 . . . . 0.0 110.664 171.916 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.466 ' O ' ' HA ' ' A' ' 87' ' ' VAL . 5.4 tmmm? -128.41 143.84 51.05 Favored 'General case' 0 C--N 1.308 -1.212 0 CA-C-O 121.376 0.608 . . . . 0.0 110.334 -178.546 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.509 HG23 ' HZ ' ' A' ' 36' ' ' PHE . 0.9 OUTLIER -115.96 140.16 39.18 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.494 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.249 -179.132 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.402 HD13 ' HG2' ' A' ' 33' ' ' GLU . 46.8 mm -103.81 112.12 36.09 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.28 0 N-CA-C 107.194 -1.41 . . . . 0.0 107.194 174.496 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 28' ' ' GLY . . . . . 0.49 ' HA2' ' HB ' ' A' ' 90' ' ' VAL . . . -80.87 166.58 48.94 Favored Glycine 0 N--CA 1.428 -1.89 0 C-N-CA 120.181 -1.009 . . . . 0.0 111.493 -176.92 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.92 -20.07 64.83 Favored 'General case' 0 C--N 1.314 -0.978 0 CA-C-O 121.567 0.699 . . . . 0.0 110.902 177.481 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -97.16 12.97 30.87 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 121.685 0.755 . . . . 0.0 109.568 177.653 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 21.7 m 69.81 14.64 8.02 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.744 -179.055 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 7.9 t -72.79 116.93 13.87 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.533 -179.215 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.498 ' HA ' ' O ' ' A' ' 26' ' ' VAL . 41.7 mt-10 -89.44 106.33 18.38 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.214 0.531 . . . . 0.0 110.791 178.333 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 29.5 mm -96.44 136.11 28.36 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.426 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 178.574 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 12.5 m170 -115.62 131.35 56.96 Favored 'General case' 0 C--N 1.321 -0.674 0 N-CA-C 109.783 -0.451 . . . . 0.0 109.783 -178.373 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.509 ' HZ ' HG23 ' A' ' 26' ' ' VAL . 2.1 p90 -147.2 149.09 32.26 Favored 'General case' 0 C--N 1.309 -1.163 0 CA-C-O 121.33 0.586 . . . . 0.0 111.379 -179.311 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.494 ' HG2' ' HG2' ' A' ' 23' ' ' LYS . 38.1 mtmt -110.03 123.3 49.43 Favored 'General case' 0 C--N 1.313 -0.979 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.418 178.774 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.479 HG21 HD12 ' A' ' 47' ' ' LEU . 22.5 m -141.33 165.19 19.19 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.96 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 179.816 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.433 ' O ' HG22 ' A' ' 42' ' ' THR . 48.0 mtpt -84.81 176.71 8.34 Favored 'General case' 0 C--N 1.308 -1.237 0 CA-C-O 121.566 0.698 . . . . 0.0 111.517 179.854 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.38 -33.99 20.34 Favored 'General case' 0 C--N 1.307 -1.27 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.25 178.672 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 9.0 t -94.06 25.32 3.78 Favored 'General case' 0 N--CA 1.444 -0.732 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.24 -177.765 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' THR . . . . . 0.433 HG22 ' O ' ' A' ' 39' ' ' LYS . 7.0 t -108.08 172.6 6.74 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 109.711 -0.477 . . . . 0.0 109.711 178.85 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 43' ' ' HIS . . . . . 0.423 ' O ' ' HG3' ' A' ' 46' ' ' LYS . 47.8 m170 -92.92 143.89 25.8 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-O 121.501 0.667 . . . . 0.0 111.479 -179.618 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.539 ' HB2' ' O ' ' A' ' 75' ' ' HIS . 0.7 OUTLIER -68.13 -17.3 64.32 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.564 178.469 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.514 ' HA ' ' HD3' ' A' ' 48' ' ' LYS . 0.0 OUTLIER -54.82 -44.94 74.3 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.883 -179.361 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.581 ' O ' ' HB2' ' A' ' 50' ' ' SER . 0.0 OUTLIER -74.0 -26.12 60.27 Favored 'General case' 0 N--CA 1.439 -1.009 0 CA-C-O 121.296 0.57 . . . . 0.0 110.493 -179.176 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.479 HD12 HG21 ' A' ' 38' ' ' VAL . 8.7 tt -72.96 -52.03 16.09 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.605 178.464 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.514 ' HD3' ' HA ' ' A' ' 45' ' ' LYS . 6.1 ptmm? -59.7 -41.04 89.88 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.98 0.419 . . . . 0.0 111.557 -178.695 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.47 -31.12 65.16 Favored 'General case' 0 C--N 1.318 -0.779 0 C-N-CA 120.437 -0.505 . . . . 0.0 110.564 178.247 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 50' ' ' SER . . . . . 0.581 ' HB2' ' O ' ' A' ' 46' ' ' LYS . 8.6 t -66.23 -42.89 88.04 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.481 -178.398 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.463 ' CD2' ' HA ' ' A' ' 48' ' ' LYS . 3.4 p90 -76.51 -32.85 58.55 Favored 'General case' 0 N--CA 1.446 -0.625 0 C-N-CA 119.672 -0.811 . . . . 0.0 110.502 -179.473 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 52' ' ' CYS . . . . . 0.464 ' SG ' HD11 ' A' ' 62' ' ' LEU . 90.8 m -63.77 -45.03 91.65 Favored 'General case' 0 CA--C 1.509 -0.625 0 CA-C-O 121.229 0.537 . . . . 0.0 110.291 179.07 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 53' ' ' GLN . . . . . 0.44 ' HG2' ' O ' ' A' ' 50' ' ' SER . 13.8 pt20 -66.46 -33.96 76.88 Favored 'General case' 0 N--CA 1.444 -0.734 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.319 -178.987 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 2.2 mmp_? -56.05 -39.16 71.6 Favored 'General case' 0 C--N 1.349 0.571 0 CA-C-O 121.244 0.545 . . . . 0.0 111.08 176.204 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 29.6 mt-30 -82.32 -22.07 35.78 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.363 -178.482 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 83.6 29.54 32.32 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 120.43 -0.891 . . . . 0.0 111.721 179.736 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 21.0 m -129.11 149.9 73.89 Favored Pre-proline 0 C--O 1.238 0.495 0 O-C-N 122.519 -0.401 . . . . 0.0 110.692 -177.955 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' PRO . . . . . 0.512 ' HG2' ' OG ' ' A' ' 61' ' ' SER . 34.3 Cg_endo -65.78 149.71 86.6 Favored 'Trans proline' 0 C--O 1.238 0.483 0 C-N-CA 122.487 2.125 . . . . 0.0 112.383 178.445 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.446 ' HG2' ' SG ' ' A' ' 52' ' ' CYS . 73.4 mtp -74.25 -9.31 58.48 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.514 -177.28 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 2.0 p-10 -91.73 -8.32 47.26 Favored 'General case' 0 C--N 1.311 -1.068 0 CA-C-O 121.142 0.496 . . . . 0.0 111.266 -179.09 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.512 ' OG ' ' HG2' ' A' ' 58' ' ' PRO . 71.0 m -91.76 -20.32 21.65 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 121.012 0.434 . . . . 0.0 111.946 -179.785 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.464 HD11 ' SG ' ' A' ' 52' ' ' CYS . 1.9 pp -130.4 155.21 46.78 Favored 'General case' 0 C--N 1.315 -0.931 0 N-CA-C 112.629 0.603 . . . . 0.0 112.629 -179.229 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.553 ' O ' ' HA ' ' A' ' 90' ' ' VAL . 40.2 mtm-85 -105.79 130.23 53.82 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.576 -177.943 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -107.12 116.12 31.37 Favored 'General case' 0 C--N 1.309 -1.191 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.458 178.131 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.464 ' C ' HD22 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -141.89 163.2 33.54 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 121.464 0.65 . . . . 0.0 111.353 179.704 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 90.5 t80 -145.07 138.04 26.41 Favored 'General case' 0 C--N 1.308 -1.218 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 179.602 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.479 ' HG2' HE21 ' A' ' 69' ' ' GLN . 6.8 pt-20 49.86 26.76 2.06 Favored 'General case' 0 N--CA 1.485 1.314 0 C-N-CA 123.997 0.919 . . . . 0.0 112.118 -179.261 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 82.66 23.11 56.94 Favored Glycine 0 CA--C 1.522 0.512 0 C-N-CA 120.525 -0.845 . . . . 0.0 113.087 -177.618 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' GLN . . . . . 0.479 HE21 ' HG2' ' A' ' 67' ' ' GLU . 2.6 pt20 -129.57 134.36 47.69 Favored 'General case' 0 C--N 1.319 -0.735 0 O-C-N 122.177 -0.601 . . . . 0.0 109.471 179.797 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.45 ' CD ' ' H ' ' A' ' 70' ' ' ARG . 0.2 OUTLIER -68.31 143.59 55.14 Favored 'General case' 0 C--N 1.307 -1.278 0 CA-C-O 121.53 0.681 . . . . 0.0 110.612 176.662 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.422 HG21 HD12 ' A' ' 44' ' ' LEU . 25.1 mm -90.26 122.94 42.18 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.468 0 CA-C-O 121.055 0.455 . . . . 0.0 110.866 -178.148 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.414 ' O ' ' HB2' ' A' ' 75' ' ' HIS . . . -96.04 163.12 13.26 Favored 'General case' 0 N--CA 1.436 -1.153 0 N-CA-C 109.701 -0.481 . . . . 0.0 109.701 178.8 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 73' ' ' ASP . . . . . 0.434 ' HB3' ' HB3' ' A' ' 45' ' ' LYS . 36.5 m-20 -68.53 -24.07 64.6 Favored 'General case' 0 C--N 1.31 -1.113 0 CA-C-O 121.645 0.736 . . . . 0.0 110.547 -179.644 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 12.0 m-80 -97.4 8.45 44.56 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.725 -0.67 . . . . 0.0 109.956 -178.984 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 75' ' ' HIS . . . . . 0.539 ' O ' ' HB2' ' A' ' 44' ' ' LEU . 4.5 m170 -85.91 140.57 30.25 Favored 'General case' 0 CA--C 1.502 -0.887 0 CA-C-N 115.982 -0.554 . . . . 0.0 109.568 179.426 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 81.9 p -117.83 155.34 50.98 Favored Pre-proline 0 C--N 1.306 -1.317 0 C-N-CA 120.945 -0.302 . . . . 0.0 111.343 179.237 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -59.94 -40.97 57.47 Favored 'Trans proline' 0 C--N 1.347 0.453 0 C-N-CA 122.756 2.304 . . . . 0.0 111.625 179.517 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 78' ' ' LYS . . . . . 0.493 ' HG3' ' N ' ' A' ' 79' ' ' GLU . 35.2 pttt -67.04 -37.21 83.7 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.204 0.525 . . . . 0.0 110.813 -178.775 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 79' ' ' GLU . . . . . 0.493 ' N ' ' HG3' ' A' ' 78' ' ' LYS . 23.6 mm-40 -72.3 -41.82 66.19 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-O 121.007 0.432 . . . . 0.0 111.051 -179.128 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.445 HD21 ' CG ' ' A' ' 75' ' ' HIS . 4.6 mt -77.21 -9.1 58.57 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.068 0.461 . . . . 0.0 111.123 -178.885 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 82.42 44.05 7.62 Favored Glycine 0 C--O 1.237 0.323 0 C-N-CA 120.739 -0.743 . . . . 0.0 113.004 178.121 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 55.3 mtt -103.62 162.71 12.83 Favored 'General case' 0 C--N 1.317 -0.843 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 178.414 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -143.45 -165.43 2.09 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 121.06 0.457 . . . . 0.0 111.017 178.934 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.475 ' HA ' ' HB ' ' A' ' 22' ' ' ILE . 9.0 pt-20 -68.55 117.41 10.26 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-O 121.737 0.779 . . . . 0.0 112.743 -177.454 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 11.3 tt0 82.07 14.46 0.51 Allowed 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 125.435 1.494 . . . . 0.0 110.944 175.851 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -62.44 166.57 5.01 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-N 115.54 -0.755 . . . . 0.0 110.445 176.423 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 87' ' ' VAL . . . . . 0.466 ' HA ' ' O ' ' A' ' 25' ' ' LYS . 10.4 p -126.9 146.02 33.51 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.072 0 CA-C-O 121.451 0.643 . . . . 0.0 111.897 -175.925 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 3.6 mp -116.05 153.76 17.63 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.752 0 N-CA-C 108.764 -0.828 . . . . 0.0 108.764 177.507 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 13.5 tp10 -106.15 137.9 43.28 Favored 'General case' 0 C--N 1.319 -0.723 0 O-C-N 122.073 -0.392 . . . . 0.0 110.83 -176.822 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 90' ' ' VAL . . . . . 0.553 ' HA ' ' O ' ' A' ' 63' ' ' ARG . 95.2 t -127.31 131.8 70.13 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-O 121.251 0.548 . . . . 0.0 111.553 178.85 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 63.9 m-85 -116.13 174.95 5.77 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.101 -0.5 . . . . 0.0 109.829 179.461 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 10.2 tp60 -103.06 128.17 50.04 Favored 'General case' 0 C--N 1.312 -1.038 0 N-CA-C 110.058 -0.349 . . . . 0.0 110.058 178.047 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 93' ' ' GLU . . . . . 0.434 ' HB3' ' CG ' ' A' ' 63' ' ' ARG . 11.6 pt-20 . . . . . 0 C--N 1.33 -0.241 0 CA-C-O 121.151 0.5 . . . . 0.0 110.9 177.904 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' ILE . . . . . 0.411 ' HB ' ' HA ' ' A' ' 84' ' ' GLU . 26.3 pt . . . . . 0 N--CA 1.44 -0.975 0 N-CA-C 109.233 -0.655 . . . . 0.0 109.233 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 16.2 mtmt -113.66 142.81 45.56 Favored 'General case' 0 C--N 1.293 -1.869 0 N-CA-C 109.384 -0.599 . . . . 0.0 109.384 -178.174 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.401 HD13 ' CG2' ' A' ' 38' ' ' VAL . 5.6 mp -137.83 159.72 41.22 Favored 'General case' 0 C--N 1.302 -1.491 0 CA-C-O 121.216 0.531 . . . . 0.0 110.851 174.605 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.539 ' HG3' ' CD2' ' A' ' 35' ' ' HIS . 3.1 tmmt? -131.63 143.87 50.63 Favored 'General case' 0 N--CA 1.433 -1.299 0 CA-C-O 121.259 0.552 . . . . 0.0 110.638 -179.592 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.536 HG11 ' CD1' ' A' ' 51' ' ' TYR . 0.9 OUTLIER -112.06 141.06 28.72 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.429 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.182 178.672 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.426 HD11 ' NZ ' ' A' ' 25' ' ' LYS . 41.6 mm -106.46 115.84 48.92 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.133 0 N-CA-C 107.641 -1.244 . . . . 0.0 107.641 175.214 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 28' ' ' GLY . . . . . 0.441 ' HA2' ' HB ' ' A' ' 90' ' ' VAL . . . -86.14 169.47 41.99 Favored Glycine 0 N--CA 1.416 -2.651 0 C-N-CA 120.302 -0.951 . . . . 0.0 111.689 -177.008 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.25 -22.15 66.84 Favored 'General case' 0 C--N 1.299 -1.604 0 CA-C-O 121.634 0.73 . . . . 0.0 110.579 178.671 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -102.25 14.63 31.45 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.506 -0.77 . . . . 0.0 109.44 -179.338 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 46.2 m 69.99 19.71 6.8 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 115.574 -0.739 . . . . 0.0 111.005 179.812 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 11.1 t -76.71 114.55 15.58 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.172 178.86 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.45 ' HA ' ' O ' ' A' ' 26' ' ' VAL . 24.1 mt-10 -90.01 113.44 25.12 Favored 'General case' 0 CA--C 1.502 -0.896 0 CA-C-O 121.159 0.504 . . . . 0.0 110.696 177.614 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 30.1 mm -102.59 130.07 53.14 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.909 0 N-CA-C 108.152 -1.055 . . . . 0.0 108.152 176.378 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' HIS . . . . . 0.539 ' CD2' ' HG3' ' A' ' 25' ' ' LYS . 11.0 m170 -117.55 116.25 26.73 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 -177.148 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.518 ' HZ ' HG23 ' A' ' 26' ' ' VAL . 0.9 OUTLIER -129.28 170.08 14.06 Favored 'General case' 0 C--N 1.304 -1.397 0 CA-C-O 121.18 0.514 . . . . 0.0 111.452 -175.254 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 61.1 mmtt -121.44 121.64 38.0 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 -178.798 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.435 HG21 HD12 ' A' ' 47' ' ' LEU . 33.0 m -139.84 156.13 25.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-O 120.93 0.395 . . . . 0.0 110.439 179.545 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.527 ' O ' HG22 ' A' ' 42' ' ' THR . 79.2 tttt -86.55 163.13 17.65 Favored 'General case' 0 C--N 1.314 -0.94 0 O-C-N 121.964 -0.46 . . . . 0.0 110.794 -178.732 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 40' ' ' MET . . . . . 0.483 ' O ' ' HG2' ' A' ' 78' ' ' LYS . 0.0 OUTLIER -71.89 -37.93 70.07 Favored 'General case' 0 CA--C 1.519 -0.238 0 N-CA-C 112.234 0.457 . . . . 0.0 112.234 -177.026 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 14.9 t -92.71 15.11 15.23 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-O 121.343 0.592 . . . . 0.0 111.608 -177.027 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' THR . . . . . 0.527 HG22 ' O ' ' A' ' 39' ' ' LYS . 2.3 t -96.48 169.74 9.7 Favored 'General case' 0 C--N 1.32 -0.684 0 O-C-N 121.485 -0.76 . . . . 0.0 110.224 -179.267 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 29.8 m170 -85.81 142.24 29.07 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-O 121.4 0.619 . . . . 0.0 111.163 179.535 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.611 ' HB2' ' O ' ' A' ' 75' ' ' HIS . 0.2 OUTLIER -69.21 -17.16 63.75 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.559 -0.746 . . . . 0.0 109.686 -179.115 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.659 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -53.88 -45.65 71.13 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-N 115.728 -0.669 . . . . 0.0 112.602 -177.9 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.536 ' O ' ' HB2' ' A' ' 50' ' ' SER . 0.1 OUTLIER -69.89 -25.02 63.49 Favored 'General case' 0 C--O 1.219 -0.536 0 CA-C-O 121.297 0.57 . . . . 0.0 110.795 -178.266 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.558 ' HB3' HD13 ' A' ' 44' ' ' LEU . 7.8 tt -73.4 -47.29 43.14 Favored 'General case' 0 C--N 1.312 -1.062 0 CA-C-N 115.927 -0.579 . . . . 0.0 109.776 177.282 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.598 ' HG3' ' O ' ' A' ' 44' ' ' LEU . 26.7 mtpt -57.81 -47.59 82.16 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.605 -179.277 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.659 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 5.0 pt-20 -69.97 -34.52 73.5 Favored 'General case' 0 C--N 1.313 -0.981 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.446 -179.058 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 50' ' ' SER . . . . . 0.536 ' HB2' ' O ' ' A' ' 46' ' ' LYS . 7.9 t -65.63 -43.88 88.17 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.351 -177.682 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.536 ' CD1' HG11 ' A' ' 26' ' ' VAL . 1.7 p90 -76.51 -33.7 58.62 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 119.727 -0.789 . . . . 0.0 110.531 -178.593 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 52' ' ' CYS . . . . . 0.507 ' SG ' HD11 ' A' ' 62' ' ' LEU . 98.6 m -62.54 -44.54 96.1 Favored 'General case' 0 C--O 1.239 0.545 0 CA-C-O 121.252 0.549 . . . . 0.0 110.657 179.327 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 14.0 pt20 -69.28 -33.78 73.73 Favored 'General case' 0 N--CA 1.442 -0.832 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.508 -179.228 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 2.1 mmp_? -57.47 -40.05 77.72 Favored 'General case' 0 C--N 1.349 0.569 0 CA-C-O 121.179 0.514 . . . . 0.0 111.377 177.625 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 33.2 mt-30 -78.1 -20.96 51.17 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.236 0.541 . . . . 0.0 110.964 -179.819 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 82.86 29.1 35.83 Favored Glycine 0 N--CA 1.445 -0.72 0 C-N-CA 120.896 -0.668 . . . . 0.0 112.138 -179.542 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 34.6 m -128.39 150.85 75.44 Favored Pre-proline 0 C--N 1.325 -0.467 0 N-CA-C 110.211 -0.292 . . . . 0.0 110.211 -179.826 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' PRO . . . . . 0.582 ' HG2' ' OG ' ' A' ' 61' ' ' SER . 31.1 Cg_endo -70.61 152.84 65.18 Favored 'Trans proline' 0 N--CA 1.455 -0.755 0 C-N-CA 122.212 1.941 . . . . 0.0 112.212 179.349 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.41 ' HG2' ' SG ' ' A' ' 52' ' ' CYS . 81.2 mtp -68.65 -10.19 54.59 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 121.092 0.472 . . . . 0.0 111.729 -176.532 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 60' ' ' ASN . . . . . 0.512 ' OD1' ' HB2' ' A' ' 58' ' ' PRO . 2.1 p-10 -91.16 -11.99 36.78 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-O 121.137 0.494 . . . . 0.0 111.114 -179.991 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.582 ' OG ' ' HG2' ' A' ' 58' ' ' PRO . 74.9 m -83.21 -23.6 32.76 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-O 121.088 0.47 . . . . 0.0 111.87 -178.481 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.507 HD11 ' SG ' ' A' ' 52' ' ' CYS . 1.1 pp -124.65 171.79 9.77 Favored 'General case' 0 C--N 1.305 -1.369 0 N-CA-C 113.117 0.784 . . . . 0.0 113.117 -175.796 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.457 ' O ' ' HA ' ' A' ' 90' ' ' VAL . 51.3 mtm180 -121.11 113.88 20.65 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.584 -0.735 . . . . 0.0 110.851 -177.375 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -98.21 116.41 30.36 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-O 121.194 0.521 . . . . 0.0 111.513 179.943 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.495 HD11 ' HG2' ' A' ' 89' ' ' GLU . 0.0 OUTLIER -147.06 166.51 26.65 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 121.186 0.517 . . . . 0.0 110.597 178.956 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 83.0 t80 -147.38 136.13 22.02 Favored 'General case' 0 C--N 1.31 -1.141 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 177.672 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.454 ' HG2' HE21 ' A' ' 69' ' ' GLN . 7.0 pt-20 51.58 26.8 3.51 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 124.31 1.044 . . . . 0.0 112.028 -179.869 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 84.37 22.57 53.88 Favored Glycine 0 N--CA 1.448 -0.535 0 C-N-CA 120.808 -0.71 . . . . 0.0 112.611 -179.145 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' GLN . . . . . 0.454 HE21 ' HG2' ' A' ' 67' ' ' GLU . 2.5 pt20 -128.82 134.27 48.29 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 179.57 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 15.4 ptt180 -68.2 146.98 52.88 Favored 'General case' 0 C--N 1.306 -1.309 0 CA-C-O 121.368 0.604 . . . . 0.0 111.038 178.443 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.459 HG21 HD12 ' A' ' 44' ' ' LEU . 21.8 mm -94.65 117.54 38.63 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.13 0 CA-C-O 121.147 0.498 . . . . 0.0 110.041 179.11 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -95.78 160.99 14.21 Favored 'General case' 0 N--CA 1.435 -1.195 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 179.71 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 73' ' ' ASP . . . . . 0.432 ' CA ' ' HB3' ' A' ' 45' ' ' LYS . 55.1 m-20 -65.33 -22.99 66.89 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-O 121.665 0.745 . . . . 0.0 110.646 -179.511 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 12.4 m-80 -97.07 4.55 51.31 Favored 'General case' 0 C--N 1.311 -1.08 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.132 -178.08 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 75' ' ' HIS . . . . . 0.611 ' O ' ' HB2' ' A' ' 44' ' ' LEU . 4.8 m170 -83.68 146.7 28.09 Favored 'General case' 0 CA--C 1.508 -0.65 0 N-CA-C 109.43 -0.581 . . . . 0.0 109.43 178.874 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.417 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 59.7 p -120.24 155.11 56.26 Favored Pre-proline 0 C--N 1.311 -1.069 0 C-N-CA 120.867 -0.333 . . . . 0.0 111.012 178.3 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -59.22 -40.21 71.24 Favored 'Trans proline' 0 N--CA 1.461 -0.438 0 C-N-CA 122.607 2.205 . . . . 0.0 111.693 179.557 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 78' ' ' LYS . . . . . 0.483 ' HG2' ' O ' ' A' ' 40' ' ' MET . 0.0 OUTLIER -69.47 -36.2 76.34 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.852 0.358 . . . . 0.0 111.617 -178.042 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -74.93 -35.28 62.18 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.882 0.372 . . . . 0.0 111.246 -179.055 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.434 HD21 ' CG ' ' A' ' 75' ' ' HIS . 5.5 mt -80.55 -0.76 39.09 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.245 0.545 . . . . 0.0 110.819 179.728 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 76.36 45.76 13.85 Favored Glycine 0 CA--C 1.509 -0.317 0 CA-C-N 116.062 -0.517 . . . . 0.0 112.794 177.6 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 59.6 mtt -106.37 164.65 11.86 Favored 'General case' 0 C--N 1.311 -1.082 0 O-C-N 122.522 -0.399 . . . . 0.0 110.255 179.422 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 83' ' ' GLU . . . . . 0.451 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 10.0 pt-20 -141.16 -166.24 2.13 Favored 'General case' 0 C--N 1.316 -0.885 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 177.584 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.422 ' O ' ' HB2' ' A' ' 85' ' ' GLU . 6.9 pt-20 -72.93 141.52 47.83 Favored 'General case' 0 N--CA 1.444 -0.774 0 C-N-CA 120.363 -0.535 . . . . 0.0 109.801 177.747 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 85' ' ' GLU . . . . . 0.422 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 66.5 mm-40 72.87 4.92 5.1 Favored 'General case' 0 C--N 1.32 -0.682 0 C-N-CA 123.722 0.809 . . . . 0.0 111.848 -179.109 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 86' ' ' ASP . . . . . 0.451 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 2.3 t70 -60.8 155.41 19.49 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 121.139 0.495 . . . . 0.0 110.179 176.862 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 87' ' ' VAL . . . . . 0.471 ' HA ' ' O ' ' A' ' 25' ' ' LYS . 8.8 p -125.94 141.78 44.61 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.497 0 CA-C-O 121.406 0.622 . . . . 0.0 111.265 -177.011 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 3.7 mp -110.24 152.52 12.23 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.884 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 179.029 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 89' ' ' GLU . . . . . 0.495 ' HG2' HD11 ' A' ' 65' ' ' LEU . 3.0 tt0 -103.32 130.9 50.71 Favored 'General case' 0 C--N 1.309 -1.153 0 CA-C-O 121.296 0.57 . . . . 0.0 111.127 -175.507 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 90' ' ' VAL . . . . . 0.457 ' HA ' ' O ' ' A' ' 63' ' ' ARG . 60.6 t -126.73 132.94 69.6 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.948 0 CA-C-O 121.588 0.708 . . . . 0.0 111.242 179.959 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 91' ' ' TYR . . . . . 0.417 ' HB2' ' HB2' ' A' ' 63' ' ' ARG . 76.3 m-85 -116.78 -178.22 3.38 Favored 'General case' 0 C--N 1.309 -1.182 0 CA-C-N 115.639 -0.71 . . . . 0.0 109.724 177.639 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 9.3 tp60 -109.66 145.63 36.18 Favored 'General case' 0 C--N 1.313 -0.982 0 N-CA-C 109.779 -0.452 . . . . 0.0 109.779 179.676 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 . . . . . 0 C--N 1.327 -0.37 0 CA-C-O 121.346 0.593 . . . . 0.0 110.296 175.57 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 24.0 pt . . . . . 0 N--CA 1.446 -0.627 0 CA-C-O 121.372 0.605 . . . . 0.0 109.714 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 11.6 mtmt -114.61 144.46 43.36 Favored 'General case' 0 C--N 1.294 -1.805 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 -178.74 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.9 mp -139.05 161.3 37.72 Favored 'General case' 0 C--N 1.301 -1.52 0 CA-C-O 121.339 0.59 . . . . 0.0 110.945 175.051 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.437 ' O ' ' HA ' ' A' ' 87' ' ' VAL . 5.6 tmmm? -130.22 142.37 50.57 Favored 'General case' 0 N--CA 1.438 -1.043 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.377 -179.43 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.533 HG23 ' HZ ' ' A' ' 36' ' ' PHE . 0.9 OUTLIER -113.14 142.35 25.85 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.411 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.392 179.844 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 45.0 mm -103.82 113.36 40.49 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.251 0 N-CA-C 107.381 -1.34 . . . . 0.0 107.381 175.147 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -74.64 -177.56 38.74 Favored Glycine 0 N--CA 1.432 -1.598 0 C-N-CA 120.755 -0.736 . . . . 0.0 113.105 -175.649 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.65 ' H ' ' CD ' ' A' ' 29' ' ' GLN . 0.0 OUTLIER -70.0 -26.21 63.97 Favored 'General case' 0 C--N 1.305 -1.367 0 N-CA-C 108.532 -0.914 . . . . 0.0 108.532 -178.672 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 37.0 t70 -102.83 12.51 36.1 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 114.868 -1.06 . . . . 0.0 108.47 177.09 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 49.9 m 71.15 20.66 5.07 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 114.974 -1.012 . . . . 0.0 110.905 -179.141 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 8.2 t -67.7 120.56 14.27 Favored 'General case' 0 N--CA 1.447 -0.597 0 N-CA-C 108.779 -0.823 . . . . 0.0 108.779 177.711 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.524 ' HA ' ' O ' ' A' ' 26' ' ' VAL . 46.5 mt-10 -89.15 108.97 19.9 Favored 'General case' 0 C--N 1.313 -0.986 0 CA-C-O 121.338 0.59 . . . . 0.0 111.217 -178.138 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 38.9 mm -98.54 136.85 27.89 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.562 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 177.68 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 11.7 m170 -117.34 133.31 56.12 Favored 'General case' 0 C--N 1.316 -0.854 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 -178.388 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.533 ' HZ ' HG23 ' A' ' 26' ' ' VAL . 1.7 p90 -147.2 170.35 17.42 Favored 'General case' 0 C--N 1.309 -1.178 0 CA-C-O 121.376 0.608 . . . . 0.0 111.607 -178.35 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 15.1 ptpt -130.7 119.91 23.08 Favored 'General case' 0 C--N 1.314 -0.975 0 CA-C-N 115.584 -0.734 . . . . 0.0 111.027 -178.543 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.426 HG21 HD12 ' A' ' 47' ' ' LEU . 24.4 m -139.84 159.57 27.0 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 116.23 -0.441 . . . . 0.0 109.968 -179.26 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 25.9 mtpp -77.11 176.17 8.96 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-O 121.342 0.592 . . . . 0.0 111.18 179.347 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.5 -35.79 19.39 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.874 178.323 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 13.8 t -93.8 10.52 32.78 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 121.292 0.567 . . . . 0.0 111.607 -176.181 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 7.2 t -94.74 173.65 7.5 Favored 'General case' 0 C--N 1.32 -0.698 0 O-C-N 121.779 -0.575 . . . . 0.0 110.201 -179.617 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 4.8 m-70 -90.4 147.72 23.26 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 121.637 0.732 . . . . 0.0 111.611 -179.101 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.492 ' O ' ' HG2' ' A' ' 48' ' ' LYS . 1.3 mm? -70.23 -13.22 62.08 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.426 -0.806 . . . . 0.0 110.707 178.754 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.542 ' HB3' ' HB2' ' A' ' 73' ' ' ASP . 0.0 OUTLIER -54.26 -43.23 70.77 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.986 -178.899 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -71.19 -33.35 69.88 Favored 'General case' 0 C--O 1.2 -1.536 0 CA-C-O 121.069 0.461 . . . . 0.0 110.443 178.918 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.426 HD12 HG21 ' A' ' 38' ' ' VAL . 9.4 tt -69.14 -50.96 43.16 Favored 'General case' 0 C--N 1.309 -1.187 0 CA-C-O 121.105 0.479 . . . . 0.0 110.793 -178.855 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.492 ' HG2' ' O ' ' A' ' 44' ' ' LEU . 4.5 ptmm? -62.17 -40.62 96.61 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.542 -178.966 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.7 -32.86 68.26 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.11 0.481 . . . . 0.0 110.468 177.986 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 50' ' ' SER . . . . . 0.651 ' O ' ' HG2' ' A' ' 54' ' ' ARG . 5.3 m -68.81 -40.98 79.24 Favored 'General case' 0 N--CA 1.45 -0.445 0 N-CA-C 112.52 0.563 . . . . 0.0 112.52 -177.822 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.475 ' CD1' HG11 ' A' ' 26' ' ' VAL . 2.0 p90 -76.45 -33.06 58.76 Favored 'General case' 0 C--N 1.317 -0.809 0 C-N-CA 119.005 -1.078 . . . . 0.0 110.203 179.352 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 52' ' ' CYS . . . . . 0.615 ' SG ' HD11 ' A' ' 62' ' ' LEU . 92.0 m -61.37 -45.65 93.47 Favored 'General case' 0 CA--C 1.511 -0.521 0 CA-C-O 121.221 0.534 . . . . 0.0 110.19 178.597 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -65.44 -35.67 81.61 Favored 'General case' 0 N--CA 1.442 -0.845 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.536 -179.663 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.651 ' HG2' ' O ' ' A' ' 50' ' ' SER . 41.9 mmt-85 -57.36 -39.1 75.26 Favored 'General case' 0 C--N 1.348 0.524 0 CA-C-O 121.123 0.487 . . . . 0.0 111.388 177.327 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 30.5 mt-30 -78.53 -21.78 48.3 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-O 120.958 0.408 . . . . 0.0 110.783 179.859 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 82.9 29.74 33.85 Favored Glycine 0 N--CA 1.442 -0.931 0 C-N-CA 120.434 -0.888 . . . . 0.0 111.727 179.348 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 35.9 m -130.43 148.26 69.2 Favored Pre-proline 0 C--N 1.323 -0.584 0 O-C-N 122.454 -0.439 . . . . 0.0 110.645 -178.969 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 29.1 Cg_endo -65.78 150.73 85.79 Favored 'Trans proline' 0 N--CA 1.458 -0.602 0 C-N-CA 122.27 1.98 . . . . 0.0 111.72 177.971 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 73.6 mtp -67.49 -7.79 28.51 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-N 116.113 -0.494 . . . . 0.0 112.236 -176.661 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 24.2 p30 -90.41 -12.19 38.22 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 121.387 0.613 . . . . 0.0 111.162 -179.194 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 68.1 m -84.94 -20.32 30.82 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.775 -179.906 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.615 HD11 ' SG ' ' A' ' 52' ' ' CYS . 1.4 pp -136.66 157.44 46.75 Favored 'General case' 0 C--N 1.31 -1.115 0 CA-C-O 121.71 0.767 . . . . 0.0 113.027 -176.545 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.439 ' HG3' ' HB2' ' A' ' 91' ' ' TYR . 1.2 ptp180 -115.68 138.1 51.43 Favored 'General case' 0 C--N 1.314 -0.953 0 CA-C-N 115.049 -0.978 . . . . 0.0 112.376 179.224 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.444 ' CZ ' ' HE2' ' A' ' 48' ' ' LYS . 0.1 OUTLIER -114.14 120.84 41.88 Favored 'General case' 0 C--N 1.313 -0.979 0 CA-C-N 114.983 -1.008 . . . . 0.0 110.541 -176.968 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.453 ' C ' HD22 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -142.94 164.76 29.21 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.33 0.586 . . . . 0.0 111.043 179.298 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 92.3 t80 -147.05 135.33 21.69 Favored 'General case' 0 C--N 1.314 -0.952 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 178.918 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.447 ' HG2' HE21 ' A' ' 69' ' ' GLN . 6.6 pt-20 49.33 26.3 1.54 Allowed 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 124.406 1.082 . . . . 0.0 112.549 -179.17 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 87.57 21.76 46.42 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.913 -0.661 . . . . 0.0 112.934 -179.082 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' GLN . . . . . 0.447 HE21 ' HG2' ' A' ' 67' ' ' GLU . 2.7 pt20 -129.93 136.78 49.87 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 109.365 -0.606 . . . . 0.0 109.365 -179.808 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 3.1 ptt180 -68.67 147.5 51.78 Favored 'General case' 0 C--N 1.308 -1.231 0 CA-C-O 121.585 0.707 . . . . 0.0 111.02 177.671 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 21.8 mm -97.52 118.55 44.19 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.227 0 N-CA-C 109.708 -0.478 . . . . 0.0 109.708 179.014 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -103.28 167.05 10.06 Favored 'General case' 0 N--CA 1.442 -0.864 0 CA-C-O 120.881 0.372 . . . . 0.0 110.211 -178.854 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 73' ' ' ASP . . . . . 0.542 ' HB2' ' HB3' ' A' ' 45' ' ' LYS . 8.6 p-10 -66.6 -22.06 66.13 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.779 -178.236 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 9.2 m-80 -98.93 1.78 45.91 Favored 'General case' 0 CA--C 1.51 -0.568 0 CA-C-O 121.238 0.542 . . . . 0.0 110.205 -178.553 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 75' ' ' HIS . . . . . 0.45 ' CG ' HD21 ' A' ' 80' ' ' LEU . 3.2 m170 -81.06 141.72 34.06 Favored 'General case' 0 C--N 1.318 -0.799 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 179.714 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.426 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 70.2 p -116.64 153.58 49.1 Favored Pre-proline 0 C--N 1.307 -1.245 0 C-N-CA 121.072 -0.251 . . . . 0.0 110.675 179.242 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_exo -61.36 -37.75 69.95 Favored 'Trans proline' 0 N--CA 1.459 -0.549 0 C-N-CA 122.463 2.109 . . . . 0.0 111.557 179.796 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 78' ' ' LYS . . . . . 0.515 ' HG3' ' N ' ' A' ' 79' ' ' GLU . 33.1 pttt -68.83 -38.65 79.97 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.92 -178.713 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 79' ' ' GLU . . . . . 0.515 ' N ' ' HG3' ' A' ' 78' ' ' LYS . 11.8 mm-40 -72.74 -38.29 67.44 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-O 120.953 0.406 . . . . 0.0 111.098 -178.808 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.45 HD21 ' CG ' ' A' ' 75' ' ' HIS . 5.2 mt -76.46 -6.79 53.29 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-O 121.485 0.66 . . . . 0.0 110.468 179.39 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 79.44 43.08 10.74 Favored Glycine 0 N--CA 1.452 -0.258 0 CA-C-N 115.905 -0.588 . . . . 0.0 112.954 177.201 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 60.6 mtt -102.82 165.6 10.96 Favored 'General case' 0 C--N 1.314 -0.937 0 N-CA-C 109.835 -0.431 . . . . 0.0 109.835 179.126 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -142.66 -171.45 3.43 Favored 'General case' 0 C--N 1.314 -0.952 0 N-CA-C 109.37 -0.604 . . . . 0.0 109.37 177.663 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -71.24 139.01 49.91 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-O 121.435 0.636 . . . . 0.0 111.145 -178.845 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 17.7 tp10 74.51 5.72 4.53 Favored 'General case' 0 C--N 1.321 -0.659 0 C-N-CA 125.012 1.325 . . . . 0.0 111.761 179.229 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -66.22 165.91 12.95 Favored 'General case' 0 C--O 1.238 0.475 0 CA-C-O 121.05 0.452 . . . . 0.0 110.763 176.941 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 87' ' ' VAL . . . . . 0.437 ' HA ' ' O ' ' A' ' 25' ' ' LYS . 14.9 p -127.55 145.18 35.37 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.876 0 CA-C-O 121.443 0.64 . . . . 0.0 112.054 -175.299 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 3.6 mp -115.56 152.86 17.17 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 177.527 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 -107.19 138.19 43.84 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.038 0.447 . . . . 0.0 110.601 -175.981 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 84.9 t -129.74 137.38 56.85 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.75 0 CA-C-O 121.299 0.571 . . . . 0.0 111.351 -179.3 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 91' ' ' TYR . . . . . 0.439 ' HB2' ' HG3' ' A' ' 63' ' ' ARG . 96.5 m-85 -123.77 167.09 14.49 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.09 178.802 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 7.0 tp60 -95.39 139.01 32.29 Favored 'General case' 0 C--N 1.31 -1.113 0 N-CA-C 109.841 -0.429 . . . . 0.0 109.841 -179.654 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 . . . . . 0 C--N 1.324 -0.518 0 CA-C-O 121.366 0.603 . . . . 0.0 110.281 176.911 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 26.3 pt . . . . . 0 N--CA 1.447 -0.61 0 CA-C-O 121.463 0.649 . . . . 0.0 110.593 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 3.7 mtmt -120.1 141.95 49.34 Favored 'General case' 0 C--N 1.299 -1.599 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 -179.271 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.4 mp -136.02 162.51 32.68 Favored 'General case' 0 C--N 1.305 -1.361 0 CA-C-O 121.283 0.563 . . . . 0.0 111.02 177.218 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.418 ' O ' ' HA ' ' A' ' 87' ' ' VAL . 4.9 tmmm? -131.4 142.54 50.06 Favored 'General case' 0 N--CA 1.437 -1.092 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.386 -179.114 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.515 HG23 ' HZ ' ' A' ' 36' ' ' PHE . 0.9 OUTLIER -113.13 142.05 26.83 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.447 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.232 179.892 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.458 ' O ' ' HB ' ' A' ' 90' ' ' VAL . 43.7 mm -104.32 115.54 46.44 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.952 0 N-CA-C 107.373 -1.343 . . . . 0.0 107.373 175.373 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -78.85 179.09 52.97 Favored Glycine 0 N--CA 1.431 -1.669 0 C-N-CA 120.795 -0.717 . . . . 0.0 113.138 -175.683 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.608 ' H ' ' CD ' ' A' ' 29' ' ' GLN . 0.0 OUTLIER -74.7 -22.26 58.94 Favored 'General case' 0 N--CA 1.436 -1.167 0 CA-C-O 121.996 0.903 . . . . 0.0 108.73 -178.105 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -102.62 12.57 36.19 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.032 -0.985 . . . . 0.0 108.525 176.171 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 37.1 t 73.36 18.09 3.76 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 115.174 -0.921 . . . . 0.0 110.418 -179.541 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 7.9 t -70.44 116.57 10.92 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 179.058 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.493 ' HA ' ' O ' ' A' ' 26' ' ' VAL . 37.0 mt-10 -87.76 110.59 20.57 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-O 121.144 0.497 . . . . 0.0 110.484 179.979 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 32.1 mm -98.57 139.04 21.4 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.573 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 178.235 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 10.1 m170 -119.37 131.73 55.73 Favored 'General case' 0 C--N 1.315 -0.905 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 -178.962 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.515 ' HZ ' HG23 ' A' ' 26' ' ' VAL . 1.4 p90 -146.88 173.42 12.42 Favored 'General case' 0 C--N 1.309 -1.167 0 CA-C-O 121.15 0.5 . . . . 0.0 110.862 -178.463 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 17.6 ptpt -134.29 120.65 20.22 Favored 'General case' 0 C--N 1.314 -0.951 0 CA-C-O 121.191 0.519 . . . . 0.0 111.137 -179.144 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 26.3 m -137.97 162.47 31.26 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 N-CA-C 109.406 -0.59 . . . . 0.0 109.406 -179.743 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.512 ' O ' HG22 ' A' ' 42' ' ' THR . 40.6 tttp -86.79 163.26 17.36 Favored 'General case' 0 C--N 1.313 -0.988 0 O-C-N 121.519 -0.738 . . . . 0.0 110.947 -179.596 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 40' ' ' MET . . . . . 0.401 ' H ' ' HG2' ' A' ' 39' ' ' LYS . 0.0 OUTLIER -65.82 -41.72 91.49 Favored 'General case' 0 CA--C 1.517 -0.298 0 N-CA-C 112.79 0.663 . . . . 0.0 112.79 -177.808 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 11.9 t -96.11 13.14 28.22 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-O 121.068 0.461 . . . . 0.0 112.113 -174.988 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' THR . . . . . 0.512 HG22 ' O ' ' A' ' 39' ' ' LYS . 2.0 t -91.03 161.88 14.94 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 179.666 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 43' ' ' HIS . . . . . 0.428 ' O ' ' HG2' ' A' ' 46' ' ' LYS . 42.5 m170 -75.06 138.86 42.44 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-O 121.589 0.709 . . . . 0.0 111.572 -179.979 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.634 HD13 ' HB3' ' A' ' 47' ' ' LEU . 0.2 OUTLIER -67.94 -15.4 63.59 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.219 -0.901 . . . . 0.0 109.972 -179.02 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.679 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -53.35 -45.97 69.36 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.844 -0.616 . . . . 0.0 112.433 -177.952 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.428 ' HG2' ' O ' ' A' ' 43' ' ' HIS . 21.8 ptmt -65.82 -29.37 69.83 Favored 'General case' 0 C--O 1.218 -0.562 0 CA-C-O 121.345 0.593 . . . . 0.0 110.579 -178.528 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.634 ' HB3' HD13 ' A' ' 44' ' ' LEU . 7.7 tt -72.97 -46.47 52.16 Favored 'General case' 0 C--N 1.311 -1.076 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.925 -179.596 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.607 ' HG3' ' O ' ' A' ' 44' ' ' LEU . 26.8 mtpt -58.29 -48.79 79.37 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-O 121.512 0.672 . . . . 0.0 110.185 -179.142 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.679 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 7.0 pt-20 -71.16 -31.32 67.53 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.976 -178.793 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 50' ' ' SER . . . . . 0.45 ' O ' ' HG2' ' A' ' 54' ' ' ARG . 38.0 t -65.44 -45.69 82.84 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.979 0.419 . . . . 0.0 111.283 -179.811 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.495 ' CD1' HG11 ' A' ' 26' ' ' VAL . 2.1 p90 -76.47 -32.64 58.49 Favored 'General case' 0 N--CA 1.443 -0.786 0 C-N-CA 119.86 -0.736 . . . . 0.0 110.539 -177.378 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 52' ' ' CYS . . . . . 0.488 ' SG ' ' HG2' ' A' ' 59' ' ' MET . 99.7 m -64.15 -44.15 92.99 Favored 'General case' 0 CA--C 1.509 -0.634 0 CA-C-O 121.105 0.479 . . . . 0.0 110.547 179.436 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 13.5 pt20 -67.73 -33.46 74.92 Favored 'General case' 0 N--CA 1.443 -0.779 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.274 -179.668 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.45 ' HG2' ' O ' ' A' ' 50' ' ' SER . 13.7 mmt180 -57.5 -38.16 74.17 Favored 'General case' 0 C--N 1.348 0.524 0 CA-C-O 121.018 0.437 . . . . 0.0 111.042 177.055 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 34.7 mt-30 -82.19 -22.47 35.96 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.968 -179.746 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 82.94 29.18 35.26 Favored Glycine 0 N--CA 1.443 -0.849 0 C-N-CA 120.548 -0.834 . . . . 0.0 111.886 -179.868 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 33.9 m -125.56 150.9 69.46 Favored Pre-proline 0 C--N 1.325 -0.467 0 O-C-N 122.45 -0.441 . . . . 0.0 110.649 -178.661 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' PRO . . . . . 0.502 ' HG2' ' OG ' ' A' ' 61' ' ' SER . 43.4 Cg_endo -71.01 149.9 59.74 Favored 'Trans proline' 0 N--CA 1.453 -0.871 0 C-N-CA 122.295 1.997 . . . . 0.0 111.856 177.277 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.488 ' HG2' ' SG ' ' A' ' 52' ' ' CYS . 80.6 mtp -70.1 -7.55 42.38 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.779 -177.279 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 31.3 p30 -89.12 -11.98 42.39 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.472 0.653 . . . . 0.0 110.968 179.272 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.502 ' OG ' ' HG2' ' A' ' 58' ' ' PRO . 70.3 m -90.81 -19.05 23.87 Favored 'General case' 0 N--CA 1.439 -0.986 0 N-CA-C 112.459 0.54 . . . . 0.0 112.459 -178.122 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.471 HD11 ' SG ' ' A' ' 52' ' ' CYS . 1.4 pp -128.09 167.89 16.13 Favored 'General case' 0 C--N 1.313 -1.0 0 N-CA-C 113.139 0.792 . . . . 0.0 113.139 -177.674 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.499 ' O ' ' HA ' ' A' ' 90' ' ' VAL . 35.6 mtm180 -118.66 118.29 31.26 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.261 -0.881 . . . . 0.0 110.669 -177.566 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -101.56 112.41 24.95 Favored 'General case' 0 C--N 1.312 -1.037 0 CA-C-O 121.134 0.492 . . . . 0.0 110.723 178.704 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.462 ' C ' HD22 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -141.52 164.62 29.73 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-O 121.528 0.68 . . . . 0.0 111.461 -179.377 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 88.3 t80 -144.77 133.81 22.68 Favored 'General case' 0 C--N 1.308 -1.198 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 177.733 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 49.36 29.59 2.85 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 124.264 1.025 . . . . 0.0 112.288 -178.884 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 87.26 16.28 60.94 Favored Glycine 0 N--CA 1.446 -0.681 0 C-N-CA 120.969 -0.634 . . . . 0.0 113.599 179.593 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 5.1 pt20 -125.86 135.73 52.28 Favored 'General case' 0 C--N 1.32 -0.698 0 O-C-N 122.254 -0.556 . . . . 0.0 109.623 -178.907 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.417 ' HD2' ' H ' ' A' ' 70' ' ' ARG . 0.2 OUTLIER -70.48 148.64 48.05 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-O 121.667 0.746 . . . . 0.0 110.379 177.792 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.486 HG21 HD12 ' A' ' 44' ' ' LEU . 23.4 mm -96.47 122.42 47.95 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.917 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.049 -179.278 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -95.31 166.07 12.07 Favored 'General case' 0 N--CA 1.436 -1.158 0 N-CA-C 109.697 -0.482 . . . . 0.0 109.697 -179.786 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 73' ' ' ASP . . . . . 0.422 ' CA ' ' HB3' ' A' ' 45' ' ' LYS . 11.8 p-10 -71.18 -21.04 62.21 Favored 'General case' 0 C--N 1.31 -1.121 0 CA-C-O 121.4 0.619 . . . . 0.0 110.773 -179.598 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 13.2 m-80 -98.73 4.0 47.71 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-O 121.175 0.512 . . . . 0.0 110.152 179.437 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' HIS . . . . . 0.601 ' O ' ' HB2' ' A' ' 44' ' ' LEU . 3.2 m170 -83.16 146.52 28.59 Favored 'General case' 0 CA--C 1.503 -0.862 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 -179.875 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.499 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 69.0 p -122.25 155.89 61.1 Favored Pre-proline 0 C--N 1.306 -1.308 0 C-N-CA 121.041 -0.264 . . . . 0.0 110.976 178.53 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -60.79 -41.67 44.26 Favored 'Trans proline' 0 N--CA 1.459 -0.533 0 C-N-CA 122.418 2.079 . . . . 0.0 111.01 179.619 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 78' ' ' LYS . . . . . 0.525 ' HG3' ' N ' ' A' ' 79' ' ' GLU . 44.6 pttt -65.28 -41.56 94.04 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.106 -178.618 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 79' ' ' GLU . . . . . 0.525 ' N ' ' HG3' ' A' ' 78' ' ' LYS . 60.2 mm-40 -71.2 -36.14 71.81 Favored 'General case' 0 N--CA 1.445 -0.725 0 CA-C-O 120.999 0.428 . . . . 0.0 111.176 -177.661 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.499 ' HG ' ' O ' ' A' ' 76' ' ' THR . 5.9 mt -79.22 -6.05 55.71 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.202 0.525 . . . . 0.0 110.908 179.922 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 83.14 42.37 8.07 Favored Glycine 0 N--CA 1.454 -0.16 0 C-N-CA 121.032 -0.604 . . . . 0.0 113.027 177.855 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 61.1 mtt -103.59 165.89 10.76 Favored 'General case' 0 C--N 1.315 -0.914 0 O-C-N 122.314 -0.521 . . . . 0.0 109.885 178.775 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 83' ' ' GLU . . . . . 0.415 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 10.1 pt-20 -137.22 -172.12 3.12 Favored 'General case' 0 C--N 1.312 -1.046 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 178.455 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -76.93 141.88 40.3 Favored 'General case' 0 N--CA 1.444 -0.743 0 C-N-CA 119.52 -0.872 . . . . 0.0 110.56 179.6 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 77.8 3.22 2.96 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 124.779 1.232 . . . . 0.0 110.71 -178.93 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 86' ' ' ASP . . . . . 0.415 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 1.6 t0 -63.05 164.74 7.91 Favored 'General case' 0 C--O 1.239 0.551 0 CA-C-O 121.249 0.547 . . . . 0.0 111.035 177.874 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 87' ' ' VAL . . . . . 0.418 ' HA ' ' O ' ' A' ' 25' ' ' LYS . 7.9 p -128.34 145.01 36.08 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.067 0 CA-C-O 121.288 0.566 . . . . 0.0 111.338 -176.996 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 3.7 mp -113.88 153.7 15.38 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.825 0 N-CA-C 109.095 -0.705 . . . . 0.0 109.095 177.86 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -104.0 135.95 44.55 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-O 120.918 0.39 . . . . 0.0 110.545 -175.643 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 90' ' ' VAL . . . . . 0.499 ' HA ' ' O ' ' A' ' 63' ' ' ARG . 57.9 t -129.84 134.0 63.8 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.854 0 CA-C-O 121.391 0.615 . . . . 0.0 110.904 178.356 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 83.3 m-85 -122.78 176.0 6.22 Favored 'General case' 0 C--N 1.313 -0.994 0 CA-C-N 115.962 -0.563 . . . . 0.0 109.492 178.819 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 6.7 tp60 -101.08 146.77 27.02 Favored 'General case' 0 C--N 1.305 -1.366 0 N-CA-C 109.705 -0.48 . . . . 0.0 109.705 178.87 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 . . . . . 0 C--N 1.321 -0.637 0 CA-C-O 121.452 0.644 . . . . 0.0 110.454 175.695 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 22' ' ' ILE . . . . . 0.554 ' HB ' ' HA ' ' A' ' 84' ' ' GLU . 19.9 pt . . . . . 0 N--CA 1.443 -0.821 0 CA-C-O 121.301 0.572 . . . . 0.0 110.566 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.476 ' HD3' ' N ' ' A' ' 23' ' ' LYS . 0.0 OUTLIER -121.51 143.44 49.27 Favored 'General case' 0 C--N 1.308 -1.201 0 N-CA-C 108.706 -0.85 . . . . 0.0 108.706 -179.489 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.4 mp -138.0 166.62 23.64 Favored 'General case' 0 C--N 1.306 -1.294 0 CA-C-O 121.256 0.551 . . . . 0.0 111.195 177.606 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 4.8 tmmm? -134.0 144.08 48.52 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.518 -179.917 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.609 ' O ' ' HA ' ' A' ' 33' ' ' GLU . 0.9 OUTLIER -115.41 141.54 32.01 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.159 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.707 -179.932 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.47 HD13 ' HG2' ' A' ' 33' ' ' GLU . 35.4 mm -111.26 99.57 8.97 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.728 0 N-CA-C 108.234 -1.024 . . . . 0.0 108.234 175.827 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' GLY . . . . . 0.671 ' HA3' ' OG ' ' A' ' 32' ' ' SER . . . -71.63 172.46 45.63 Favored Glycine 0 N--CA 1.426 -2.014 0 C-N-CA 119.626 -1.274 . . . . 0.0 114.007 179.722 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.416 ' HG3' ' H ' ' A' ' 29' ' ' GLN . 0.0 OUTLIER -66.04 -18.26 65.23 Favored 'General case' 0 C--N 1.307 -1.245 0 CA-C-N 114.607 -0.797 . . . . 0.0 110.99 179.539 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -100.19 10.5 41.16 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.465 -0.788 . . . . 0.0 109.375 178.589 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 50.2 m 71.61 23.31 3.81 Favored 'General case' 0 C--N 1.342 0.275 0 CA-C-O 121.913 0.864 . . . . 0.0 109.113 -175.244 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' SER . . . . . 0.671 ' OG ' ' HA3' ' A' ' 28' ' ' GLY . 2.2 p -70.77 92.52 0.89 Allowed 'General case' 0 N--CA 1.42 -1.933 0 CA-C-N 114.983 -1.008 . . . . 0.0 111.403 -179.339 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.609 ' HA ' ' O ' ' A' ' 26' ' ' VAL . 31.4 mt-10 -81.52 102.08 10.35 Favored 'General case' 0 CA--C 1.505 -0.759 0 CA-C-O 121.211 0.529 . . . . 0.0 110.579 178.71 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.426 HG21 ' HA ' ' A' ' 51' ' ' TYR . 29.5 mm -99.73 138.97 22.45 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.718 0 N-CA-C 109.283 -0.636 . . . . 0.0 109.283 179.317 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 12.0 m170 -116.43 132.9 56.55 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 178.991 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.537 ' HZ ' HG23 ' A' ' 26' ' ' VAL . 1.0 OUTLIER -147.26 167.89 23.12 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-O 121.179 0.514 . . . . 0.0 111.555 -177.456 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 91.7 mttt -124.11 125.12 43.94 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.902 -0.59 . . . . 0.0 109.805 -178.963 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 24.1 m -144.72 152.77 14.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 121.048 0.451 . . . . 0.0 110.443 -179.852 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 36.5 mtpt -77.65 174.93 10.39 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-O 121.665 0.745 . . . . 0.0 111.401 177.436 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -87.02 -32.67 19.89 Favored 'General case' 0 C--N 1.31 -1.122 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.371 179.24 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 9.8 t -94.68 14.63 20.52 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.324 -177.293 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 6.4 t -105.42 167.36 9.8 Favored 'General case' 0 C--N 1.316 -0.865 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 179.903 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' HIS . . . . . 0.444 ' O ' ' HG2' ' A' ' 46' ' ' LYS . 46.4 m170 -81.9 142.41 32.51 Favored 'General case' 0 C--N 1.312 -1.022 0 CA-C-O 121.675 0.75 . . . . 0.0 111.84 -179.309 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.652 ' O ' ' HG3' ' A' ' 48' ' ' LYS . 0.2 OUTLIER -64.88 -17.68 64.52 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 114.998 -1.001 . . . . 0.0 109.893 179.296 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.739 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -51.9 -47.81 64.44 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.967 -179.043 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.444 ' HG2' ' O ' ' A' ' 43' ' ' HIS . 22.5 ptmt -58.97 -34.29 71.63 Favored 'General case' 0 C--O 1.207 -1.147 0 CA-C-O 121.077 0.465 . . . . 0.0 110.385 -179.274 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.554 ' HB3' HD13 ' A' ' 44' ' ' LEU . 8.2 tt -70.6 -47.98 57.44 Favored 'General case' 0 C--N 1.301 -1.531 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.124 -179.997 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.652 ' HG3' ' O ' ' A' ' 44' ' ' LEU . 20.8 mtpt -59.98 -49.93 75.73 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.509 -178.041 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.739 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 10.4 pt-20 -67.67 -33.89 75.83 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.441 -179.25 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 50' ' ' SER . . . . . 0.613 ' O ' ' HG2' ' A' ' 54' ' ' ARG . 7.5 m -66.39 -45.66 79.27 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.845 -179.659 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.462 ' CE2' ' HA ' ' A' ' 48' ' ' LYS . 2.1 p90 -76.35 -32.69 58.79 Favored 'General case' 0 N--CA 1.445 -0.677 0 C-N-CA 119.667 -0.813 . . . . 0.0 110.672 -177.775 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 52' ' ' CYS . . . . . 0.529 ' SG ' ' HG2' ' A' ' 59' ' ' MET . 69.2 m -61.98 -44.75 96.09 Favored 'General case' 0 C--O 1.238 0.466 0 CA-C-O 121.0 0.428 . . . . 0.0 110.793 179.083 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 11.6 pt20 -67.99 -33.39 74.53 Favored 'General case' 0 N--CA 1.447 -0.601 0 C-N-CA 120.66 -0.416 . . . . 0.0 110.533 -179.922 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.613 ' HG2' ' O ' ' A' ' 50' ' ' SER . 17.8 mmt85 -57.67 -38.04 74.44 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-O 121.313 0.578 . . . . 0.0 110.832 177.531 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 33.7 mt-30 -81.29 -21.31 39.4 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.954 179.914 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 82.86 29.99 33.31 Favored Glycine 0 N--CA 1.446 -0.688 0 C-N-CA 120.834 -0.698 . . . . 0.0 112.325 179.224 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 35.0 m -132.17 147.63 66.55 Favored Pre-proline 0 C--N 1.324 -0.504 0 O-C-N 122.508 -0.407 . . . . 0.0 110.786 -179.042 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' PRO . . . . . 0.597 ' HG2' ' OG ' ' A' ' 61' ' ' SER . 18.8 Cg_endo -63.35 150.35 88.79 Favored 'Trans proline' 0 N--CA 1.456 -0.683 0 C-N-CA 122.33 2.02 . . . . 0.0 111.955 177.601 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.529 ' HG2' ' SG ' ' A' ' 52' ' ' CYS . 69.8 mtp -70.01 -9.16 54.33 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.77 -176.338 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 60' ' ' ASN . . . . . 0.403 ' OD1' ' HB2' ' A' ' 58' ' ' PRO . 1.9 p-10 -92.19 -8.52 45.26 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 121.23 0.538 . . . . 0.0 110.886 -179.607 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.597 ' OG ' ' HG2' ' A' ' 58' ' ' PRO . 67.3 m -84.66 -23.36 29.49 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 121.002 0.429 . . . . 0.0 111.836 179.516 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.457 HD11 ' SG ' ' A' ' 52' ' ' CYS . 1.2 pp -125.57 169.14 12.76 Favored 'General case' 0 C--N 1.307 -1.247 0 N-CA-C 113.313 0.856 . . . . 0.0 113.313 -175.091 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.466 ' O ' ' HA ' ' A' ' 90' ' ' VAL . 52.5 mtm180 -116.16 112.42 21.65 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.176 -0.92 . . . . 0.0 110.722 -178.156 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.41 ' HB3' ' OH ' ' A' ' 51' ' ' TYR . 0.1 OUTLIER -96.91 115.12 26.88 Favored 'General case' 0 C--N 1.31 -1.131 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.522 178.466 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.459 ' C ' HD22 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -143.54 162.12 36.68 Favored 'General case' 0 N--CA 1.443 -0.792 0 CA-C-O 121.745 0.783 . . . . 0.0 111.834 -179.65 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 92.5 t80 -145.79 136.95 24.75 Favored 'General case' 0 C--N 1.309 -1.168 0 N-CA-C 108.785 -0.82 . . . . 0.0 108.785 178.564 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.453 ' HG2' HE21 ' A' ' 69' ' ' GLN . 7.1 pt-20 48.54 29.04 1.94 Allowed 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 124.391 1.076 . . . . 0.0 112.231 -178.417 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 83.57 23.17 54.49 Favored Glycine 0 N--CA 1.447 -0.589 0 C-N-CA 120.935 -0.65 . . . . 0.0 113.26 -179.646 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' GLN . . . . . 0.453 HE21 ' HG2' ' A' ' 67' ' ' GLU . 3.0 pt20 -130.47 137.41 49.77 Favored 'General case' 0 C--N 1.32 -0.711 0 O-C-N 122.212 -0.581 . . . . 0.0 109.462 179.826 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.422 ' HD2' ' H ' ' A' ' 70' ' ' ARG . 0.5 OUTLIER -73.07 146.62 45.69 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-O 121.704 0.764 . . . . 0.0 110.172 178.154 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.454 HG21 HD12 ' A' ' 44' ' ' LEU . 22.6 mm -92.63 119.56 40.45 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.855 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.308 -178.391 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -94.88 161.03 14.32 Favored 'General case' 0 N--CA 1.434 -1.232 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 178.841 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' ASP . . . . . 0.413 ' HB3' ' HB3' ' A' ' 45' ' ' LYS . 66.3 m-20 -67.87 -21.18 65.18 Favored 'General case' 0 C--N 1.314 -0.964 0 CA-C-O 121.303 0.573 . . . . 0.0 111.506 -177.918 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 6.1 m-80 -100.44 6.78 44.44 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-O 121.268 0.556 . . . . 0.0 110.1 -179.437 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 75' ' ' HIS . . . . . 0.582 ' O ' ' HB2' ' A' ' 44' ' ' LEU . 2.2 m170 -83.27 145.84 28.88 Favored 'General case' 0 CA--C 1.5 -0.955 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 178.342 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.417 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 68.8 p -118.24 152.91 51.29 Favored Pre-proline 0 C--N 1.301 -1.53 0 C-N-CA 120.824 -0.351 . . . . 0.0 111.476 179.647 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_exo -57.3 -41.03 77.52 Favored 'Trans proline' 0 C--N 1.349 0.584 0 C-N-CA 122.597 2.198 . . . . 0.0 111.431 178.508 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 78' ' ' LYS . . . . . 0.54 ' HG3' ' N ' ' A' ' 79' ' ' GLU . 48.1 pttt -64.58 -40.92 96.41 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.877 -178.918 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 79' ' ' GLU . . . . . 0.54 ' N ' ' HG3' ' A' ' 78' ' ' LYS . 55.6 mm-40 -73.55 -35.73 65.55 Favored 'General case' 0 N--CA 1.439 -0.99 0 CA-C-O 120.951 0.405 . . . . 0.0 111.463 -177.592 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.455 HD21 ' CG ' ' A' ' 75' ' ' HIS . 5.5 mt -80.69 -0.93 40.44 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.119 0.485 . . . . 0.0 111.253 -179.35 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 78.26 37.78 27.35 Favored Glycine 0 CA--C 1.51 -0.256 0 C-N-CA 120.872 -0.68 . . . . 0.0 112.963 177.174 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 61.0 mtt -100.18 165.26 11.58 Favored 'General case' 0 C--N 1.311 -1.082 0 N-CA-C 109.844 -0.428 . . . . 0.0 109.844 179.35 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -148.2 -171.32 3.81 Favored 'General case' 0 C--N 1.311 -1.084 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 178.151 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.554 ' HA ' ' HB ' ' A' ' 22' ' ' ILE . 15.8 pt-20 -71.19 138.39 49.5 Favored 'General case' 0 N--CA 1.443 -0.778 0 C-N-CA 120.223 -0.591 . . . . 0.0 110.928 -179.89 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 79.7 -2.29 2.1 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 124.801 1.24 . . . . 0.0 111.433 178.861 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -59.33 162.5 4.65 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-O 121.395 0.617 . . . . 0.0 111.284 179.109 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 7.1 p -129.48 143.38 41.32 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.948 0 CA-C-O 121.285 0.564 . . . . 0.0 111.33 -177.001 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 3.7 mp -114.47 153.9 15.91 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 179.642 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 11.0 tp10 -107.41 138.56 43.39 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 120.802 0.334 . . . . 0.0 110.102 -177.226 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 90' ' ' VAL . . . . . 0.596 ' HB ' ' HA2' ' A' ' 28' ' ' GLY . 97.1 t -130.62 134.05 62.62 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.974 0 CA-C-O 121.47 0.653 . . . . 0.0 110.922 178.863 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 89.0 m-85 -119.27 -177.36 3.33 Favored 'General case' 0 C--N 1.306 -1.284 0 CA-C-N 115.886 -0.597 . . . . 0.0 109.465 179.799 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 8.1 tp60 -108.31 148.26 30.3 Favored 'General case' 0 C--N 1.307 -1.263 0 O-C-N 121.934 -0.478 . . . . 0.0 110.38 -179.281 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 93' ' ' GLU . . . . . 0.419 ' OE2' ' HG2' ' A' ' 63' ' ' ARG . 10.5 pt-20 . . . . . 0 C--N 1.329 -0.309 0 CA-C-O 121.702 0.763 . . . . 0.0 110.322 174.658 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' ILE . . . . . 0.518 ' HB ' ' HA ' ' A' ' 84' ' ' GLU . 27.7 pt . . . . . 0 N--CA 1.44 -0.973 0 CA-C-O 121.471 0.653 . . . . 0.0 110.131 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 41.1 mtmt -120.95 142.5 49.69 Favored 'General case' 0 C--N 1.296 -1.745 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 179.899 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.6 mp -135.76 160.83 37.32 Favored 'General case' 0 C--N 1.301 -1.539 0 CA-C-O 121.278 0.561 . . . . 0.0 110.755 176.708 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.429 ' O ' ' HA ' ' A' ' 87' ' ' VAL . 5.1 tmmm? -130.17 142.09 50.61 Favored 'General case' 0 C--N 1.309 -1.156 0 CA-C-O 121.37 0.605 . . . . 0.0 110.315 -178.728 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.519 HG23 ' HZ ' ' A' ' 36' ' ' PHE . 0.9 OUTLIER -112.87 142.82 24.03 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.544 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.353 -179.142 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 44.4 mm -106.97 115.61 48.86 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.138 0 N-CA-C 107.463 -1.31 . . . . 0.0 107.463 174.737 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -78.13 178.31 52.66 Favored Glycine 0 N--CA 1.423 -2.202 0 C-N-CA 120.796 -0.716 . . . . 0.0 113.257 -175.054 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.66 ' H ' ' CD ' ' A' ' 29' ' ' GLN . 0.0 OUTLIER -72.72 -27.63 62.17 Favored 'General case' 0 C--N 1.3 -1.581 0 CA-C-O 122.141 0.972 . . . . 0.0 108.442 -179.02 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -102.73 16.28 26.95 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 114.705 -1.134 . . . . 0.0 108.343 178.375 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 21.3 m 73.46 15.86 4.13 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 115.267 -0.879 . . . . 0.0 111.402 179.003 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 21.6 t -68.04 110.41 3.92 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.05 179.304 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.512 ' HA ' ' O ' ' A' ' 26' ' ' VAL . 4.3 mp0 -86.65 108.48 18.65 Favored 'General case' 0 N--CA 1.445 -0.714 0 CA-C-O 121.3 0.571 . . . . 0.0 110.828 179.9 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 28.7 mm -98.59 141.28 16.61 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.212 0 N-CA-C 109.365 -0.606 . . . . 0.0 109.365 179.582 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 11.4 m170 -120.02 129.31 54.2 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 -179.898 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.519 ' HZ ' HG23 ' A' ' 26' ' ' VAL . 1.7 p90 -147.17 162.56 38.62 Favored 'General case' 0 C--N 1.313 -0.984 0 CA-C-O 121.351 0.596 . . . . 0.0 111.625 -177.676 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 19.2 ptpt -118.69 127.61 53.73 Favored 'General case' 0 N--CA 1.445 -0.704 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.853 179.41 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.423 HG21 HD12 ' A' ' 47' ' ' LEU . 34.6 m -142.17 162.34 19.46 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 178.098 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.583 ' O ' HG22 ' A' ' 42' ' ' THR . 70.9 tttt -94.46 166.56 12.0 Favored 'General case' 0 C--N 1.305 -1.33 0 O-C-N 121.587 -0.695 . . . . 0.0 110.649 -179.426 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -76.1 -35.06 59.48 Favored 'General case' 0 C--N 1.328 -0.362 0 O-C-N 121.914 -0.491 . . . . 0.0 111.923 -177.436 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 15.1 t -90.05 16.91 7.52 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 120.996 0.426 . . . . 0.0 111.606 -177.961 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' THR . . . . . 0.583 HG22 ' O ' ' A' ' 39' ' ' LYS . 2.0 t -106.86 170.63 7.83 Favored 'General case' 0 C--N 1.321 -0.67 0 O-C-N 121.938 -0.476 . . . . 0.0 110.174 -178.624 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 8.2 m-70 -85.41 147.35 26.54 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.557 0.694 . . . . 0.0 111.522 -179.75 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.58 HD13 ' HB3' ' A' ' 47' ' ' LEU . 0.2 OUTLIER -73.77 -13.26 60.92 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.309 -179.345 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.734 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -55.75 -43.37 76.6 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.986 -178.966 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 12.0 ptmt -68.34 -29.15 67.81 Favored 'General case' 0 C--O 1.213 -0.861 0 CA-C-O 121.127 0.489 . . . . 0.0 110.596 -178.929 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.58 ' HB3' HD13 ' A' ' 44' ' ' LEU . 9.1 tt -73.23 -49.03 30.1 Favored 'General case' 0 C--N 1.305 -1.357 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.153 -179.866 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.535 ' HA ' ' CD2' ' A' ' 51' ' ' TYR . 7.7 ptmm? -63.65 -41.63 98.2 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.726 -177.563 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.734 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 8.4 pt-20 -69.71 -33.76 72.95 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 121.0 0.428 . . . . 0.0 110.426 176.992 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 4.7 m -67.83 -41.76 82.49 Favored 'General case' 0 C--O 1.236 0.354 0 N-CA-C 112.512 0.56 . . . . 0.0 112.512 -178.312 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.535 ' CD2' ' HA ' ' A' ' 48' ' ' LYS . 2.7 p90 -76.78 -32.38 57.65 Favored 'General case' 0 N--CA 1.444 -0.734 0 C-N-CA 119.436 -0.905 . . . . 0.0 110.229 -179.096 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 52' ' ' CYS . . . . . 0.567 ' SG ' HD11 ' A' ' 62' ' ' LEU . 98.6 m -62.34 -45.08 94.8 Favored 'General case' 0 CA--C 1.51 -0.559 0 CA-C-O 120.967 0.413 . . . . 0.0 110.646 178.857 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 10.6 pt20 -66.36 -34.67 78.48 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.159 -179.727 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.433 ' NE ' ' HA ' ' A' ' 54' ' ' ARG . 3.9 mmp_? -59.23 -39.56 83.11 Favored 'General case' 0 CA--C 1.514 -0.432 0 CA-C-O 121.023 0.44 . . . . 0.0 111.329 177.707 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 32.4 mt-30 -77.46 -21.28 53.17 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-O 121.137 0.494 . . . . 0.0 110.715 179.371 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 82.75 30.85 31.22 Favored Glycine 0 N--CA 1.444 -0.813 0 C-N-CA 120.937 -0.649 . . . . 0.0 112.217 179.25 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 35.6 m -133.65 148.31 68.06 Favored Pre-proline 0 C--N 1.326 -0.439 0 O-C-N 122.42 -0.459 . . . . 0.0 110.803 -179.045 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' PRO . . . . . 0.57 ' HG2' ' OG ' ' A' ' 61' ' ' SER . 18.0 Cg_endo -62.45 153.43 71.05 Favored 'Trans proline' 0 N--CA 1.461 -0.422 0 C-N-CA 122.585 2.19 . . . . 0.0 111.866 177.205 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.469 ' HG2' ' SG ' ' A' ' 52' ' ' CYS . 74.1 mtp -72.69 -8.72 56.76 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.134 0.493 . . . . 0.0 111.529 -176.356 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.9 p-10 -91.63 -8.75 46.32 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-O 121.268 0.556 . . . . 0.0 110.561 179.551 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.57 ' OG ' ' HG2' ' A' ' 58' ' ' PRO . 75.6 m -87.25 -18.03 31.2 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-O 121.095 0.474 . . . . 0.0 111.862 -179.742 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.567 HD11 ' SG ' ' A' ' 52' ' ' CYS . 1.3 pp -131.19 169.69 15.59 Favored 'General case' 0 C--N 1.31 -1.114 0 N-CA-C 113.067 0.765 . . . . 0.0 113.067 -176.999 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.435 ' O ' ' HA ' ' A' ' 90' ' ' VAL . 35.8 mtm180 -119.72 121.15 38.56 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.416 -177.748 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.415 ' HB3' ' OH ' ' A' ' 51' ' ' TYR . 0.2 OUTLIER -105.1 117.96 35.33 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-O 121.206 0.527 . . . . 0.0 111.462 179.475 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.445 ' C ' HD22 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -147.85 164.42 33.74 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 121.208 0.528 . . . . 0.0 110.471 179.606 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 77.9 t80 -144.69 135.84 25.14 Favored 'General case' 0 C--N 1.313 -0.994 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 178.134 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.477 ' HG2' HE21 ' A' ' 69' ' ' GLN . 7.3 pt-20 50.88 26.37 2.61 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 124.117 0.967 . . . . 0.0 112.327 -179.899 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 85.04 23.27 49.73 Favored Glycine 0 N--CA 1.445 -0.726 0 C-N-CA 120.871 -0.68 . . . . 0.0 112.902 -179.38 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' GLN . . . . . 0.477 HE21 ' HG2' ' A' ' 67' ' ' GLU . 2.8 pt20 -129.92 134.39 47.45 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 178.953 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 10.8 ptt180 -65.56 148.68 51.34 Favored 'General case' 0 C--N 1.31 -1.136 0 CA-C-O 121.586 0.708 . . . . 0.0 111.113 177.824 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.474 HG21 HD12 ' A' ' 44' ' ' LEU . 21.0 mm -98.92 115.56 39.73 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.301 0 N-CA-C 109.629 -0.508 . . . . 0.0 109.629 177.724 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -96.34 165.99 11.93 Favored 'General case' 0 N--CA 1.437 -1.091 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 -179.237 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' ASP . . . . . 0.428 ' CA ' ' HB3' ' A' ' 45' ' ' LYS . 37.1 m-20 -69.32 -25.44 64.22 Favored 'General case' 0 C--N 1.31 -1.124 0 CA-C-O 121.518 0.675 . . . . 0.0 110.982 -178.268 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 8.5 m-80 -96.5 4.66 51.93 Favored 'General case' 0 C--N 1.311 -1.076 0 CA-C-O 121.491 0.662 . . . . 0.0 109.708 -178.026 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 75' ' ' HIS . . . . . 0.546 ' O ' ' HB2' ' A' ' 44' ' ' LEU . 4.5 m170 -83.77 144.75 29.11 Favored 'General case' 0 CA--C 1.503 -0.855 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 178.849 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.523 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 77.6 p -117.85 155.29 51.06 Favored Pre-proline 0 C--N 1.302 -1.499 0 N-CA-C 110.276 -0.268 . . . . 0.0 110.276 178.516 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -67.49 -30.57 35.63 Favored 'Trans proline' 0 N--CA 1.454 -0.822 0 C-N-CA 121.95 1.767 . . . . 0.0 111.043 -179.896 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 78' ' ' LYS . . . . . 0.466 ' HG3' ' N ' ' A' ' 79' ' ' GLU . 33.2 pttt -70.73 -38.47 73.57 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.952 0.406 . . . . 0.0 110.551 179.59 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 79' ' ' GLU . . . . . 0.466 ' N ' ' HG3' ' A' ' 78' ' ' LYS . 5.0 mm-40 -74.14 -37.64 64.0 Favored 'General case' 0 N--CA 1.447 -0.623 0 CA-C-O 121.015 0.436 . . . . 0.0 111.269 -179.572 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.523 ' HG ' ' O ' ' A' ' 76' ' ' THR . 5.9 mt -77.29 -5.04 47.96 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.278 0.561 . . . . 0.0 110.872 -179.862 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 78.34 42.96 13.7 Favored Glycine 0 C--O 1.227 -0.34 0 C-N-CA 121.129 -0.558 . . . . 0.0 113.217 176.733 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 61.4 mtt -101.65 165.68 11.1 Favored 'General case' 0 C--N 1.315 -0.932 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 179.51 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -142.6 -170.72 3.27 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 110.073 -0.343 . . . . 0.0 110.073 177.104 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.518 ' HA ' ' HB ' ' A' ' 22' ' ' ILE . 14.4 pt-20 -68.7 135.94 52.11 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.97 0.414 . . . . 0.0 111.003 -179.421 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 79.07 4.41 2.33 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 124.361 1.064 . . . . 0.0 111.158 177.574 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 17.6 t0 -60.64 159.26 11.02 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-O 121.422 0.629 . . . . 0.0 110.982 178.515 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 87' ' ' VAL . . . . . 0.429 ' HA ' ' O ' ' A' ' 25' ' ' LYS . 7.4 p -127.05 141.48 46.14 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.243 0 CA-C-O 121.386 0.612 . . . . 0.0 111.417 -177.387 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 3.6 mp -111.33 155.91 12.61 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.743 0 CA-C-N 116.203 -0.453 . . . . 0.0 109.82 -179.379 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 6.3 tp10 -105.34 135.3 46.97 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.929 0.395 . . . . 0.0 110.227 -177.25 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 90' ' ' VAL . . . . . 0.435 ' HA ' ' O ' ' A' ' 63' ' ' ARG . 60.4 t -128.87 134.75 63.72 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.912 0 CA-C-O 121.119 0.485 . . . . 0.0 110.809 178.148 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 87.9 m-85 -119.05 173.9 6.63 Favored 'General case' 0 C--N 1.32 -0.713 0 N-CA-C 108.947 -0.761 . . . . 0.0 108.947 178.115 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 7.1 tp60 -102.44 146.85 27.5 Favored 'General case' 0 C--N 1.314 -0.947 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 178.633 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 23.0 pt-20 . . . . . 0 C--N 1.328 -0.362 0 CA-C-O 121.165 0.507 . . . . 0.0 111.191 176.267 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 24.5 pt . . . . . 0 N--CA 1.442 -0.837 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 1.8 mppt? -118.44 142.84 47.16 Favored 'General case' 0 C--N 1.296 -1.74 0 N-CA-C 109.017 -0.735 . . . . 0.0 109.017 -179.508 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.5 mp -135.3 162.83 31.46 Favored 'General case' 0 C--N 1.301 -1.508 0 CA-C-O 121.197 0.523 . . . . 0.0 110.572 176.67 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.428 ' O ' ' HA ' ' A' ' 87' ' ' VAL . 5.3 tmmm? -132.5 142.55 49.26 Favored 'General case' 0 N--CA 1.434 -1.274 0 CA-C-O 121.436 0.636 . . . . 0.0 110.775 -178.775 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.515 HG11 ' CD1' ' A' ' 51' ' ' TYR . 0.9 OUTLIER -115.98 141.89 31.57 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.324 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.036 -179.954 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.43 ' O ' ' HB ' ' A' ' 90' ' ' VAL . 48.3 mm -104.6 118.27 51.62 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.109 0 N-CA-C 107.425 -1.324 . . . . 0.0 107.425 174.626 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 28' ' ' GLY . . . . . 0.472 ' HA2' ' HB ' ' A' ' 90' ' ' VAL . . . -91.53 162.22 27.86 Favored Glycine 0 N--CA 1.423 -2.215 0 C-N-CA 120.145 -1.026 . . . . 0.0 111.32 -177.064 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.83 -24.45 62.01 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-O 121.531 0.681 . . . . 0.0 111.351 177.701 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 36.4 t70 -89.1 9.1 26.65 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-O 121.401 0.62 . . . . 0.0 110.177 178.598 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 8.6 t 70.06 16.7 7.48 Favored 'General case' 0 C--N 1.342 0.279 0 CA-C-O 122.177 0.989 . . . . 0.0 109.301 -177.458 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 5.0 t -77.13 111.56 12.86 Favored 'General case' 0 N--CA 1.444 -0.754 0 CA-C-N 114.997 -1.001 . . . . 0.0 110.195 -179.821 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.419 ' HA ' ' O ' ' A' ' 26' ' ' VAL . 41.3 mt-10 -87.15 112.08 21.59 Favored 'General case' 0 CA--C 1.507 -0.705 0 N-CA-C 109.803 -0.443 . . . . 0.0 109.803 177.861 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.416 HG21 ' HA ' ' A' ' 51' ' ' TYR . 32.1 mm -101.6 136.86 31.54 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.659 0 N-CA-C 109.489 -0.56 . . . . 0.0 109.489 179.681 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 35' ' ' HIS . . . . . 0.407 ' NE2' ' HG3' ' A' ' 25' ' ' LYS . 11.7 m170 -117.28 134.71 54.49 Favored 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 179.397 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.485 ' HZ ' HG23 ' A' ' 26' ' ' VAL . 1.0 OUTLIER -147.13 159.47 43.58 Favored 'General case' 0 C--N 1.309 -1.184 0 CA-C-O 121.22 0.533 . . . . 0.0 111.332 -177.765 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -116.41 117.21 29.32 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.743 -178.712 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 32.6 m -137.74 158.39 33.83 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 N-CA-C 109.884 -0.413 . . . . 0.0 109.884 179.787 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 24.2 mtpp -81.85 175.92 10.02 Favored 'General case' 0 CA--C 1.503 -0.837 0 CA-C-O 121.497 0.665 . . . . 0.0 111.205 178.382 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -83.05 -32.39 26.86 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-N 115.712 -0.676 . . . . 0.0 111.118 178.843 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 14.8 t -97.13 15.21 23.25 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.03 0.443 . . . . 0.0 112.002 -177.351 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 4.2 t -98.71 163.99 12.41 Favored 'General case' 0 C--N 1.316 -0.852 0 O-C-N 121.87 -0.518 . . . . 0.0 110.052 -178.908 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 27.6 m170 -77.34 142.68 39.24 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.458 0.647 . . . . 0.0 111.421 179.114 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.605 ' O ' ' HG3' ' A' ' 48' ' ' LYS . 0.2 OUTLIER -70.81 -15.96 62.7 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 115.391 -0.822 . . . . 0.0 109.41 -179.878 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.659 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -55.22 -45.43 75.96 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.868 -0.605 . . . . 0.0 112.576 -177.506 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 21.9 ptmt -66.46 -28.99 69.02 Favored 'General case' 0 C--O 1.22 -0.494 0 CA-C-O 121.283 0.563 . . . . 0.0 110.407 -178.699 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.576 ' HB3' HD13 ' A' ' 44' ' ' LEU . 8.1 tt -70.16 -47.72 60.41 Favored 'General case' 0 C--N 1.312 -1.052 0 CA-C-N 115.721 -0.672 . . . . 0.0 109.668 178.726 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.605 ' HG3' ' O ' ' A' ' 44' ' ' LEU . 20.9 mtpt -57.31 -48.12 79.77 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-O 121.512 0.673 . . . . 0.0 110.434 -179.329 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.659 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 6.3 pt-20 -71.61 -32.63 68.21 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.859 -178.386 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 50' ' ' SER . . . . . 0.443 ' O ' ' HG2' ' A' ' 53' ' ' GLN . 28.5 t -63.87 -46.44 84.92 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-O 121.173 0.511 . . . . 0.0 110.944 -179.687 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.515 ' CD1' HG11 ' A' ' 26' ' ' VAL . 1.9 p90 -76.46 -32.55 58.46 Favored 'General case' 0 N--CA 1.44 -0.931 0 C-N-CA 119.976 -0.689 . . . . 0.0 110.564 -177.783 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 52' ' ' CYS . . . . . 0.537 ' SG ' HD11 ' A' ' 62' ' ' LEU . 74.7 m -63.63 -43.37 97.03 Favored 'General case' 0 CA--C 1.511 -0.537 0 CA-C-O 121.159 0.504 . . . . 0.0 110.704 179.226 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 53' ' ' GLN . . . . . 0.443 ' HG2' ' O ' ' A' ' 50' ' ' SER . 13.7 pt20 -67.5 -34.77 77.82 Favored 'General case' 0 N--CA 1.443 -0.786 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.271 -179.875 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.512 ' NE ' ' HA ' ' A' ' 54' ' ' ARG . 4.0 mmp_? -58.08 -38.53 76.55 Favored 'General case' 0 C--N 1.347 0.47 0 CA-C-O 121.075 0.464 . . . . 0.0 111.444 177.496 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 30.2 mt-30 -79.91 -21.13 44.3 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 121.218 0.533 . . . . 0.0 110.956 179.519 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 83.64 29.31 32.81 Favored Glycine 0 N--CA 1.448 -0.553 0 C-N-CA 121.005 -0.617 . . . . 0.0 112.24 178.313 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 28.8 m -130.62 151.59 78.98 Favored Pre-proline 0 C--N 1.323 -0.56 0 O-C-N 122.238 -0.566 . . . . 0.0 111.074 -177.824 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' PRO . . . . . 0.556 ' HG2' ' OG ' ' A' ' 61' ' ' SER . 19.2 Cg_endo -64.5 155.11 68.16 Favored 'Trans proline' 0 N--CA 1.455 -0.773 0 C-N-CA 122.301 2.001 . . . . 0.0 111.481 176.405 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.404 ' HG2' ' SG ' ' A' ' 52' ' ' CYS . 82.4 mtp -74.69 -8.77 57.41 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-O 121.146 0.498 . . . . 0.0 111.458 -176.101 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 29.9 p30 -91.58 -10.43 40.56 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 121.328 0.585 . . . . 0.0 110.749 -179.445 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.556 ' OG ' ' HG2' ' A' ' 58' ' ' PRO . 71.4 m -83.47 -24.8 31.64 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 121.175 0.512 . . . . 0.0 111.649 -179.106 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.537 HD11 ' SG ' ' A' ' 52' ' ' CYS . 1.4 pp -124.99 170.14 11.43 Favored 'General case' 0 C--N 1.302 -1.473 0 N-CA-C 112.685 0.624 . . . . 0.0 112.685 -175.629 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.532 ' O ' ' HA ' ' A' ' 90' ' ' VAL . 42.2 mtm180 -119.14 120.02 35.89 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.811 -0.632 . . . . 0.0 110.66 -178.223 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -102.61 114.76 29.25 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-O 121.124 0.488 . . . . 0.0 110.993 178.264 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.446 ' C ' HD22 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -143.72 162.91 34.77 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-O 121.39 0.614 . . . . 0.0 111.059 -179.854 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 85.9 t80 -144.61 134.15 23.35 Favored 'General case' 0 C--N 1.31 -1.137 0 CA-C-N 116.01 -0.541 . . . . 0.0 109.614 179.168 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.465 ' HG2' HE21 ' A' ' 69' ' ' GLN . 7.0 pt-20 49.31 26.85 1.69 Allowed 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 124.282 1.033 . . . . 0.0 112.562 179.964 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 87.25 22.81 42.99 Favored Glycine 0 N--CA 1.446 -0.653 0 C-N-CA 121.049 -0.596 . . . . 0.0 113.471 -179.683 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 69' ' ' GLN . . . . . 0.465 HE21 ' HG2' ' A' ' 67' ' ' GLU . 3.4 pt20 -130.06 138.2 50.62 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 179.198 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -72.34 146.75 46.89 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-O 121.28 0.562 . . . . 0.0 110.031 178.065 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.482 HG21 HD12 ' A' ' 44' ' ' LEU . 23.6 mm -94.94 122.27 46.24 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.255 0 CA-C-O 121.174 0.511 . . . . 0.0 110.546 -179.016 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -96.67 160.75 14.21 Favored 'General case' 0 N--CA 1.44 -0.949 0 N-CA-C 109.468 -0.567 . . . . 0.0 109.468 179.561 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 73' ' ' ASP . . . . . 0.452 ' CA ' ' HB3' ' A' ' 45' ' ' LYS . 11.6 p-10 -68.94 -21.9 64.17 Favored 'General case' 0 C--N 1.311 -1.08 0 CA-C-O 121.377 0.608 . . . . 0.0 111.04 -179.323 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 4.9 m-80 -96.8 1.86 51.23 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-O 121.209 0.528 . . . . 0.0 109.63 -179.721 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 75' ' ' HIS . . . . . 0.568 ' O ' ' HB2' ' A' ' 44' ' ' LEU . 2.8 m170 -81.29 146.32 30.46 Favored 'General case' 0 CA--C 1.501 -0.915 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 -179.234 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.48 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 72.7 p -118.48 153.83 52.08 Favored Pre-proline 0 C--N 1.302 -1.465 0 C-N-CA 121.038 -0.265 . . . . 0.0 110.699 178.383 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 22.1 Cg_endo -62.1 -37.92 60.21 Favored 'Trans proline' 0 N--CA 1.455 -0.783 0 C-N-CA 122.197 1.931 . . . . 0.0 111.395 -179.387 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 78' ' ' LYS . . . . . 0.536 ' HG3' ' N ' ' A' ' 79' ' ' GLU . 36.2 pttt -66.11 -41.52 90.46 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.917 0.389 . . . . 0.0 110.797 -179.652 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 79' ' ' GLU . . . . . 0.536 ' N ' ' HG3' ' A' ' 78' ' ' LYS . 49.7 mm-40 -70.33 -35.9 73.92 Favored 'General case' 0 CA--C 1.515 -0.398 0 CA-C-O 121.023 0.44 . . . . 0.0 111.305 -178.63 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.51 HD21 ' CG ' ' A' ' 75' ' ' HIS . 5.2 mt -78.15 -8.02 57.77 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 120.514 -0.474 . . . . 0.0 110.712 179.843 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 84.07 38.98 9.61 Favored Glycine 0 C--N 1.321 -0.265 0 C-N-CA 120.965 -0.636 . . . . 0.0 112.777 177.905 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 61.6 mtt -100.87 162.34 12.97 Favored 'General case' 0 C--N 1.314 -0.946 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 179.193 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 83' ' ' GLU . . . . . 0.452 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 4.9 pt-20 -143.4 -171.83 3.58 Favored 'General case' 0 C--N 1.306 -1.303 0 N-CA-C 109.914 -0.402 . . . . 0.0 109.914 179.953 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -69.85 136.59 50.89 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.103 0.478 . . . . 0.0 111.235 -178.777 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 75.55 5.21 4.04 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.712 1.205 . . . . 0.0 111.285 179.306 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 86' ' ' ASP . . . . . 0.452 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 1.9 t0 -62.78 162.48 10.85 Favored 'General case' 0 C--O 1.238 0.495 0 CA-C-O 121.347 0.594 . . . . 0.0 111.065 177.719 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 87' ' ' VAL . . . . . 0.428 ' HA ' ' O ' ' A' ' 25' ' ' LYS . 11.4 p -128.51 144.07 39.09 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.911 0 CA-C-O 121.383 0.611 . . . . 0.0 111.734 -176.82 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 3.6 mp -115.5 153.66 17.02 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.758 0 N-CA-C 108.728 -0.842 . . . . 0.0 108.728 178.518 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -107.85 139.44 42.44 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 121.195 0.521 . . . . 0.0 110.915 -176.836 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 90' ' ' VAL . . . . . 0.532 ' HA ' ' O ' ' A' ' 63' ' ' ARG . 63.3 t -128.77 133.47 66.25 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.023 0 CA-C-O 121.412 0.625 . . . . 0.0 110.949 179.844 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 86.7 m-85 -118.63 179.67 4.06 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-N 115.972 -0.558 . . . . 0.0 109.79 179.183 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 7.5 tp60 -109.47 131.84 54.69 Favored 'General case' 0 C--N 1.316 -0.871 0 O-C-N 122.267 -0.271 . . . . 0.0 110.763 179.207 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 93' ' ' GLU . . . . . 0.418 ' OE1' ' HG2' ' A' ' 63' ' ' ARG . 7.4 pt-20 . . . . . 0 CA--C 1.533 0.316 0 CA-C-O 120.753 0.311 . . . . 0.0 110.691 177.899 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' ILE . . . . . 0.499 ' HB ' ' HA ' ' A' ' 84' ' ' GLU . 25.9 pt . . . . . 0 N--CA 1.441 -0.921 0 CA-C-O 121.465 0.65 . . . . 0.0 109.79 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.507 ' HE3' ' HG3' ' A' ' 85' ' ' GLU . 0.0 OUTLIER -117.43 149.03 41.24 Favored 'General case' 0 C--N 1.293 -1.872 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 -179.156 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -142.04 158.41 43.79 Favored 'General case' 0 C--N 1.3 -1.581 0 CA-C-O 121.406 0.622 . . . . 0.0 111.477 175.201 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 5.3 tmmm? -128.73 141.97 51.15 Favored 'General case' 0 N--CA 1.436 -1.158 0 CA-C-N 115.604 -0.725 . . . . 0.0 110.225 179.945 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.542 ' O ' ' HA ' ' A' ' 33' ' ' GLU . 0.9 OUTLIER -112.92 142.35 25.59 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.442 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.293 -179.372 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.464 ' O ' ' HB ' ' A' ' 90' ' ' VAL . 44.6 mm -103.92 115.22 45.45 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.359 0 N-CA-C 106.83 -1.544 . . . . 0.0 106.83 173.562 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 28' ' ' GLY . . . . . 0.439 ' HA2' ' HB ' ' A' ' 90' ' ' VAL . . . -86.26 161.64 34.41 Favored Glycine 0 N--CA 1.422 -2.256 0 C-N-CA 120.022 -1.085 . . . . 0.0 111.185 -175.971 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.17 -24.08 62.77 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-O 121.417 0.627 . . . . 0.0 111.081 176.556 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -96.9 20.1 11.63 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 121.504 0.669 . . . . 0.0 109.658 178.774 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 43.2 m 64.28 17.61 10.83 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-O 121.84 0.829 . . . . 0.0 110.53 -179.101 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 10.6 t -76.8 108.78 10.06 Favored 'General case' 0 N--CA 1.444 -0.734 0 CA-C-N 115.152 -0.931 . . . . 0.0 110.222 -179.372 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.542 ' HA ' ' O ' ' A' ' 26' ' ' VAL . 41.9 mt-10 -87.15 109.79 19.69 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 121.363 0.602 . . . . 0.0 109.943 178.38 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 33.5 mm -100.9 139.11 23.02 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.431 0 CA-C-N 116.037 -0.529 . . . . 0.0 109.596 -178.756 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 12.2 m170 -117.34 132.4 56.6 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 109.395 -0.595 . . . . 0.0 109.395 179.851 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.518 ' HZ ' HG23 ' A' ' 26' ' ' VAL . 1.3 p90 -147.61 163.9 35.16 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-O 121.216 0.532 . . . . 0.0 111.603 -178.668 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 88.1 mttt -119.66 119.47 33.8 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.66 -179.123 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.444 HG21 HD12 ' A' ' 47' ' ' LEU . 35.7 m -138.81 157.93 29.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-O 120.911 0.386 . . . . 0.0 110.276 178.904 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 47.5 mtpt -83.12 178.14 8.25 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-O 121.45 0.643 . . . . 0.0 111.426 179.073 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -87.26 -31.17 20.4 Favored 'General case' 0 C--N 1.313 -1.01 0 CA-C-O 121.371 0.605 . . . . 0.0 110.144 178.04 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 9.0 t -98.78 19.71 14.36 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.312 -177.268 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 10.0 t -105.54 176.01 5.31 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 178.678 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 53.0 m170 -91.76 147.34 23.06 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-O 121.432 0.634 . . . . 0.0 111.387 -179.426 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.613 ' HB2' ' O ' ' A' ' 75' ' ' HIS . 0.2 OUTLIER -74.58 -12.61 60.5 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 115.53 -0.759 . . . . 0.0 109.226 179.113 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.76 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -57.15 -45.11 83.88 Favored 'General case' 0 N--CA 1.442 -0.825 0 CA-C-N 115.563 -0.744 . . . . 0.0 111.899 -178.55 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.425 ' HG3' ' N ' ' A' ' 47' ' ' LEU . 19.4 ptpt -65.85 -32.1 73.43 Favored 'General case' 0 CA--C 1.508 -0.651 0 CA-C-O 121.695 0.759 . . . . 0.0 109.883 -178.888 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.536 ' HB3' HD13 ' A' ' 44' ' ' LEU . 8.2 tt -71.05 -51.55 24.65 Favored 'General case' 0 N--CA 1.428 -1.553 0 CA-C-N 115.197 -0.911 . . . . 0.0 110.738 -176.724 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.463 ' HA ' ' CD2' ' A' ' 51' ' ' TYR . 6.4 ptmm? -61.19 -41.01 96.04 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.721 -178.017 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.76 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 8.8 pt-20 -72.46 -30.92 65.0 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-O 121.029 0.443 . . . . 0.0 110.703 178.012 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 50' ' ' SER . . . . . 0.579 ' O ' ' HG2' ' A' ' 54' ' ' ARG . 32.7 t -68.71 -44.73 73.31 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.945 0.402 . . . . 0.0 111.677 -178.632 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.468 ' CD1' HG11 ' A' ' 26' ' ' VAL . 2.3 p90 -75.06 -32.82 61.61 Favored 'General case' 0 N--CA 1.446 -0.657 0 C-N-CA 119.512 -0.875 . . . . 0.0 110.176 -178.09 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 52' ' ' CYS . . . . . 0.524 ' SG ' HD11 ' A' ' 62' ' ' LEU . 83.5 m -59.8 -43.94 94.2 Favored 'General case' 0 C--O 1.238 0.454 0 CA-C-O 120.938 0.399 . . . . 0.0 110.703 177.985 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 11.9 pt20 -69.94 -33.69 72.47 Favored 'General case' 0 N--CA 1.447 -0.622 0 C-N-CA 120.769 -0.373 . . . . 0.0 110.617 -179.213 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.579 ' HG2' ' O ' ' A' ' 50' ' ' SER . 9.3 mmp_? -54.78 -40.99 69.99 Favored 'General case' 0 C--N 1.351 0.634 0 CA-C-O 121.403 0.62 . . . . 0.0 110.607 176.192 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 29.4 mt-30 -78.45 -21.48 49.05 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.747 179.6 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 81.74 27.48 46.4 Favored Glycine 0 N--CA 1.443 -0.887 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.223 179.276 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 33.9 m -127.18 148.1 64.62 Favored Pre-proline 0 C--N 1.321 -0.666 0 O-C-N 122.505 -0.409 . . . . 0.0 110.283 -179.145 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 58' ' ' PRO . . . . . 0.471 ' HG2' ' OG ' ' A' ' 61' ' ' SER . 26.0 Cg_endo -64.87 150.52 88.01 Favored 'Trans proline' 0 N--CA 1.457 -0.647 0 C-N-CA 122.278 1.985 . . . . 0.0 111.999 178.632 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.415 ' HG2' ' SG ' ' A' ' 52' ' ' CYS . 66.2 mtp -69.06 -9.11 50.97 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.231 0.538 . . . . 0.0 111.721 -176.905 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 28.8 p30 -88.82 -12.88 40.72 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-O 121.214 0.53 . . . . 0.0 111.33 -178.751 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.471 ' OG ' ' HG2' ' A' ' 58' ' ' PRO . 55.6 m -88.06 -19.08 27.59 Favored 'General case' 0 C--N 1.316 -0.878 0 N-CA-C 112.654 0.613 . . . . 0.0 112.654 -177.738 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.524 HD11 ' SG ' ' A' ' 52' ' ' CYS . 1.5 pp -132.4 159.96 37.74 Favored 'General case' 0 C--N 1.315 -0.934 0 N-CA-C 113.413 0.894 . . . . 0.0 113.413 -177.386 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.484 ' O ' ' HA ' ' A' ' 90' ' ' VAL . 50.0 mtm-85 -107.86 124.87 50.73 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 114.903 -1.044 . . . . 0.0 111.741 -177.997 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -106.09 117.26 33.56 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.545 178.329 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.472 ' C ' HD22 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -143.01 160.85 39.57 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-O 121.362 0.601 . . . . 0.0 111.161 179.951 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 90.7 t80 -141.35 134.26 28.96 Favored 'General case' 0 C--N 1.31 -1.118 0 N-CA-C 109.033 -0.729 . . . . 0.0 109.033 178.775 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.478 ' HG2' HE21 ' A' ' 69' ' ' GLN . 6.4 pt-20 50.04 26.75 2.19 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 124.124 0.97 . . . . 0.0 112.33 -179.16 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 85.02 25.03 42.22 Favored Glycine 0 N--CA 1.447 -0.627 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.948 -178.833 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 69' ' ' GLN . . . . . 0.478 HE21 ' HG2' ' A' ' 67' ' ' GLU . 3.3 pt20 -130.86 136.71 48.9 Favored 'General case' 0 C--N 1.322 -0.619 0 O-C-N 122.074 -0.663 . . . . 0.0 109.888 179.279 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.435 ' HD3' ' N ' ' A' ' 70' ' ' ARG . 0.0 OUTLIER -66.72 146.88 53.98 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-O 121.336 0.588 . . . . 0.0 110.557 178.067 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.483 HG21 HD12 ' A' ' 44' ' ' LEU . 20.9 mm -101.45 118.05 47.64 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.133 0 CA-C-O 120.89 0.376 . . . . 0.0 110.264 -179.535 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -99.65 167.34 10.63 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-O 120.882 0.373 . . . . 0.0 110.365 -179.517 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 73' ' ' ASP . . . . . 0.506 ' CA ' ' HB3' ' A' ' 45' ' ' LYS . 7.8 p-10 -67.92 -22.1 65.09 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-O 121.194 0.521 . . . . 0.0 111.391 -179.618 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 8.0 m-80 -98.56 1.09 46.15 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-O 121.338 0.589 . . . . 0.0 110.076 -178.324 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 75' ' ' HIS . . . . . 0.613 ' O ' ' HB2' ' A' ' 44' ' ' LEU . 2.1 m170 -80.8 142.71 33.46 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 -179.512 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.47 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 81.0 p -116.96 153.25 49.44 Favored Pre-proline 0 C--N 1.306 -1.302 0 CA-C-N 116.79 -0.186 . . . . 0.0 111.29 -179.949 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_exo -58.2 -39.68 82.89 Favored 'Trans proline' 0 C--N 1.347 0.484 0 C-N-CA 122.492 2.128 . . . . 0.0 111.586 178.809 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 78' ' ' LYS . . . . . 0.518 ' HG3' ' N ' ' A' ' 79' ' ' GLU . 32.7 pttt -67.39 -39.61 85.62 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.082 -178.379 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 79' ' ' GLU . . . . . 0.518 ' N ' ' HG3' ' A' ' 78' ' ' LYS . 45.9 mm-40 -73.31 -35.66 66.11 Favored 'General case' 0 CA--C 1.511 -0.553 0 CA-C-O 121.166 0.508 . . . . 0.0 110.936 -179.206 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.486 HD21 ' CG ' ' A' ' 75' ' ' HIS . 5.4 mt -81.1 -3.93 53.6 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.074 0.464 . . . . 0.0 110.96 -179.456 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 75.45 48.1 11.32 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.972 -0.632 . . . . 0.0 112.813 177.738 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 63.5 mtt -105.64 161.13 14.65 Favored 'General case' 0 C--N 1.315 -0.929 0 N-CA-C 110.023 -0.362 . . . . 0.0 110.023 178.83 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 14.2 pt-20 -143.04 -173.03 3.8 Favored 'General case' 0 C--N 1.317 -0.841 0 N-CA-C 109.917 -0.401 . . . . 0.0 109.917 179.134 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.499 ' HA ' ' HB ' ' A' ' 22' ' ' ILE . 11.6 pt-20 -68.33 126.46 29.66 Favored 'General case' 0 N--CA 1.447 -0.584 0 CA-C-O 121.466 0.65 . . . . 0.0 111.68 -179.188 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 85' ' ' GLU . . . . . 0.507 ' HG3' ' HE3' ' A' ' 23' ' ' LYS . 33.5 mt-10 77.54 8.39 2.66 Favored 'General case' 0 C--N 1.322 -0.625 0 C-N-CA 124.723 1.209 . . . . 0.0 112.738 177.19 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -63.42 167.15 5.69 Favored 'General case' 0 C--O 1.239 0.539 0 CA-C-O 121.082 0.468 . . . . 0.0 110.302 174.754 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 15.0 p -125.9 143.93 37.73 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.036 0 CA-C-O 121.516 0.674 . . . . 0.0 111.752 -176.153 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 88' ' ' ILE . . . . . 0.425 ' HB ' HG22 ' A' ' 26' ' ' VAL . 2.3 mt -111.86 152.96 13.63 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 N-CA-C 108.836 -0.801 . . . . 0.0 108.836 177.646 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 89' ' ' GLU . . . . . 0.404 ' O ' HD13 ' A' ' 65' ' ' LEU . 9.5 tp10 -106.64 137.44 44.65 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-O 120.924 0.392 . . . . 0.0 110.58 -177.38 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 90' ' ' VAL . . . . . 0.484 ' HA ' ' O ' ' A' ' 63' ' ' ARG . 90.2 t -129.02 133.4 66.08 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-O 121.317 0.58 . . . . 0.0 111.454 178.667 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 82.1 m-85 -118.92 178.41 4.5 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.375 179.429 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 9.5 tp60 -105.15 135.95 45.54 Favored 'General case' 0 C--N 1.31 -1.124 0 O-C-N 122.241 -0.287 . . . . 0.0 110.623 -179.281 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 . . . . . 0 C--N 1.33 -0.28 0 CA-C-O 121.262 0.553 . . . . 0.0 110.403 176.358 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 22' ' ' ILE . . . . . 0.4 ' HB ' ' HA ' ' A' ' 84' ' ' GLU . 24.0 pt . . . . . 0 N--CA 1.445 -0.678 0 N-CA-C 109.395 -0.594 . . . . 0.0 109.395 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 45.3 mtmt -115.75 142.54 46.61 Favored 'General case' 0 C--N 1.294 -1.827 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 -179.509 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.4 mp -136.21 162.59 32.55 Favored 'General case' 0 C--N 1.302 -1.473 0 CA-C-O 121.098 0.475 . . . . 0.0 110.445 175.257 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.45 ' HE2' ' HB3' ' A' ' 25' ' ' LYS . 5.3 tmmm? -133.62 143.59 48.72 Favored 'General case' 0 C--N 1.308 -1.211 0 CA-C-O 121.403 0.621 . . . . 0.0 110.592 -178.786 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.511 HG23 ' HZ ' ' A' ' 36' ' ' PHE . 0.9 OUTLIER -115.0 143.33 24.98 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.454 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.046 -179.896 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.421 ' O ' ' HB ' ' A' ' 90' ' ' VAL . 45.4 mm -107.61 116.57 51.42 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.022 0 N-CA-C 107.683 -1.228 . . . . 0.0 107.683 175.392 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 28' ' ' GLY . . . . . 0.453 ' HA2' ' HB ' ' A' ' 90' ' ' VAL . . . -84.65 175.44 50.68 Favored Glycine 0 N--CA 1.419 -2.488 0 C-N-CA 120.158 -1.02 . . . . 0.0 111.834 -177.312 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.57 -22.18 63.55 Favored 'General case' 0 C--N 1.302 -1.476 0 CA-C-O 121.626 0.727 . . . . 0.0 110.324 179.906 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -100.57 13.73 33.71 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.693 -0.685 . . . . 0.0 109.219 178.523 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 19.3 m 71.49 15.59 6.11 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 115.376 -0.829 . . . . 0.0 111.319 179.265 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 10.9 t -72.35 114.59 10.63 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 109.697 -0.482 . . . . 0.0 109.697 179.199 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.445 ' HA ' ' O ' ' A' ' 26' ' ' VAL . 34.5 mt-10 -87.55 108.62 19.14 Favored 'General case' 0 CA--C 1.509 -0.61 0 CA-C-O 121.164 0.507 . . . . 0.0 110.42 179.187 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.437 HG21 ' HA ' ' A' ' 51' ' ' TYR . 38.9 mm -97.88 137.69 24.76 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.589 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 179.206 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 12.4 m170 -115.97 136.56 52.92 Favored 'General case' 0 C--N 1.315 -0.918 0 N-CA-C 109.3 -0.63 . . . . 0.0 109.3 -179.045 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.511 ' HZ ' HG23 ' A' ' 26' ' ' VAL . 0.5 OUTLIER -147.28 155.66 42.24 Favored 'General case' 0 C--N 1.308 -1.196 0 CA-C-O 121.309 0.576 . . . . 0.0 111.275 -178.501 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 93.4 mttt -113.67 113.37 24.92 Favored 'General case' 0 C--N 1.31 -1.13 0 CA-C-N 115.723 -0.672 . . . . 0.0 109.999 -179.177 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.416 HG21 HD12 ' A' ' 47' ' ' LEU . 28.2 m -134.91 158.18 41.28 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.768 0 CA-C-O 120.87 0.367 . . . . 0.0 110.069 -179.792 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.533 ' O ' HG22 ' A' ' 42' ' ' THR . 80.8 tttt -90.33 165.13 14.05 Favored 'General case' 0 C--N 1.311 -1.066 0 O-C-N 121.822 -0.549 . . . . 0.0 110.683 -179.021 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -70.14 -37.02 75.16 Favored 'General case' 0 N--CA 1.463 0.224 0 O-C-N 121.969 -0.457 . . . . 0.0 111.854 -177.771 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 14.5 t -97.13 19.09 13.51 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-O 120.939 0.4 . . . . 0.0 111.93 -176.471 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' THR . . . . . 0.533 HG22 ' O ' ' A' ' 39' ' ' LYS . 3.4 t -100.24 167.64 10.3 Favored 'General case' 0 C--N 1.323 -0.561 0 O-C-N 121.797 -0.564 . . . . 0.0 109.72 178.855 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 37.3 m170 -82.16 141.77 32.78 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 121.576 0.703 . . . . 0.0 111.459 179.903 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.645 HD13 ' HB3' ' A' ' 47' ' ' LEU . 0.2 OUTLIER -70.84 -13.88 62.2 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.459 -0.791 . . . . 0.0 109.731 -179.741 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.728 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -54.59 -43.65 72.34 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 115.787 -0.642 . . . . 0.0 112.009 -179.31 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.434 ' N ' ' HD3' ' A' ' 45' ' ' LYS . 21.9 ptmt -69.23 -28.4 66.31 Favored 'General case' 0 C--O 1.201 -1.451 0 CA-C-O 120.911 0.386 . . . . 0.0 110.462 -179.158 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.645 ' HB3' HD13 ' A' ' 44' ' ' LEU . 8.4 tt -74.36 -49.34 23.14 Favored 'General case' 0 C--N 1.302 -1.459 0 CA-C-O 120.994 0.426 . . . . 0.0 110.631 -178.855 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.453 ' HA ' ' CD2' ' A' ' 51' ' ' TYR . 6.8 ptmm? -62.6 -43.17 99.47 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.328 -0.397 . . . . 0.0 111.404 -177.555 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.728 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 8.1 pt-20 -70.8 -33.47 70.76 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-O 121.021 0.439 . . . . 0.0 110.626 178.139 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 50' ' ' SER . . . . . 0.673 ' O ' ' HG2' ' A' ' 54' ' ' ARG . 10.5 m -67.81 -41.87 82.42 Favored 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 -178.122 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.505 ' CD1' HG11 ' A' ' 26' ' ' VAL . 3.4 p90 -76.68 -33.09 58.27 Favored 'General case' 0 C--N 1.32 -0.707 0 C-N-CA 119.129 -1.029 . . . . 0.0 110.392 -178.532 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 52' ' ' CYS . . . . . 0.593 ' SG ' HD11 ' A' ' 62' ' ' LEU . 90.6 m -62.42 -44.89 95.34 Favored 'General case' 0 CA--C 1.509 -0.625 0 CA-C-O 121.296 0.57 . . . . 0.0 110.465 179.419 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 53' ' ' GLN . . . . . 0.438 ' HG2' ' O ' ' A' ' 50' ' ' SER . 13.8 pt20 -67.23 -33.83 76.19 Favored 'General case' 0 N--CA 1.44 -0.953 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.743 -179.392 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.673 ' HG2' ' O ' ' A' ' 50' ' ' SER . 40.4 mmt180 -56.59 -44.4 81.04 Favored 'General case' 0 C--N 1.351 0.638 0 CA-C-O 121.368 0.604 . . . . 0.0 110.434 177.002 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 37.1 mt-30 -73.38 -20.82 60.66 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.736 -0.666 . . . . 0.0 111.462 -179.555 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 79.66 33.37 34.5 Favored Glycine 0 N--CA 1.448 -0.547 0 C-N-CA 120.675 -0.774 . . . . 0.0 111.765 -179.758 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 29.1 m -132.93 151.28 77.72 Favored Pre-proline 0 C--O 1.24 0.565 0 O-C-N 122.532 -0.393 . . . . 0.0 110.518 -179.298 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' PRO . . . . . 0.463 ' HG2' ' OG ' ' A' ' 61' ' ' SER . 40.9 Cg_endo -69.62 148.93 67.08 Favored 'Trans proline' 0 N--CA 1.459 -0.555 0 C-N-CA 122.506 2.138 . . . . 0.0 112.307 179.065 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.526 ' HG2' ' SG ' ' A' ' 52' ' ' CYS . 72.8 mtp -71.22 -11.28 60.84 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.602 -0.726 . . . . 0.0 111.637 -177.382 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 24.7 p30 -88.02 -12.2 45.09 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-O 121.311 0.577 . . . . 0.0 111.461 -179.191 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.463 ' OG ' ' HG2' ' A' ' 58' ' ' PRO . 66.4 m -90.49 -20.85 22.23 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-O 120.928 0.394 . . . . 0.0 111.951 -179.585 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.593 HD11 ' SG ' ' A' ' 52' ' ' CYS . 2.0 pp -123.32 164.99 17.75 Favored 'General case' 0 C--N 1.313 -0.986 0 N-CA-C 113.031 0.752 . . . . 0.0 113.031 -177.796 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.532 ' O ' ' HA ' ' A' ' 90' ' ' VAL . 5.8 mtp180 -114.47 123.13 48.64 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.538 -0.755 . . . . 0.0 110.585 -178.691 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.461 ' HB3' ' OH ' ' A' ' 51' ' ' TYR . 0.2 OUTLIER -104.27 113.48 27.06 Favored 'General case' 0 C--N 1.307 -1.278 0 CA-C-O 120.986 0.422 . . . . 0.0 110.145 176.53 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.446 ' C ' HD22 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -142.79 165.13 28.21 Favored 'General case' 0 N--CA 1.438 -1.068 0 CA-C-O 121.634 0.73 . . . . 0.0 111.88 -179.144 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 92.3 t80 -145.44 134.76 23.0 Favored 'General case' 0 C--N 1.305 -1.361 0 N-CA-C 108.542 -0.91 . . . . 0.0 108.542 178.537 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.448 ' HG2' HE21 ' A' ' 69' ' ' GLN . 5.3 pt-20 50.24 26.7 2.3 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 124.359 1.064 . . . . 0.0 112.204 -177.927 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 86.79 17.5 59.72 Favored Glycine 0 CA--C 1.519 0.287 0 C-N-CA 120.781 -0.723 . . . . 0.0 113.314 -178.803 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 69' ' ' GLN . . . . . 0.448 HE21 ' HG2' ' A' ' 67' ' ' GLU . 2.9 pt20 -124.39 134.65 53.06 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 -179.74 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -70.25 146.7 50.47 Favored 'General case' 0 C--N 1.312 -1.032 0 CA-C-O 121.376 0.608 . . . . 0.0 110.301 178.017 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.501 HG21 HD12 ' A' ' 44' ' ' LEU . 22.7 mm -94.36 122.76 46.11 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.55 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.283 -178.557 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -98.79 166.75 11.16 Favored 'General case' 0 N--CA 1.439 -0.978 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 -179.499 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -67.55 -26.0 66.09 Favored 'General case' 0 C--N 1.313 -1.001 0 CA-C-O 121.265 0.555 . . . . 0.0 111.259 -178.421 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 8.1 m-80 -97.23 4.99 50.79 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-O 121.327 0.584 . . . . 0.0 110.097 -177.799 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 75' ' ' HIS . . . . . 0.603 ' O ' ' HB2' ' A' ' 44' ' ' LEU . 2.5 m170 -83.68 145.94 28.51 Favored 'General case' 0 CA--C 1.507 -0.71 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 179.232 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.42 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 43.7 p -122.81 158.76 56.12 Favored Pre-proline 0 C--N 1.31 -1.119 0 C-N-CA 121.012 -0.275 . . . . 0.0 110.742 179.003 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_exo -60.81 -40.54 53.09 Favored 'Trans proline' 0 N--CA 1.457 -0.627 0 C-N-CA 122.538 2.159 . . . . 0.0 111.604 179.054 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 78' ' ' LYS . . . . . 0.521 ' HG3' ' N ' ' A' ' 79' ' ' GLU . 20.7 pttt -68.99 -36.75 78.18 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.947 0.404 . . . . 0.0 110.992 -177.935 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 79' ' ' GLU . . . . . 0.521 ' N ' ' HG3' ' A' ' 78' ' ' LYS . 52.5 mm-40 -69.84 -40.56 75.74 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-O 120.921 0.391 . . . . 0.0 110.636 -179.243 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.42 ' HG ' ' O ' ' A' ' 76' ' ' THR . 5.4 mt -79.74 -6.71 57.78 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.25 0.548 . . . . 0.0 110.864 -178.985 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 80.45 45.14 8.17 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.967 -0.635 . . . . 0.0 113.01 177.794 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 59.5 mtt -102.7 163.33 12.28 Favored 'General case' 0 C--N 1.317 -0.806 0 N-CA-C 109.755 -0.461 . . . . 0.0 109.755 178.388 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -136.93 -172.45 3.19 Favored 'General case' 0 C--N 1.312 -1.045 0 CA-C-O 120.884 0.373 . . . . 0.0 110.01 179.113 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.4 ' HA ' ' HB ' ' A' ' 22' ' ' ILE . 12.6 pt-20 -70.43 141.47 52.1 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 177.738 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 73.78 1.93 4.07 Favored 'General case' 0 CA--C 1.552 1.05 0 C-N-CA 123.826 0.851 . . . . 0.0 111.283 179.868 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -63.91 161.77 15.03 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-O 121.269 0.557 . . . . 0.0 110.97 179.123 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 87' ' ' VAL . . . . . 0.421 ' HA ' ' O ' ' A' ' 25' ' ' LYS . 8.6 p -127.64 142.88 42.43 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.079 0 CA-C-O 121.418 0.627 . . . . 0.0 111.505 -176.302 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 3.7 mp -112.57 152.93 14.27 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.855 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 178.667 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 89' ' ' GLU . . . . . 0.407 ' O ' HD13 ' A' ' 65' ' ' LEU . 7.2 tp10 -105.43 137.49 43.17 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-O 120.969 0.414 . . . . 0.0 110.484 -175.785 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 90' ' ' VAL . . . . . 0.532 ' HA ' ' O ' ' A' ' 63' ' ' ARG . 78.4 t -128.75 135.7 61.64 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.887 0 CA-C-O 121.259 0.552 . . . . 0.0 110.793 179.16 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 91.8 m-85 -122.71 177.84 5.28 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.201 179.155 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 9.6 tp60 -108.44 121.32 44.7 Favored 'General case' 0 C--N 1.312 -1.051 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 179.553 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 93' ' ' GLU . . . . . 0.466 ' HB3' ' CG ' ' A' ' 63' ' ' ARG . 9.3 pt-20 . . . . . 0 C--O 1.236 0.349 0 CA-C-O 121.022 0.439 . . . . 0.0 111.068 179.991 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' ILE . . . . . 0.418 HD13 ' HG2' ' A' ' 40' ' ' MET . 23.0 pt . . . . . 0 N--CA 1.444 -0.744 0 CA-C-O 121.39 0.614 . . . . 0.0 110.446 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.414 ' HE3' ' HB2' ' A' ' 23' ' ' LYS . 40.8 mtmt -119.11 142.07 48.23 Favored 'General case' 0 C--N 1.304 -1.406 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 -179.367 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.5 mp -136.04 164.11 28.77 Favored 'General case' 0 C--N 1.304 -1.411 0 CA-C-O 121.268 0.556 . . . . 0.0 110.811 176.097 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.42 ' HE2' ' HB3' ' A' ' 25' ' ' LYS . 5.6 tmmm? -136.45 145.06 44.79 Favored 'General case' 0 C--N 1.311 -1.107 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.448 -179.271 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.55 ' O ' ' HA ' ' A' ' 33' ' ' GLU . 0.9 OUTLIER -115.73 142.44 28.93 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.291 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.968 -179.768 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.434 ' CD1' ' HG2' ' A' ' 33' ' ' GLU . 45.4 mm -109.17 98.15 6.66 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.874 0 N-CA-C 108.498 -0.927 . . . . 0.0 108.498 175.884 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 28' ' ' GLY . . . . . 0.545 ' HA2' ' HB ' ' A' ' 90' ' ' VAL . . . -67.12 166.04 41.66 Favored Glycine 0 N--CA 1.436 -1.339 0 C-N-CA 120.45 -0.881 . . . . 0.0 112.764 178.321 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.43 -16.9 40.47 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 121.129 0.49 . . . . 0.0 112.311 179.209 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -102.76 18.1 22.25 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 121.487 0.66 . . . . 0.0 109.69 178.754 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 7.3 m 69.72 17.21 7.79 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.376 -179.134 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 12.8 t -73.46 108.48 6.35 Favored 'General case' 0 N--CA 1.444 -0.766 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.698 -178.458 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.55 ' HA ' ' O ' ' A' ' 26' ' ' VAL . 40.6 mt-10 -87.09 104.29 16.19 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-O 121.111 0.481 . . . . 0.0 110.479 178.287 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 40.2 mm -97.21 136.86 26.55 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.426 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 178.103 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 12.8 m170 -114.78 134.48 55.08 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 -178.148 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.524 ' HZ ' HG23 ' A' ' 26' ' ' VAL . 1.1 p90 -147.15 158.37 43.92 Favored 'General case' 0 C--N 1.309 -1.193 0 CA-C-O 121.397 0.618 . . . . 0.0 111.061 -178.919 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 7.3 ptpt -120.1 120.74 37.13 Favored 'General case' 0 C--N 1.307 -1.26 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.289 -178.913 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 33.4 m -139.87 162.0 25.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-O 121.352 0.596 . . . . 0.0 110.962 -178.514 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.58 ' O ' HG22 ' A' ' 42' ' ' THR . 19.1 mmmt -80.8 156.03 26.35 Favored 'General case' 0 C--N 1.312 -1.025 0 CA-C-O 121.027 0.442 . . . . 0.0 110.851 177.488 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 40' ' ' MET . . . . . 0.443 ' O ' ' HG2' ' A' ' 78' ' ' LYS . 0.0 OUTLIER -70.55 -35.51 73.15 Favored 'General case' 0 CA--C 1.506 -0.746 0 CA-C-O 121.404 0.621 . . . . 0.0 109.903 177.521 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 12.9 t -91.98 18.48 7.85 Favored 'General case' 0 N--CA 1.438 -1.035 0 CA-C-N 115.724 -0.671 . . . . 0.0 112.284 -176.396 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' THR . . . . . 0.58 HG22 ' O ' ' A' ' 39' ' ' LYS . 3.7 t -105.51 169.93 8.18 Favored 'General case' 0 C--N 1.323 -0.579 0 O-C-N 121.876 -0.515 . . . . 0.0 110.157 -179.705 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 4.6 m-70 -81.65 141.65 33.46 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 121.561 0.696 . . . . 0.0 111.487 179.79 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.6 HD13 ' HB3' ' A' ' 47' ' ' LEU . 0.2 OUTLIER -70.96 -12.14 61.37 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 115.303 -0.862 . . . . 0.0 109.596 179.702 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.813 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -55.65 -50.24 70.75 Favored 'General case' 0 N--CA 1.441 -0.884 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.802 -179.186 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.521 ' O ' ' HB2' ' A' ' 50' ' ' SER . 20.7 ptmt -63.31 -29.14 70.51 Favored 'General case' 0 C--O 1.218 -0.576 0 CA-C-O 121.318 0.58 . . . . 0.0 110.688 -177.928 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.6 ' HB3' HD13 ' A' ' 44' ' ' LEU . 8.4 tt -72.63 -50.86 22.36 Favored 'General case' 0 C--N 1.307 -1.265 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.766 -179.072 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.482 ' HA ' ' CD2' ' A' ' 51' ' ' TYR . 7.2 ptmm? -62.97 -41.28 99.49 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.923 0.392 . . . . 0.0 111.764 -177.537 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.813 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 7.0 pt-20 -72.25 -30.06 64.51 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-O 121.104 0.478 . . . . 0.0 110.528 177.828 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 50' ' ' SER . . . . . 0.684 ' O ' ' HG2' ' A' ' 54' ' ' ARG . 15.7 t -68.58 -45.69 71.37 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.414 -179.151 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.482 ' CD2' ' HA ' ' A' ' 48' ' ' LYS . 2.7 p90 -74.74 -32.93 62.25 Favored 'General case' 0 N--CA 1.448 -0.538 0 C-N-CA 119.772 -0.771 . . . . 0.0 110.48 -177.266 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 52' ' ' CYS . . . . . 0.497 ' SG ' HD11 ' A' ' 62' ' ' LEU . 98.6 m -60.93 -44.27 97.47 Favored 'General case' 0 C--O 1.239 0.541 0 CA-C-O 120.879 0.371 . . . . 0.0 110.822 179.048 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 10.6 pt20 -70.52 -31.57 68.7 Favored 'General case' 0 N--CA 1.444 -0.742 0 C-N-CA 120.368 -0.533 . . . . 0.0 110.966 -179.274 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.684 ' HG2' ' O ' ' A' ' 50' ' ' SER . 34.0 mmt180 -57.41 -36.3 71.15 Favored 'General case' 0 C--N 1.351 0.64 0 CA-C-O 121.237 0.541 . . . . 0.0 110.496 176.616 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 31.2 mt-30 -83.61 -20.82 33.01 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.844 179.797 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 80.88 33.09 30.92 Favored Glycine 0 N--CA 1.446 -0.666 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.47 178.933 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 35.1 m -132.33 148.65 70.53 Favored Pre-proline 0 C--N 1.322 -0.594 0 O-C-N 122.481 -0.423 . . . . 0.0 110.46 -179.8 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 58' ' ' PRO . . . . . 0.474 ' HG2' ' OG ' ' A' ' 61' ' ' SER . 28.8 Cg_endo -65.18 149.29 88.99 Favored 'Trans proline' 0 N--CA 1.458 -0.582 0 C-N-CA 122.31 2.007 . . . . 0.0 111.705 178.136 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.485 ' HG2' ' SG ' ' A' ' 52' ' ' CYS . 66.8 mtp -71.55 -9.32 58.04 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.524 -176.312 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 33.2 p30 -87.75 -10.25 51.61 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-O 121.404 0.621 . . . . 0.0 111.029 -178.959 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.474 ' OG ' ' HG2' ' A' ' 58' ' ' PRO . 74.3 m -90.11 -24.66 21.04 Favored 'General case' 0 N--CA 1.434 -1.245 0 CA-C-N 115.936 -0.575 . . . . 0.0 112.1 -177.579 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.497 HD11 ' SG ' ' A' ' 52' ' ' CYS . 1.5 pp -123.53 167.41 13.94 Favored 'General case' 0 C--N 1.307 -1.276 0 N-CA-C 112.538 0.57 . . . . 0.0 112.538 -177.483 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.483 ' O ' ' HA ' ' A' ' 90' ' ' VAL . 74.2 mtm180 -119.18 119.27 33.65 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.095 -176.949 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -100.9 116.08 31.92 Favored 'General case' 0 C--N 1.31 -1.113 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.847 178.587 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.449 ' C ' HD22 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -144.29 164.2 31.45 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.342 0.591 . . . . 0.0 110.918 -179.925 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 87.7 t80 -145.92 134.09 21.63 Favored 'General case' 0 C--N 1.309 -1.187 0 N-CA-C 109.219 -0.66 . . . . 0.0 109.219 178.388 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.425 ' HG2' HE21 ' A' ' 69' ' ' GLN . 7.9 pt-20 49.69 27.13 2.07 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 124.291 1.036 . . . . 0.0 112.563 -179.825 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 90.15 16.91 55.01 Favored Glycine 0 CA--C 1.521 0.411 0 C-N-CA 121.033 -0.603 . . . . 0.0 113.391 179.255 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 69' ' ' GLN . . . . . 0.425 HE21 ' HG2' ' A' ' 67' ' ' GLU . 2.7 pt20 -127.97 133.92 49.24 Favored 'General case' 0 C--N 1.317 -0.842 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 -179.986 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -72.36 146.85 46.79 Favored 'General case' 0 C--N 1.309 -1.193 0 CA-C-O 121.588 0.709 . . . . 0.0 110.705 178.807 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.472 HG21 HD12 ' A' ' 44' ' ' LEU . 20.7 mm -93.81 117.28 37.02 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.482 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.3 -178.611 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.409 ' O ' ' HB2' ' A' ' 75' ' ' HIS . . . -97.73 162.78 13.11 Favored 'General case' 0 N--CA 1.436 -1.141 0 N-CA-C 109.872 -0.418 . . . . 0.0 109.872 -179.761 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 73' ' ' ASP . . . . . 0.485 ' O ' ' HB3' ' A' ' 45' ' ' LYS . 7.4 p-10 -65.82 -22.46 66.56 Favored 'General case' 0 C--N 1.312 -1.039 0 CA-C-O 121.168 0.509 . . . . 0.0 111.7 -179.347 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 10.7 m-80 -96.03 2.86 53.65 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-O 121.382 0.61 . . . . 0.0 110.135 179.53 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 75' ' ' HIS . . . . . 0.595 ' O ' ' HB2' ' A' ' 44' ' ' LEU . 3.4 m170 -83.83 146.56 28.04 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 109.597 -0.519 . . . . 0.0 109.597 178.565 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.52 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 72.4 p -122.54 156.18 61.56 Favored Pre-proline 0 C--N 1.31 -1.147 0 O-C-N 122.307 -0.246 . . . . 0.0 111.062 178.555 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 25.0 Cg_exo -62.07 -37.45 64.01 Favored 'Trans proline' 0 C--N 1.351 0.676 0 C-N-CA 122.319 2.013 . . . . 0.0 110.999 179.243 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 78' ' ' LYS . . . . . 0.443 ' HG2' ' O ' ' A' ' 40' ' ' MET . 14.6 ptmt -67.26 -40.84 86.28 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.577 -179.165 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 47.4 mm-40 -75.33 -35.45 61.19 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 120.936 0.398 . . . . 0.0 111.355 -178.356 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.52 ' HG ' ' O ' ' A' ' 76' ' ' THR . 5.9 mt -79.27 -4.0 48.63 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-O 121.074 0.464 . . . . 0.0 110.688 179.762 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 74.04 47.85 17.51 Favored Glycine 0 N--CA 1.445 -0.759 0 C-N-CA 120.815 -0.707 . . . . 0.0 112.622 178.229 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 64.4 mtt -103.6 165.5 10.99 Favored 'General case' 0 C--N 1.313 -0.982 0 N-CA-C 109.516 -0.55 . . . . 0.0 109.516 178.204 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 83' ' ' GLU . . . . . 0.475 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 12.9 pt-20 -139.62 -172.88 3.47 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-O 120.842 0.354 . . . . 0.0 110.465 178.838 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -72.7 137.84 46.23 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-O 121.234 0.54 . . . . 0.0 111.152 -179.216 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 26.0 tt0 77.34 3.43 3.16 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.791 1.237 . . . . 0.0 111.052 179.495 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 86' ' ' ASP . . . . . 0.475 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 0.5 OUTLIER -60.62 162.45 6.5 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 121.366 0.603 . . . . 0.0 111.212 178.135 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 13.5 p -128.18 146.63 33.4 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.176 0 CA-C-O 121.207 0.527 . . . . 0.0 110.675 -177.677 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 3.8 mp -114.75 152.16 16.41 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.99 0 N-CA-C 108.844 -0.799 . . . . 0.0 108.844 178.536 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -104.9 138.77 40.63 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 109.931 -0.396 . . . . 0.0 109.931 -176.52 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 90' ' ' VAL . . . . . 0.545 ' HB ' ' HA2' ' A' ' 28' ' ' GLY . 85.5 t -128.91 134.72 63.75 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.834 0 CA-C-O 121.439 0.638 . . . . 0.0 111.302 179.312 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 75.1 m-85 -118.22 -179.73 3.86 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.93 -0.577 . . . . 0.0 109.578 179.08 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 8.5 tp60 -107.13 142.4 36.88 Favored 'General case' 0 C--N 1.313 -0.992 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 177.364 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 93' ' ' GLU . . . . . 0.466 ' OE2' ' HG2' ' A' ' 63' ' ' ARG . 11.1 pt-20 . . . . . 0 C--N 1.326 -0.414 0 CA-C-O 121.325 0.583 . . . . 0.0 111.117 176.497 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 23.8 ptt? . . . . . 0 N--CA 1.474 0.756 0 CA-C-O 120.572 0.225 . . . . 0.0 111.258 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 8.7 m -64.6 -16.03 62.05 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-O 121.602 0.715 . . . . 0.0 110.703 178.273 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 14.5 p-10 -89.75 38.6 0.92 Allowed 'General case' 0 C--N 1.318 -0.765 0 CA-C-O 121.856 0.836 . . . . 0.0 109.654 179.073 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' GLN . . . . . 0.405 ' HG2' ' H ' ' A' ' 4' ' ' GLN . 8.8 pt20 -90.49 14.53 12.82 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.226 -0.897 . . . . 0.0 111.358 -176.206 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -87.97 155.61 19.75 Favored 'General case' 0 C--N 1.3 -1.561 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.17 179.683 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -162.2 174.42 12.92 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-O 120.957 0.408 . . . . 0.0 110.196 -177.938 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.76 156.91 62.54 Favored Pre-proline 0 C--N 1.311 -1.101 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.158 177.56 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -66.0 108.3 1.28 Allowed 'Trans proline' 0 N--CA 1.463 -0.276 0 C-N-CA 122.341 2.027 . . . . 0.0 112.801 -177.862 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 64.2 m -137.45 36.88 2.48 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-O 121.276 0.56 . . . . 0.0 109.632 178.34 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 24.3 p -55.92 147.05 20.4 Favored 'General case' 0 C--O 1.241 0.643 0 CA-C-O 121.453 0.644 . . . . 0.0 112.051 -179.703 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -81.85 106.2 13.59 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.594 -179.31 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -84.65 -40.0 17.94 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-O 121.678 0.752 . . . . 0.0 109.791 178.116 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 2.6 pp -149.77 173.06 14.15 Favored 'General case' 0 N--CA 1.436 -1.165 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.339 -177.799 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -134.72 38.79 1.77 Allowed Glycine 0 N--CA 1.436 -1.325 0 N-CA-C 111.234 -0.746 . . . . 0.0 111.234 179.748 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -101.56 96.29 7.02 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-O 121.045 0.45 . . . . 0.0 109.864 -178.802 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -164.85 166.09 19.94 Favored 'General case' 0 C--N 1.312 -1.029 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 -179.046 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -93.49 156.09 16.96 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-O 121.057 0.456 . . . . 0.0 110.452 -179.69 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.608 ' HA ' ' CE2' ' A' ' 21' ' ' TYR . 4.7 pt-20 -87.22 176.6 7.49 Favored 'General case' 0 C--N 1.314 -0.935 0 CA-C-N 116.508 -0.315 . . . . 0.0 110.23 177.215 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -164.3 -92.95 0.09 OUTLIER Glycine 0 N--CA 1.433 -1.527 0 C-N-CA 119.715 -1.231 . . . . 0.0 112.77 -177.12 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -124.08 6.86 8.56 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-O 121.048 0.451 . . . . 0.0 110.649 -178.856 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.608 ' CE2' ' HA ' ' A' ' 18' ' ' GLU . 47.9 p90 -88.69 152.8 21.58 Favored 'General case' 0 N--CA 1.447 -0.624 0 CA-C-O 121.381 0.61 . . . . 0.0 111.682 -179.019 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.427 ' HB ' ' HA ' ' A' ' 84' ' ' GLU . 18.3 pt -113.42 171.52 3.83 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.2 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.356 -179.192 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.56 ' HG2' ' HG2' ' A' ' 37' ' ' LYS . 50.9 mtmt -111.1 146.31 37.03 Favored 'General case' 0 C--N 1.305 -1.335 0 N-CA-C 109.726 -0.472 . . . . 0.0 109.726 179.756 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.9 mp -139.4 159.44 42.15 Favored 'General case' 0 C--N 1.295 -1.774 0 CA-C-O 121.095 0.474 . . . . 0.0 110.381 173.233 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.45 ' HE2' ' HB3' ' A' ' 25' ' ' LYS . 5.0 tmmm? -129.9 142.67 50.62 Favored 'General case' 0 N--CA 1.437 -1.083 0 CA-C-O 121.325 0.583 . . . . 0.0 110.426 -179.349 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.616 ' O ' ' HA ' ' A' ' 33' ' ' GLU . 0.9 OUTLIER -114.6 142.53 27.01 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.384 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.592 -179.163 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.473 HD13 ' HG2' ' A' ' 33' ' ' GLU . 47.4 mm -105.79 113.83 43.62 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.987 0 N-CA-C 107.243 -1.391 . . . . 0.0 107.243 174.691 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' GLY . . . . . 0.488 ' HA2' ' HB ' ' A' ' 90' ' ' VAL . . . -83.39 171.64 50.06 Favored Glycine 0 N--CA 1.425 -2.089 0 C-N-CA 119.998 -1.096 . . . . 0.0 111.804 -176.622 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.86 -23.61 65.28 Favored 'General case' 0 C--N 1.305 -1.363 0 CA-C-O 121.438 0.637 . . . . 0.0 111.03 178.108 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -103.34 15.32 29.42 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-O 121.578 0.704 . . . . 0.0 109.642 178.931 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 32.4 m 73.91 23.34 2.26 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-O 122.635 1.207 . . . . 0.0 108.192 -178.907 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.1 m -66.6 95.58 0.34 Allowed 'General case' 0 N--CA 1.428 -1.548 0 CA-C-N 113.285 -1.78 . . . . 0.0 111.106 -179.17 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.616 ' HA ' ' O ' ' A' ' 26' ' ' VAL . 38.6 mt-10 -83.71 106.89 15.78 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 121.533 0.682 . . . . 0.0 111.127 179.424 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.437 HG21 ' HA ' ' A' ' 51' ' ' TYR . 40.1 mm -103.62 140.42 21.83 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.431 0 CA-C-N 115.7 -0.682 . . . . 0.0 109.57 179.393 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 13.0 m170 -115.97 132.48 56.64 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 -179.625 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.557 ' HZ ' HG23 ' A' ' 26' ' ' VAL . 1.0 OUTLIER -147.24 159.33 43.77 Favored 'General case' 0 C--N 1.312 -1.031 0 CA-C-O 121.445 0.64 . . . . 0.0 112.003 -178.904 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.56 ' HG2' ' HG2' ' A' ' 23' ' ' LYS . 28.6 mtmt -120.92 119.11 31.65 Favored 'General case' 0 C--N 1.312 -1.053 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.363 -179.109 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 20.5 m -138.38 159.48 31.9 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-O 121.172 0.51 . . . . 0.0 110.947 -178.516 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.524 ' O ' HG22 ' A' ' 42' ' ' THR . 0.9 OUTLIER -74.85 154.56 38.2 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-O 121.058 0.456 . . . . 0.0 111.193 178.625 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -69.85 -37.31 76.11 Favored 'General case' 0 CA--C 1.507 -0.691 0 CA-C-O 121.22 0.533 . . . . 0.0 110.458 178.49 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 11.8 t -99.8 25.59 7.1 Favored 'General case' 0 N--CA 1.436 -1.169 0 CA-C-O 121.375 0.607 . . . . 0.0 112.424 -175.462 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' THR . . . . . 0.524 HG22 ' O ' ' A' ' 39' ' ' LYS . 6.1 t -108.17 168.26 9.43 Favored 'General case' 0 C--N 1.32 -0.713 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 176.995 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 14.8 m170 -78.26 140.35 38.87 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 121.734 0.778 . . . . 0.0 111.885 -179.125 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.65 ' HB2' ' O ' ' A' ' 75' ' ' HIS . 0.2 OUTLIER -64.98 -18.44 65.28 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.051 -0.977 . . . . 0.0 109.813 -179.911 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.722 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -51.25 -45.84 62.14 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.734 -179.212 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.446 ' HA ' ' CG ' ' A' ' 49' ' ' GLU . 21.4 ptmt -66.47 -31.82 72.81 Favored 'General case' 0 C--O 1.22 -0.498 0 CA-C-O 121.427 0.632 . . . . 0.0 110.933 -177.647 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.559 ' HB3' HD13 ' A' ' 44' ' ' LEU . 8.1 tt -67.97 -47.84 67.5 Favored 'General case' 0 C--N 1.308 -1.202 0 CA-C-O 121.6 0.714 . . . . 0.0 109.259 178.025 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.504 ' HA ' ' CE2' ' A' ' 51' ' ' TYR . 40.5 mtpt -60.63 -45.2 94.93 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.066 -0.97 . . . . 0.0 111.535 -178.763 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.722 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 3.7 pt-20 -71.03 -33.85 70.72 Favored 'General case' 0 C--N 1.312 -1.05 0 CA-C-O 120.958 0.408 . . . . 0.0 110.376 178.639 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.594 ' O ' ' HG2' ' A' ' 54' ' ' ARG . 21.9 t -64.19 -44.91 90.53 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-O 120.881 0.372 . . . . 0.0 111.257 -178.744 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.504 ' CE2' ' HA ' ' A' ' 48' ' ' LYS . 3.6 p90 -75.73 -32.39 60.0 Favored 'General case' 0 N--CA 1.443 -0.81 0 C-N-CA 119.639 -0.824 . . . . 0.0 110.659 -178.618 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' CYS . . . . . 0.614 ' SG ' ' HG2' ' A' ' 59' ' ' MET . 69.3 m -62.77 -43.55 98.5 Favored 'General case' 0 C--O 1.238 0.451 0 CA-C-O 120.868 0.366 . . . . 0.0 110.822 178.667 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' GLN . . . . . 0.404 ' HG2' ' O ' ' A' ' 49' ' ' GLU . 6.6 pt20 -66.49 -36.06 81.79 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 120.649 -0.421 . . . . 0.0 110.284 178.997 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.594 ' HG2' ' O ' ' A' ' 50' ' ' SER . 29.7 mmt180 -53.76 -45.77 70.73 Favored 'General case' 0 C--N 1.351 0.668 0 CA-C-O 121.233 0.54 . . . . 0.0 110.594 176.667 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 23.1 mt-30 -76.73 -23.43 53.05 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.881 -179.609 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 83.27 29.34 33.83 Favored Glycine 0 N--CA 1.445 -0.716 0 C-N-CA 120.565 -0.826 . . . . 0.0 112.086 178.464 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 26.6 m -128.49 153.45 79.3 Favored Pre-proline 0 C--N 1.327 -0.393 0 O-C-N 122.659 -0.318 . . . . 0.0 110.326 -178.725 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -69.01 149.14 71.31 Favored 'Trans proline' 0 C--O 1.239 0.571 0 C-N-CA 122.334 2.022 . . . . 0.0 112.188 178.226 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.614 ' HG2' ' SG ' ' A' ' 52' ' ' CYS . 75.3 mtp -71.46 -9.23 57.85 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.791 -0.64 . . . . 0.0 112.112 -176.06 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 21.0 p30 -89.72 -13.41 36.91 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-O 121.115 0.483 . . . . 0.0 111.529 -178.64 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.422 ' HB3' ' CG ' ' A' ' 94' ' ' GLN . 67.6 m -88.36 -16.1 33.88 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-O 121.164 0.507 . . . . 0.0 112.162 -179.204 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.547 HD11 ' SG ' ' A' ' 52' ' ' CYS . 1.5 pp -126.66 168.47 14.31 Favored 'General case' 0 C--N 1.309 -1.172 0 N-CA-C 112.817 0.673 . . . . 0.0 112.817 -178.457 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.555 ' O ' ' HA ' ' A' ' 90' ' ' VAL . 14.4 mtp180 -121.14 127.09 51.24 Favored 'General case' 0 CA--C 1.506 -0.73 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.658 -177.814 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -106.91 113.9 27.67 Favored 'General case' 0 C--N 1.305 -1.338 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.643 178.147 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.462 ' C ' HD22 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -141.23 162.12 36.24 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.361 0.6 . . . . 0.0 111.056 179.541 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 86.1 t80 -142.89 135.16 27.36 Favored 'General case' 0 C--N 1.311 -1.068 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 178.964 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 6.2 pt-20 48.96 29.32 2.32 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 124.23 1.012 . . . . 0.0 112.405 -179.729 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 81.77 27.65 45.63 Favored Glycine 0 N--CA 1.445 -0.709 0 C-N-CA 120.72 -0.752 . . . . 0.0 113.131 -179.273 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 6.5 pt20 -132.61 136.47 46.54 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 109.217 -0.661 . . . . 0.0 109.217 178.018 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.91 145.74 49.98 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-O 121.638 0.732 . . . . 0.0 110.672 178.292 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.448 HG12 ' HA ' ' A' ' 65' ' ' LEU . 16.8 mm -99.74 121.27 50.21 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.592 0 CA-C-O 121.161 0.505 . . . . 0.0 109.989 -179.632 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -95.86 164.58 12.68 Favored 'General case' 0 C--N 1.309 -1.153 0 N-CA-C 109.946 -0.391 . . . . 0.0 109.946 -179.382 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -65.49 -21.75 66.66 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-O 121.287 0.565 . . . . 0.0 110.584 179.411 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 6.5 m-80 -97.93 2.31 48.94 Favored 'General case' 0 CA--C 1.508 -0.653 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.162 -179.61 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' HIS . . . . . 0.65 ' O ' ' HB2' ' A' ' 44' ' ' LEU . 1.6 m170 -82.33 146.18 29.54 Favored 'General case' 0 CA--C 1.505 -0.786 0 C-N-CA 119.96 -0.696 . . . . 0.0 109.305 -179.832 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.497 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 82.1 p -120.7 155.53 56.97 Favored Pre-proline 0 C--N 1.308 -1.198 0 C-N-CA 120.961 -0.296 . . . . 0.0 111.27 179.514 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_exo -61.85 -38.71 57.23 Favored 'Trans proline' 0 C--N 1.348 0.516 0 C-N-CA 122.459 2.106 . . . . 0.0 111.161 179.335 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' LYS . . . . . 0.521 ' HG3' ' N ' ' A' ' 79' ' ' GLU . 47.0 pttt -67.22 -39.58 86.3 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.801 -178.835 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.521 ' N ' ' HG3' ' A' ' 78' ' ' LYS . 4.3 mm-40 -75.26 -33.57 61.3 Favored 'General case' 0 N--CA 1.44 -0.974 0 CA-C-O 120.947 0.404 . . . . 0.0 111.614 -177.31 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.497 ' HG ' ' O ' ' A' ' 76' ' ' THR . 6.5 mt -82.8 -1.32 51.43 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.214 0.53 . . . . 0.0 110.78 179.573 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 76.3 46.43 12.61 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 121.133 -0.556 . . . . 0.0 113.114 177.248 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 60.7 mtt -107.04 167.72 9.7 Favored 'General case' 0 C--N 1.313 -1.021 0 N-CA-C 109.627 -0.509 . . . . 0.0 109.627 178.569 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -148.42 -171.3 3.81 Favored 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 109.938 -0.393 . . . . 0.0 109.938 178.168 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.427 ' HA ' ' HB ' ' A' ' 22' ' ' ILE . 7.0 pt-20 -66.29 135.31 54.23 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.531 0.681 . . . . 0.0 111.659 -178.48 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 74.63 6.74 4.48 Favored 'General case' 0 C--N 1.324 -0.539 0 C-N-CA 124.816 1.246 . . . . 0.0 112.558 178.746 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -62.27 162.54 9.64 Favored 'General case' 0 C--O 1.238 0.491 0 CA-C-O 121.093 0.473 . . . . 0.0 110.081 175.87 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.438 ' HA ' ' O ' ' A' ' 25' ' ' LYS . 7.3 p -127.56 142.19 44.3 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.264 0 CA-C-O 121.537 0.684 . . . . 0.0 111.925 -176.392 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 3.7 mp -114.4 153.62 15.89 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 179.699 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -104.67 135.53 45.9 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 121.046 0.451 . . . . 0.0 109.994 -176.401 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' VAL . . . . . 0.555 ' HA ' ' O ' ' A' ' 63' ' ' ARG . 96.7 t -128.57 134.74 64.03 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.904 0 CA-C-O 121.268 0.556 . . . . 0.0 110.825 179.039 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 80.7 m-85 -121.24 179.07 4.53 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-N 116.213 -0.449 . . . . 0.0 109.858 179.43 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 8.7 tp60 -108.22 128.23 54.53 Favored 'General case' 0 C--N 1.313 -1.005 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 179.54 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' GLU . . . . . 0.403 ' HB3' ' CD ' ' A' ' 63' ' ' ARG . 9.8 pt-20 -117.84 21.42 12.9 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.316 0.579 . . . . 0.0 111.037 178.209 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 94' ' ' GLN . . . . . 0.422 ' CG ' ' HB3' ' A' ' 61' ' ' SER . 98.9 mt-30 -63.43 -159.42 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.515 175.375 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 8.8 t -144.37 138.35 27.74 Favored 'General case' 0 C--N 1.306 -1.287 0 O-C-N 121.195 -0.94 . . . . 0.0 110.871 -178.042 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -96.75 3.28 62.75 Favored Glycine 0 N--CA 1.44 -1.09 0 C-N-CA 120.701 -0.761 . . . . 0.0 111.349 178.558 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.436 -1.348 0 CA-C-O 118.943 -0.92 . . . . 0.0 111.222 -179.499 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 92.7 mmm . . . . . 0 N--CA 1.479 0.997 0 CA-C-O 121.42 0.628 . . . . 0.0 110.257 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 16.0 m -107.53 31.21 5.6 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.853 -176.867 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 13.2 m-20 72.23 33.82 1.48 Allowed 'General case' 0 N--CA 1.48 1.026 0 CA-C-O 121.652 0.739 . . . . 0.0 110.541 178.626 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 16.0 mt-30 -115.72 -19.09 10.65 Favored 'General case' 0 C--N 1.309 -1.166 0 CA-C-O 122.426 1.108 . . . . 0.0 108.372 -179.656 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -127.75 148.73 50.43 Favored 'General case' 0 N--CA 1.423 -1.802 0 CA-C-N 114.292 -1.322 . . . . 0.0 109.533 -175.71 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -165.89 179.66 5.76 Favored 'General case' 0 C--N 1.312 -1.044 0 CA-C-O 121.241 0.543 . . . . 0.0 111.21 -178.178 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.414 ' HD3' ' O ' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -143.5 150.62 51.76 Favored Pre-proline 0 N--CA 1.442 -0.856 0 CA-C-N 115.636 -0.711 . . . . 0.0 109.696 178.277 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.528 ' HB2' HG22 ' A' ' 10' ' ' THR . 7.9 Cg_endo -49.83 132.22 31.21 Favored 'Trans proline' 0 CA--C 1.538 0.694 0 C-N-CA 123.29 2.66 . . . . 0.0 113.19 -178.649 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 50.1 m -60.74 -31.58 70.89 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.699 -178.859 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' THR . . . . . 0.528 HG22 ' HB2' ' A' ' 8' ' ' PRO . 12.8 t -53.01 -20.35 3.39 Favored 'General case' 0 CA--C 1.543 0.706 0 N-CA-C 112.059 0.392 . . . . 0.0 112.059 176.864 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 28.2 tt0 -81.08 131.0 35.28 Favored 'General case' 0 N--CA 1.448 -0.535 0 N-CA-C 108.415 -0.958 . . . . 0.0 108.415 175.854 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -50.94 -48.08 60.92 Favored 'General case' 0 N--CA 1.476 0.846 0 N-CA-C 116.039 1.866 . . . . 0.0 116.039 -170.613 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 71.2 mt -102.37 -173.53 2.36 Favored 'General case' 0 C--N 1.315 -0.915 0 O-C-N 121.221 -0.924 . . . . 0.0 111.365 -174.094 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 75.81 49.75 8.57 Favored Glycine 0 N--CA 1.441 -0.971 0 C-N-CA 120.606 -0.807 . . . . 0.0 111.424 -179.128 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 3.8 p-10 -85.23 149.96 25.13 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-O 121.124 0.487 . . . . 0.0 110.605 -179.06 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 3.4 mppt? -122.47 154.66 37.51 Favored 'General case' 0 C--N 1.316 -0.85 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 178.81 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -86.89 178.76 6.87 Favored 'General case' 0 C--N 1.312 -1.053 0 C-N-CA 120.428 -0.509 . . . . 0.0 111.602 179.415 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.457 ' H ' ' HG2' ' A' ' 18' ' ' GLU . 5.8 pt-20 -108.79 166.41 10.83 Favored 'General case' 0 C--N 1.312 -1.056 0 CA-C-O 121.238 0.542 . . . . 0.0 112.094 -172.852 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 173.7 -47.63 0.15 Allowed Glycine 0 N--CA 1.448 -0.503 0 N-CA-C 111.072 -0.811 . . . . 0.0 111.072 -177.952 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -43.99 -29.46 0.59 Allowed 'General case' 0 N--CA 1.481 1.097 0 N-CA-C 113.632 0.975 . . . . 0.0 113.632 176.285 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.483 ' CE2' ' HD3' ' A' ' 37' ' ' LYS . 44.1 p90 -66.95 172.07 4.82 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-O 121.469 0.652 . . . . 0.0 111.255 179.851 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.457 ' HB ' ' HA ' ' A' ' 84' ' ' GLU . 22.3 pt -124.42 172.18 12.3 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.814 0 CA-C-O 121.569 0.699 . . . . 0.0 110.25 177.833 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 14.2 mtmt -117.63 146.69 43.49 Favored 'General case' 0 C--N 1.298 -1.636 0 N-CA-C 109.058 -0.719 . . . . 0.0 109.058 -179.071 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.6 mp -141.35 161.48 37.79 Favored 'General case' 0 C--N 1.303 -1.434 0 CA-C-O 121.337 0.589 . . . . 0.0 111.473 174.957 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.415 ' HE2' ' HB3' ' A' ' 25' ' ' LYS . 5.5 tmmm? -133.34 142.88 48.65 Favored 'General case' 0 N--CA 1.436 -1.16 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.463 -178.993 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.498 HG23 ' HZ ' ' A' ' 36' ' ' PHE . 0.9 OUTLIER -114.46 141.72 29.83 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.341 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.247 -179.701 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.436 ' O ' ' HB ' ' A' ' 90' ' ' VAL . 45.5 mm -105.11 117.74 51.31 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.971 0 N-CA-C 107.685 -1.228 . . . . 0.0 107.685 175.652 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' GLY . . . . . 0.415 ' HA2' ' HB ' ' A' ' 90' ' ' VAL . . . -87.56 168.1 37.75 Favored Glycine 0 N--CA 1.421 -2.359 0 C-N-CA 120.372 -0.918 . . . . 0.0 111.845 -177.316 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.04 -22.59 66.96 Favored 'General case' 0 C--N 1.305 -1.348 0 CA-C-O 121.592 0.711 . . . . 0.0 110.704 178.832 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -97.99 12.18 35.07 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.663 -0.699 . . . . 0.0 109.555 179.672 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 15.1 m 71.54 16.56 5.86 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.337 -178.961 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 9.6 t -76.09 115.94 16.3 Favored 'General case' 0 N--CA 1.444 -0.737 0 CA-C-N 115.551 -0.749 . . . . 0.0 110.234 -179.731 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.478 ' HA ' ' O ' ' A' ' 26' ' ' VAL . 40.9 mt-10 -89.15 112.68 23.74 Favored 'General case' 0 CA--C 1.509 -0.598 0 CA-C-O 120.942 0.401 . . . . 0.0 110.415 178.678 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 30.6 mm -99.48 135.53 34.45 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.515 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 177.193 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 11.9 m170 -116.13 132.74 56.57 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 109.549 -0.537 . . . . 0.0 109.549 -178.52 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.498 ' HZ ' HG23 ' A' ' 26' ' ' VAL . 1.4 p90 -147.22 166.77 26.0 Favored 'General case' 0 C--N 1.314 -0.972 0 CA-C-O 121.424 0.63 . . . . 0.0 111.6 -178.164 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.483 ' HD3' ' CE2' ' A' ' 21' ' ' TYR . 89.9 mttt -125.17 121.34 33.91 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.835 -178.79 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 28.1 m -139.15 156.97 28.08 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 CA-C-O 120.949 0.404 . . . . 0.0 110.165 179.455 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.528 ' O ' HG22 ' A' ' 42' ' ' THR . 80.4 tttt -84.21 167.25 16.85 Favored 'General case' 0 C--N 1.311 -1.072 0 O-C-N 121.98 -0.45 . . . . 0.0 110.654 179.832 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -73.39 -36.28 66.02 Favored 'General case' 0 N--CA 1.464 0.269 0 N-CA-C 112.907 0.706 . . . . 0.0 112.907 -176.931 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 11.3 t -96.18 15.72 20.16 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 112.02 0.378 . . . . 0.0 112.02 -177.182 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' THR . . . . . 0.528 HG22 ' O ' ' A' ' 39' ' ' LYS . 5.3 t -93.58 171.62 8.78 Favored 'General case' 0 C--N 1.319 -0.742 0 O-C-N 121.627 -0.67 . . . . 0.0 109.917 -179.604 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' HIS . . . . . 0.405 ' O ' ' HG2' ' A' ' 46' ' ' LYS . 51.6 m170 -88.39 141.23 28.71 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 121.381 0.61 . . . . 0.0 111.188 -179.535 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.631 ' HB2' ' O ' ' A' ' 75' ' ' HIS . 0.2 OUTLIER -69.49 -15.22 63.22 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.571 -0.74 . . . . 0.0 110.033 -179.815 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.778 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -54.75 -44.98 74.1 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-N 115.756 -0.656 . . . . 0.0 111.934 -179.225 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.459 ' N ' ' HD3' ' A' ' 45' ' ' LYS . 21.4 ptmt -69.49 -29.12 66.7 Favored 'General case' 0 C--O 1.218 -0.602 0 CA-C-O 121.286 0.565 . . . . 0.0 110.482 -178.233 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.579 ' HB3' HD13 ' A' ' 44' ' ' LEU . 8.0 tt -72.55 -49.83 29.89 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.498 -179.653 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.501 ' HG2' ' O ' ' A' ' 44' ' ' LEU . 8.3 ptmm? -61.76 -41.76 98.1 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.418 -178.306 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.778 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 8.2 pt-20 -72.16 -30.49 65.05 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-O 121.021 0.439 . . . . 0.0 110.716 177.841 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.594 ' O ' ' HG2' ' A' ' 53' ' ' GLN . 29.3 t -68.57 -43.7 76.01 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.431 -0.35 . . . . 0.0 111.5 -178.75 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.462 ' CD1' HG11 ' A' ' 26' ' ' VAL . 2.5 p90 -75.66 -32.46 60.19 Favored 'General case' 0 N--CA 1.446 -0.658 0 C-N-CA 119.531 -0.868 . . . . 0.0 110.206 -178.619 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' CYS . . . . . 0.512 ' SG ' HD11 ' A' ' 62' ' ' LEU . 98.9 m -65.14 -42.75 93.55 Favored 'General case' 0 CA--C 1.504 -0.807 0 CA-C-O 121.236 0.541 . . . . 0.0 110.601 179.765 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' GLN . . . . . 0.594 ' HG2' ' O ' ' A' ' 50' ' ' SER . 25.4 pt20 -67.37 -35.89 80.25 Favored 'General case' 0 N--CA 1.434 -1.271 0 CA-C-N 115.97 -0.559 . . . . 0.0 109.596 -179.728 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.41 ' NE ' ' HA ' ' A' ' 54' ' ' ARG . 1.0 OUTLIER -56.91 -39.35 74.28 Favored 'General case' 0 C--N 1.355 0.832 0 CA-C-O 121.315 0.578 . . . . 0.0 111.279 178.831 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 34.6 mt-30 -77.7 -20.91 52.81 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.888 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 80.86 33.63 29.57 Favored Glycine 0 N--CA 1.447 -0.615 0 C-N-CA 120.787 -0.721 . . . . 0.0 111.88 179.899 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 31.2 m -133.8 150.67 75.27 Favored Pre-proline 0 C--O 1.238 0.488 0 O-C-N 122.606 -0.349 . . . . 0.0 110.743 -178.685 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' PRO . . . . . 0.546 ' HG2' ' OG ' ' A' ' 61' ' ' SER . 29.9 Cg_endo -65.37 149.57 88.03 Favored 'Trans proline' 0 N--CA 1.455 -0.739 0 C-N-CA 122.558 2.172 . . . . 0.0 111.479 176.829 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.483 ' HG2' ' SG ' ' A' ' 52' ' ' CYS . 68.5 mtp -73.5 -8.38 55.69 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 121.246 0.546 . . . . 0.0 111.52 -176.686 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 60' ' ' ASN . . . . . 0.423 ' OD1' ' HB2' ' A' ' 58' ' ' PRO . 2.0 p-10 -90.82 -10.19 43.67 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-O 121.272 0.558 . . . . 0.0 111.046 -179.124 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.546 ' OG ' ' HG2' ' A' ' 58' ' ' PRO . 67.1 m -87.59 -19.22 28.12 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 121.08 0.467 . . . . 0.0 111.59 179.766 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.512 HD11 ' SG ' ' A' ' 52' ' ' CYS . 1.8 pp -127.66 170.31 12.83 Favored 'General case' 0 C--N 1.317 -0.829 0 N-CA-C 112.948 0.721 . . . . 0.0 112.948 -177.949 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.443 ' O ' ' HA ' ' A' ' 90' ' ' VAL . 44.2 mtm180 -120.18 119.4 33.14 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.606 -0.724 . . . . 0.0 110.824 -176.686 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.449 ' HB3' ' OH ' ' A' ' 51' ' ' TYR . 0.2 OUTLIER -102.33 116.11 31.96 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-O 121.085 0.469 . . . . 0.0 111.034 178.458 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.467 ' C ' HD22 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -143.3 162.52 35.45 Favored 'General case' 0 N--CA 1.444 -0.755 0 CA-C-O 121.395 0.616 . . . . 0.0 111.285 179.412 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.417 ' CB ' HD11 ' A' ' 71' ' ' ILE . 90.2 t80 -143.64 134.48 25.29 Favored 'General case' 0 C--N 1.306 -1.287 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 179.432 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.445 ' HG2' HE21 ' A' ' 69' ' ' GLN . 6.4 pt-20 49.34 27.34 1.9 Allowed 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 124.006 0.923 . . . . 0.0 112.354 -179.071 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 87.19 19.94 54.02 Favored Glycine 0 N--CA 1.449 -0.463 0 C-N-CA 121.079 -0.582 . . . . 0.0 113.687 -179.541 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' GLN . . . . . 0.445 HE21 ' HG2' ' A' ' 67' ' ' GLU . 3.3 pt20 -128.68 137.3 51.55 Favored 'General case' 0 C--N 1.319 -0.737 0 O-C-N 122.058 -0.672 . . . . 0.0 109.486 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -68.8 146.64 52.72 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-O 121.292 0.567 . . . . 0.0 110.225 178.241 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.508 HG21 HD12 ' A' ' 44' ' ' LEU . 24.5 mm -93.15 119.09 40.3 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.54 0 CA-C-O 120.931 0.396 . . . . 0.0 110.161 -179.613 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -96.96 163.54 12.91 Favored 'General case' 0 N--CA 1.437 -1.095 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 -179.505 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' ASP . . . . . 0.463 ' CA ' ' HB3' ' A' ' 45' ' ' LYS . 13.8 m-20 -65.02 -28.17 69.31 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-O 121.563 0.697 . . . . 0.0 110.769 -178.901 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 6.2 m-80 -95.36 4.13 53.7 Favored 'General case' 0 C--N 1.313 -0.981 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.994 -176.443 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' HIS . . . . . 0.631 ' O ' ' HB2' ' A' ' 44' ' ' LEU . 1.7 m170 -80.29 141.69 35.25 Favored 'General case' 0 CA--C 1.509 -0.629 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 179.974 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.418 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 69.7 p -116.57 154.11 49.1 Favored Pre-proline 0 C--N 1.308 -1.236 0 C-N-CA 120.829 -0.348 . . . . 0.0 111.286 178.942 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -58.64 -40.6 72.02 Favored 'Trans proline' 0 C--N 1.349 0.594 0 C-N-CA 122.624 2.216 . . . . 0.0 111.602 179.264 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' LYS . . . . . 0.483 ' HG3' ' N ' ' A' ' 79' ' ' GLU . 17.3 pttt -68.66 -35.52 77.36 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.05 0.452 . . . . 0.0 111.114 -178.146 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.483 ' N ' ' HG3' ' A' ' 78' ' ' LYS . 32.8 mm-40 -76.24 -32.74 59.04 Favored 'General case' 0 CA--C 1.508 -0.672 0 CA-C-O 120.854 0.359 . . . . 0.0 111.233 -179.29 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.469 HD21 ' CG ' ' A' ' 75' ' ' HIS . 5.5 mt -83.27 -2.76 56.43 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.417 0.627 . . . . 0.0 110.361 178.954 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 75.06 44.52 23.28 Favored Glycine 0 N--CA 1.449 -0.456 0 CA-C-N 115.852 -0.613 . . . . 0.0 112.552 177.696 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 63.0 mtt -101.65 162.02 13.21 Favored 'General case' 0 C--N 1.316 -0.874 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 178.745 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -139.85 -172.76 3.46 Favored 'General case' 0 C--N 1.309 -1.181 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 178.471 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.457 ' HA ' ' HB ' ' A' ' 22' ' ' ILE . 10.0 pt-20 -73.34 136.23 44.41 Favored 'General case' 0 N--CA 1.443 -0.813 0 C-N-CA 119.843 -0.743 . . . . 0.0 110.836 179.443 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 85' ' ' GLU . . . . . 0.405 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 42.9 mt-10 76.04 5.06 3.8 Favored 'General case' 0 C--N 1.321 -0.644 0 C-N-CA 124.612 1.165 . . . . 0.0 111.557 -179.114 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 1.8 t0 -63.22 163.84 9.69 Favored 'General case' 0 C--O 1.238 0.488 0 CA-C-O 121.007 0.432 . . . . 0.0 110.309 176.435 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 9.1 p -126.92 143.14 41.37 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.267 0 CA-C-O 121.421 0.629 . . . . 0.0 111.713 -175.934 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 3.4 mp -113.2 152.19 14.96 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.746 0 N-CA-C 108.611 -0.885 . . . . 0.0 108.611 178.134 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -105.42 137.24 43.55 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-O 121.182 0.515 . . . . 0.0 110.754 -175.89 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' VAL . . . . . 0.443 ' HA ' ' O ' ' A' ' 63' ' ' ARG . 58.3 t -130.02 134.97 62.01 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.843 0 CA-C-O 121.398 0.618 . . . . 0.0 110.74 178.68 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 95.7 m-85 -123.33 -178.79 4.09 Favored 'General case' 0 C--N 1.307 -1.276 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 178.645 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 8.0 tp60 -104.65 152.75 22.09 Favored 'General case' 0 C--N 1.305 -1.344 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 179.332 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -141.7 20.78 2.17 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.424 0.63 . . . . 0.0 110.329 175.207 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 98.8 mt-30 -59.92 -164.56 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.79 0 CA-C-N 115.507 -0.77 . . . . 0.0 112.396 178.275 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 7.4 t -126.12 -32.25 2.76 Favored 'General case' 0 C--N 1.32 -0.697 0 O-C-N 121.711 -0.618 . . . . 0.0 111.151 -176.43 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -147.05 -168.79 14.08 Favored Glycine 0 N--CA 1.44 -1.09 0 C-N-CA 120.632 -0.794 . . . . 0.0 111.896 -179.794 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.438 -1.213 0 CA-C-O 118.875 -0.958 . . . . 0.0 111.442 -179.976 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.4 ptm . . . . . 0 N--CA 1.484 1.238 0 CA-C-O 120.877 0.37 . . . . 0.0 111.763 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 39.6 m -160.54 14.39 0.12 Allowed 'General case' 0 N--CA 1.479 1.015 0 CA-C-O 122.014 0.911 . . . . 0.0 109.413 -177.755 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -106.93 0.22 23.64 Favored 'General case' 0 C--N 1.31 -1.141 0 CA-C-N 114.921 -1.036 . . . . 0.0 109.915 -175.688 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 7.3 pt20 -70.43 -16.75 62.98 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.267 -0.879 . . . . 0.0 110.45 178.91 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -114.53 147.05 39.98 Favored 'General case' 0 N--CA 1.438 -1.069 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.414 -179.634 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -141.4 128.28 20.55 Favored 'General case' 0 C--N 1.303 -1.444 0 N-CA-C 108.218 -1.03 . . . . 0.0 108.218 175.862 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 14.3 mmmm -123.99 154.01 67.78 Favored Pre-proline 0 C--N 1.303 -1.45 0 C-N-CA 120.752 -0.379 . . . . 0.0 110.503 -176.441 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -77.24 105.49 2.07 Favored 'Trans proline' 0 N--CA 1.446 -1.281 0 C-N-CA 122.057 1.838 . . . . 0.0 110.635 177.135 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 12.0 p -83.0 93.67 7.61 Favored 'General case' 0 N--CA 1.433 -1.278 0 CA-C-O 121.52 0.676 . . . . 0.0 110.835 -177.752 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 22.5 p -94.62 142.19 27.74 Favored 'General case' 0 N--CA 1.433 -1.297 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.376 179.642 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 24.5 tt0 -139.11 95.08 2.88 Favored 'General case' 0 C--N 1.31 -1.123 0 N-CA-C 108.594 -0.891 . . . . 0.0 108.594 178.7 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 33.2 m-20 -90.26 11.55 20.84 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.768 -173.563 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 50.4 mt -48.08 -54.55 12.79 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.94 177.208 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 80.44 -34.78 2.24 Favored Glycine 0 N--CA 1.453 -0.208 0 C-N-CA 121.178 -0.534 . . . . 0.0 112.694 178.63 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -76.51 103.9 6.75 Favored 'General case' 0 CA--C 1.502 -0.886 0 CA-C-O 121.223 0.535 . . . . 0.0 110.659 -179.674 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 66.9 mttm -149.43 144.16 26.17 Favored 'General case' 0 CA--C 1.499 -0.995 0 CA-C-N 115.626 -0.716 . . . . 0.0 110.939 -179.369 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 84.3 tttt -141.76 165.8 26.48 Favored 'General case' 0 N--CA 1.414 -2.258 0 N-CA-C 108.25 -1.019 . . . . 0.0 108.25 179.041 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 50.8 mt-10 -144.66 83.22 1.7 Allowed 'General case' 0 C--N 1.318 -0.793 0 CA-C-O 121.506 0.669 . . . . 0.0 110.675 -176.879 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -111.63 -83.68 1.36 Allowed Glycine 0 C--N 1.301 -1.412 0 C-N-CA 120.738 -0.744 . . . . 0.0 111.309 176.696 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -82.45 68.94 9.09 Favored 'General case' 0 C--N 1.312 -1.044 0 CA-C-O 121.405 0.622 . . . . 0.0 110.941 176.631 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 34.8 p90 -104.63 178.07 4.67 Favored 'General case' 0 C--N 1.308 -1.229 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.872 178.041 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.422 ' HB ' ' HA ' ' A' ' 84' ' ' GLU . 21.1 pt -123.99 172.23 11.76 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.93 0 CA-C-O 121.261 0.553 . . . . 0.0 110.391 -177.026 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -117.17 143.0 46.32 Favored 'General case' 0 C--N 1.303 -1.427 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 -179.68 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.4 mp -135.21 162.02 33.71 Favored 'General case' 0 C--N 1.309 -1.177 0 CA-C-O 121.202 0.525 . . . . 0.0 110.863 176.778 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.569 ' HG3' ' NE2' ' A' ' 35' ' ' HIS . 2.9 tmmt? -133.22 144.02 49.52 Favored 'General case' 0 N--CA 1.439 -1.002 0 CA-C-O 121.391 0.615 . . . . 0.0 111.186 -178.648 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.561 HG23 ' HZ ' ' A' ' 36' ' ' PHE . 1.0 OUTLIER -118.54 139.03 47.31 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.314 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.231 178.904 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.442 ' CD1' ' HG2' ' A' ' 33' ' ' GLU . 40.1 mm -107.19 99.13 7.95 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.01 0 N-CA-C 108.525 -0.917 . . . . 0.0 108.525 175.039 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' GLY . . . . . 0.59 ' HA2' ' HB ' ' A' ' 90' ' ' VAL . . . -69.8 161.9 52.68 Favored Glycine 0 N--CA 1.42 -2.396 0 C-N-CA 120.27 -0.966 . . . . 0.0 112.943 178.382 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.417 ' HG3' ' H ' ' A' ' 29' ' ' GLN . 0.0 OUTLIER -54.62 -28.55 47.54 Favored 'General case' 0 C--N 1.306 -1.293 0 C-N-CA 123.675 0.79 . . . . 0.0 112.01 176.914 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -88.49 14.88 8.82 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-O 121.249 0.547 . . . . 0.0 110.362 179.597 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 55.6 m 67.62 14.56 9.57 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-O 121.76 0.791 . . . . 0.0 110.353 -177.639 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 2.2 t -72.82 101.48 3.15 Favored 'General case' 0 N--CA 1.438 -1.07 0 CA-C-N 115.238 -0.892 . . . . 0.0 110.4 -179.664 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.442 ' HG2' ' CD1' ' A' ' 27' ' ' ILE . 23.9 mt-10 -79.7 103.61 9.72 Favored 'General case' 0 N--CA 1.444 -0.749 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 177.569 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.417 HG21 ' HA ' ' A' ' 51' ' ' TYR . 23.0 mm -97.33 130.97 45.21 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.587 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 -178.918 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' HIS . . . . . 0.569 ' NE2' ' HG3' ' A' ' 25' ' ' LYS . 12.1 m170 -115.95 123.77 48.87 Favored 'General case' 0 CA--C 1.505 -0.768 0 N-CA-C 109.646 -0.501 . . . . 0.0 109.646 -178.953 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.561 ' HZ ' HG23 ' A' ' 26' ' ' VAL . 1.3 p90 -138.15 147.28 43.73 Favored 'General case' 0 C--N 1.301 -1.534 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.763 -177.156 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 96.2 mttt -109.7 117.92 35.17 Favored 'General case' 0 C--N 1.311 -1.068 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.022 -179.333 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.412 HG21 HD12 ' A' ' 47' ' ' LEU . 24.6 m -137.17 167.04 24.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.351 -178.433 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.423 ' HG2' ' N ' ' A' ' 40' ' ' MET . 81.7 tttt -90.76 160.03 16.01 Favored 'General case' 0 C--N 1.318 -0.8 0 O-C-N 121.782 -0.574 . . . . 0.0 110.695 -179.769 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' MET . . . . . 0.423 ' N ' ' HG2' ' A' ' 39' ' ' LYS . 0.0 OUTLIER -66.21 -37.85 86.56 Favored 'General case' 0 CA--C 1.517 -0.317 0 N-CA-C 112.594 0.591 . . . . 0.0 112.594 -177.466 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 11.0 t -98.84 17.87 18.44 Favored 'General case' 0 C--N 1.312 -1.032 0 CA-C-O 120.952 0.406 . . . . 0.0 111.741 -175.739 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 1.1 t -95.16 165.73 12.26 Favored 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 120.205 -0.598 . . . . 0.0 109.788 179.069 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 18.3 m170 -81.28 137.52 35.79 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-O 121.498 0.666 . . . . 0.0 112.029 -179.917 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.598 ' HB2' ' O ' ' A' ' 75' ' ' HIS . 0.4 OUTLIER -65.71 -14.39 61.19 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.034 -0.984 . . . . 0.0 110.968 179.784 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.748 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -51.01 -54.45 24.45 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.505 0.557 . . . . 0.0 112.505 -178.432 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.432 ' HD3' ' N ' ' A' ' 47' ' ' LEU . 0.1 OUTLIER -66.85 -25.27 66.34 Favored 'General case' 0 C--O 1.218 -0.573 0 CA-C-O 121.289 0.566 . . . . 0.0 111.491 -178.192 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.463 ' HB3' HD13 ' A' ' 44' ' ' LEU . 8.2 tt -73.51 -51.34 17.4 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.708 178.93 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.49 ' HG2' ' O ' ' A' ' 44' ' ' LEU . 8.7 ptmm? -62.39 -40.27 95.95 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.904 0.383 . . . . 0.0 111.522 -177.566 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.748 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 11.5 pt-20 -72.57 -31.29 65.12 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-O 120.909 0.385 . . . . 0.0 110.632 177.838 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.408 ' HB2' ' O ' ' A' ' 46' ' ' LYS . 38.1 t -65.86 -44.33 85.73 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-O 120.932 0.396 . . . . 0.0 111.226 -179.292 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.54 ' CD1' HG11 ' A' ' 26' ' ' VAL . 1.2 p90 -76.49 -33.17 58.66 Favored 'General case' 0 N--CA 1.443 -0.78 0 C-N-CA 119.676 -0.81 . . . . 0.0 110.266 -177.78 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 84.5 m -61.81 -44.75 96.24 Favored 'General case' 0 CA--C 1.512 -0.513 0 CA-C-O 121.174 0.512 . . . . 0.0 110.57 179.727 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 12.9 pt20 -69.63 -32.5 71.23 Favored 'General case' 0 N--CA 1.444 -0.727 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.552 -179.022 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.557 ' NE ' ' HA ' ' A' ' 54' ' ' ARG . 6.9 mmp_? -59.61 -29.41 67.97 Favored 'General case' 0 C--N 1.344 0.337 0 CA-C-O 121.13 0.491 . . . . 0.0 111.465 177.319 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 34.0 mt-30 -89.36 -21.09 23.27 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-O 121.04 0.448 . . . . 0.0 111.046 179.57 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 84.8 28.58 31.48 Favored Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 120.855 -0.688 . . . . 0.0 112.272 179.476 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 27.3 m -133.05 153.37 80.88 Favored Pre-proline 0 C--N 1.324 -0.542 0 O-C-N 122.375 -0.486 . . . . 0.0 110.948 -178.656 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' PRO . . . . . 0.433 ' HB2' ' OD1' ' A' ' 60' ' ' ASN . 59.1 Cg_endo -77.6 164.57 28.14 Favored 'Trans proline' 0 N--CA 1.457 -0.63 0 C-N-CA 122.631 2.221 . . . . 0.0 112.417 177.864 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 42.0 mtt -69.75 -8.67 49.99 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-N 116.184 -0.462 . . . . 0.0 112.111 -177.415 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' ASN . . . . . 0.433 ' OD1' ' HB2' ' A' ' 58' ' ' PRO . 1.4 p-10 -92.7 -11.74 33.26 Favored 'General case' 0 C--N 1.312 -1.037 0 CA-C-O 121.319 0.581 . . . . 0.0 111.023 -177.649 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 50.0 m -88.43 -22.67 23.6 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-O 121.275 0.56 . . . . 0.0 111.314 -179.114 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -135.27 165.09 26.23 Favored 'General case' 0 C--N 1.307 -1.257 0 CA-C-O 121.372 0.606 . . . . 0.0 112.401 -176.954 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.568 ' O ' ' HA ' ' A' ' 90' ' ' VAL . 9.8 mtp180 -116.27 118.88 33.99 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.256 -178.123 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.501 ' HB3' ' OH ' ' A' ' 51' ' ' TYR . 0.2 OUTLIER -96.72 112.36 24.14 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-O 121.064 0.459 . . . . 0.0 110.671 177.515 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.455 ' C ' HD22 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -143.12 164.7 29.44 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-O 121.614 0.721 . . . . 0.0 111.928 -179.258 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 91.8 t80 -145.41 135.14 23.46 Favored 'General case' 0 C--N 1.31 -1.116 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 179.056 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.466 ' HG2' HE21 ' A' ' 69' ' ' GLN . 6.8 pt-20 49.19 27.81 1.95 Allowed 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 124.214 1.006 . . . . 0.0 112.292 -179.19 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 85.59 23.21 47.78 Favored Glycine 0 CA--C 1.523 0.591 0 C-N-CA 120.885 -0.674 . . . . 0.0 113.312 -178.817 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' GLN . . . . . 0.466 HE21 ' HG2' ' A' ' 67' ' ' GLU . 3.0 pt20 -131.75 134.27 45.68 Favored 'General case' 0 C--N 1.321 -0.655 0 O-C-N 122.191 -0.594 . . . . 0.0 109.452 179.341 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.499 ' CD ' ' H ' ' A' ' 70' ' ' ARG . 0.1 OUTLIER -73.58 145.03 45.78 Favored 'General case' 0 C--N 1.31 -1.131 0 CA-C-O 121.695 0.76 . . . . 0.0 110.497 178.113 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 23.0 mm -91.58 126.82 44.19 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.516 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.78 -176.671 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -102.15 165.49 11.12 Favored 'General case' 0 N--CA 1.44 -0.934 0 N-CA-C 109.891 -0.411 . . . . 0.0 109.891 179.906 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -69.22 -21.66 63.93 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-O 121.288 0.566 . . . . 0.0 111.562 -178.951 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 12.0 m-80 -98.26 1.45 47.23 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-O 121.369 0.604 . . . . 0.0 109.863 -179.803 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' HIS . . . . . 0.598 ' O ' ' HB2' ' A' ' 44' ' ' LEU . 5.2 m170 -79.85 142.32 35.36 Favored 'General case' 0 CA--C 1.505 -0.765 0 CA-C-N 116.14 -0.482 . . . . 0.0 109.948 179.933 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.447 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 66.7 p -118.51 154.5 52.36 Favored Pre-proline 0 C--N 1.304 -1.391 0 CA-C-N 116.751 -0.204 . . . . 0.0 110.637 178.514 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 24.9 Cg_exo -62.33 -37.51 60.51 Favored 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 122.429 2.086 . . . . 0.0 110.917 179.457 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' LYS . . . . . 0.544 ' HG3' ' N ' ' A' ' 79' ' ' GLU . 41.3 pttt -65.56 -43.22 90.51 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.794 -179.501 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.544 ' N ' ' HG3' ' A' ' 78' ' ' LYS . 5.9 mm-40 -70.59 -40.32 73.33 Favored 'General case' 0 CA--C 1.509 -0.628 0 CA-C-O 120.902 0.382 . . . . 0.0 111.475 -177.919 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.447 ' HG ' ' O ' ' A' ' 76' ' ' THR . 5.2 mt -74.63 -10.47 59.57 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.328 0.585 . . . . 0.0 110.282 179.971 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 81.78 44.18 7.91 Favored Glycine 0 N--CA 1.45 -0.417 0 CA-C-N 115.887 -0.597 . . . . 0.0 113.246 176.698 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 57.2 mtt -100.99 166.31 10.88 Favored 'General case' 0 C--N 1.314 -0.94 0 N-CA-C 109.489 -0.559 . . . . 0.0 109.489 178.514 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' GLU . . . . . 0.445 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 12.8 pt-20 -135.31 -169.76 2.45 Favored 'General case' 0 C--N 1.311 -1.066 0 N-CA-C 109.662 -0.496 . . . . 0.0 109.662 177.162 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.422 ' HA ' ' HB ' ' A' ' 22' ' ' ILE . 11.3 pt-20 -73.64 143.29 46.35 Favored 'General case' 0 N--CA 1.445 -0.717 0 C-N-CA 120.306 -0.557 . . . . 0.0 110.156 179.183 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 70.25 8.91 6.84 Favored 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 123.437 0.695 . . . . 0.0 111.497 -179.935 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' ASP . . . . . 0.445 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 3.2 t0 -65.71 162.11 19.24 Favored 'General case' 0 C--O 1.24 0.562 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.155 175.893 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 11.6 p -127.54 142.81 42.59 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.443 0 CA-C-O 121.653 0.739 . . . . 0.0 111.48 -177.049 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' ILE . . . . . 0.48 ' HB ' HG22 ' A' ' 26' ' ' VAL . 3.6 mp -112.63 149.82 15.02 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.213 0 N-CA-C 107.885 -1.154 . . . . 0.0 107.885 178.288 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 20.3 tp10 -106.84 141.38 38.17 Favored 'General case' 0 C--N 1.308 -1.205 0 CA-C-O 120.958 0.409 . . . . 0.0 110.39 -175.144 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' VAL . . . . . 0.59 ' HB ' ' HA2' ' A' ' 28' ' ' GLY . 77.4 t -130.93 133.82 62.5 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.188 0 CA-C-O 120.986 0.422 . . . . 0.0 110.413 178.811 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 82.2 m-85 -117.86 173.29 6.84 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-O 120.753 0.311 . . . . 0.0 110.376 -178.566 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' GLN . . . . . 0.407 ' NE2' ' HG2' ' A' ' 29' ' ' GLN . 7.5 tp60 -103.41 133.39 48.55 Favored 'General case' 0 C--N 1.311 -1.074 0 CA-C-O 120.915 0.388 . . . . 0.0 110.966 -179.752 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -131.51 23.17 4.73 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 121.481 0.658 . . . . 0.0 110.201 176.137 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 94' ' ' GLN . . . . . 0.402 ' HB3' ' H ' ' A' ' 95' ' ' THR . 99.4 mt-30 -61.44 -160.92 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.813 0 CA-C-N 115.339 -0.846 . . . . 0.0 112.167 176.641 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 95' ' ' THR . . . . . 0.402 ' H ' ' HB3' ' A' ' 94' ' ' GLN . 9.9 t -158.31 163.6 37.21 Favored 'General case' 0 N--CA 1.439 -0.983 0 N-CA-C 109.743 -0.466 . . . . 0.0 109.743 -177.338 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -137.28 39.65 1.6 Allowed Glycine 0 N--CA 1.441 -1.007 0 C-N-CA 120.953 -0.642 . . . . 0.0 111.88 179.419 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.44 -1.073 0 CA-C-O 118.599 -1.112 . . . . 0.0 111.475 179.257 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 19.1 ttt . . . . . 0 N--CA 1.478 0.97 0 CA-C-O 121.127 0.489 . . . . 0.0 110.573 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 69.6 m -100.02 -35.42 9.71 Favored 'General case' 0 C--N 1.328 -0.364 0 O-C-N 121.675 -0.641 . . . . 0.0 111.216 -178.782 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 10.2 p-10 -86.95 29.86 0.79 Allowed 'General case' 0 C--N 1.319 -0.736 0 CA-C-O 121.135 0.493 . . . . 0.0 110.494 -178.753 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 9.9 pt20 -160.1 152.39 20.72 Favored 'General case' 0 N--CA 1.443 -0.823 0 CA-C-O 121.243 0.544 . . . . 0.0 110.818 -175.259 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -161.51 159.65 28.15 Favored 'General case' 0 C--N 1.309 -1.189 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 176.964 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -136.64 123.83 21.76 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-O 121.101 0.477 . . . . 0.0 110.245 -178.842 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -165.26 150.5 8.23 Favored Pre-proline 0 C--N 1.312 -1.059 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.316 -178.254 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -78.16 164.79 26.64 Favored 'Trans proline' 0 N--CA 1.452 -0.933 0 C-N-CA 122.365 2.043 . . . . 0.0 111.945 179.566 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 50.0 m 46.06 78.75 0.06 Allowed 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 123.326 0.65 . . . . 0.0 112.007 -177.343 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 15.0 t -91.54 -14.08 30.96 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-O 121.371 0.605 . . . . 0.0 110.595 179.796 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -86.06 172.25 10.76 Favored 'General case' 0 N--CA 1.446 -0.67 0 N-CA-C 109.638 -0.504 . . . . 0.0 109.638 177.714 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -119.52 125.61 49.28 Favored 'General case' 0 C--N 1.31 -1.137 0 O-C-N 122.132 -0.355 . . . . 0.0 110.152 -179.333 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 2.5 pp -141.52 158.89 43.27 Favored 'General case' 0 C--N 1.308 -1.231 0 CA-C-O 121.027 0.441 . . . . 0.0 110.889 179.172 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 139.51 56.06 0.04 OUTLIER Glycine 0 C--N 1.307 -1.06 0 C-N-CA 121.018 -0.611 . . . . 0.0 112.298 178.926 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -99.17 101.47 12.81 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 121.411 0.624 . . . . 0.0 111.525 179.728 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.431 ' HD3' ' N ' ' A' ' 16' ' ' LYS . 0.0 OUTLIER -105.93 146.68 29.7 Favored 'General case' 0 C--N 1.312 -1.047 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 177.728 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.434 ' HD3' ' H ' ' A' ' 17' ' ' LYS . 0.0 OUTLIER -66.0 169.38 6.88 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 120.822 -0.351 . . . . 0.0 110.462 179.937 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -97.02 -173.98 2.84 Favored 'General case' 0 C--N 1.314 -0.951 0 N-CA-C 109.614 -0.513 . . . . 0.0 109.614 -177.692 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 179.59 -98.98 0.12 Allowed Glycine 0 N--CA 1.437 -1.287 0 C-N-CA 119.416 -1.373 . . . . 0.0 112.75 -176.768 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.483 ' O ' ' HG3' ' A' ' 39' ' ' LYS . 65.5 mm-40 -95.29 14.33 22.69 Favored 'General case' 0 C--N 1.31 -1.13 0 CA-C-O 120.785 0.326 . . . . 0.0 111.242 -177.248 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.451 ' CE1' ' HB3' ' A' ' 37' ' ' LYS . 51.6 p90 -133.13 162.57 31.38 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 112.781 0.66 . . . . 0.0 112.781 -177.63 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 22.4 pt -107.95 173.96 1.68 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.221 -0.899 . . . . 0.0 110.607 -179.168 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.421 ' HE3' ' HB2' ' A' ' 23' ' ' LYS . 31.5 mtmt -117.83 139.0 51.71 Favored 'General case' 0 C--N 1.308 -1.203 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.328 -178.106 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.4 mp -134.94 163.74 29.17 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-O 121.163 0.506 . . . . 0.0 110.816 176.704 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.478 ' NZ ' HD11 ' A' ' 27' ' ' ILE . 2.3 tmmt? -132.94 144.88 50.44 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-O 121.164 0.507 . . . . 0.0 110.344 179.878 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.615 HG23 ' HZ ' ' A' ' 36' ' ' PHE . 0.9 OUTLIER -114.83 142.3 28.16 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.286 0 CA-C-O 121.091 0.472 . . . . 0.0 111.351 179.121 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.478 HD11 ' NZ ' ' A' ' 25' ' ' LYS . 45.9 mm -104.89 112.69 39.55 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.213 0 N-CA-C 107.634 -1.247 . . . . 0.0 107.634 175.274 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -79.28 171.87 55.01 Favored Glycine 0 N--CA 1.424 -2.158 0 C-N-CA 120.447 -0.882 . . . . 0.0 112.565 -176.198 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.563 ' H ' ' CD ' ' A' ' 29' ' ' GLN . 0.0 OUTLIER -67.5 -23.01 65.42 Favored 'General case' 0 C--N 1.309 -1.183 0 CA-C-O 121.739 0.78 . . . . 0.0 109.573 179.082 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -97.83 12.42 34.01 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.315 -0.857 . . . . 0.0 109.362 177.465 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 49.5 m 70.24 15.81 7.42 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.809 -178.906 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 21.9 t -71.19 116.3 11.34 Favored 'General case' 0 N--CA 1.445 -0.677 0 CA-C-N 115.416 -0.811 . . . . 0.0 109.846 178.901 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.443 ' HA ' ' O ' ' A' ' 26' ' ' VAL . 32.4 mt-10 -89.4 108.69 19.78 Favored 'General case' 0 N--CA 1.445 -0.725 0 CA-C-O 121.226 0.536 . . . . 0.0 109.988 179.268 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 34.4 mm -97.79 138.79 21.59 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.371 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 179.4 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 13.3 m170 -116.95 129.6 56.15 Favored 'General case' 0 C--N 1.317 -0.829 0 N-CA-C 109.511 -0.551 . . . . 0.0 109.511 -178.387 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.615 ' HZ ' HG23 ' A' ' 26' ' ' VAL . 1.9 p90 -147.02 158.02 43.8 Favored 'General case' 0 C--N 1.307 -1.25 0 CA-C-O 121.477 0.656 . . . . 0.0 110.603 -179.158 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.451 ' HB3' ' CE1' ' A' ' 21' ' ' TYR . 47.1 mtmt -126.17 116.31 21.14 Favored 'General case' 0 C--N 1.301 -1.502 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.652 -178.593 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.426 HG21 HD12 ' A' ' 47' ' ' LEU . 17.6 m -132.81 163.85 36.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.525 -176.74 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.483 ' HG3' ' O ' ' A' ' 20' ' ' GLU . 84.9 tttt -85.67 160.33 19.59 Favored 'General case' 0 C--N 1.316 -0.857 0 O-C-N 121.923 -0.486 . . . . 0.0 111.413 -178.279 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -70.39 -37.18 74.45 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.031 0.444 . . . . 0.0 112.154 -177.625 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 14.5 t -90.51 9.35 29.69 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.531 -177.79 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' THR . . . . . 0.455 HG22 ' O ' ' A' ' 39' ' ' LYS . 1.2 t -92.06 167.73 11.87 Favored 'General case' 0 C--N 1.322 -0.591 0 C-N-CA 120.03 -0.668 . . . . 0.0 110.298 -178.482 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' HIS . . . . . 0.53 ' HB3' ' HG2' ' A' ' 45' ' ' LYS . 31.9 m170 -87.93 141.65 28.41 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-O 121.51 0.671 . . . . 0.0 111.589 -179.26 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.515 ' HB2' ' O ' ' A' ' 75' ' ' HIS . 0.6 OUTLIER -65.68 -19.26 65.83 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.554 -0.748 . . . . 0.0 111.515 179.944 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.53 ' HG2' ' HB3' ' A' ' 43' ' ' HIS . 7.5 ptpt -50.82 -49.24 59.08 Favored 'General case' 0 N--CA 1.463 0.188 0 N-CA-C 112.018 0.377 . . . . 0.0 112.018 -179.167 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.6 -29.67 69.06 Favored 'General case' 0 C--O 1.207 -1.162 0 CA-C-O 120.893 0.378 . . . . 0.0 111.239 -178.847 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.426 HD12 HG21 ' A' ' 38' ' ' VAL . 8.3 tt -70.71 -47.83 57.76 Favored 'General case' 0 C--N 1.311 -1.106 0 CA-C-O 121.3 0.571 . . . . 0.0 109.608 178.29 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.519 ' HD3' ' HA ' ' A' ' 45' ' ' LYS . 30.9 mtpt -58.82 -45.9 88.88 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.204 -179.718 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.87 -30.56 65.54 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 121.282 0.563 . . . . 0.0 110.713 -179.383 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 5.6 m -68.67 -44.43 74.09 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-N 115.984 -0.553 . . . . 0.0 112.089 -179.754 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.464 ' CE2' ' HA ' ' A' ' 48' ' ' LYS . 3.0 p90 -74.59 -33.55 62.66 Favored 'General case' 0 C--N 1.324 -0.541 0 C-N-CA 119.551 -0.86 . . . . 0.0 110.178 -178.936 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' CYS . . . . . 0.586 ' SG ' HD11 ' A' ' 62' ' ' LEU . 84.2 m -59.22 -46.87 87.31 Favored 'General case' 0 C--O 1.238 0.454 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.09 178.658 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 7.1 pt20 -68.06 -32.68 73.19 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 120.526 -0.469 . . . . 0.0 110.95 -179.217 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 1.6 mmp_? -59.42 -34.58 72.66 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-O 121.062 0.458 . . . . 0.0 111.662 177.669 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 32.4 mt-30 -81.81 -20.4 39.18 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-O 121.372 0.606 . . . . 0.0 110.286 179.034 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 82.2 28.9 39.04 Favored Glycine 0 N--CA 1.443 -0.872 0 CA-C-N 115.823 -0.626 . . . . 0.0 112.02 -179.994 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 33.9 m -131.45 145.95 59.83 Favored Pre-proline 0 C--N 1.326 -0.443 0 O-C-N 122.548 -0.384 . . . . 0.0 110.74 -179.313 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' PRO . . . . . 0.446 ' HG2' ' OG ' ' A' ' 61' ' ' SER . 28.0 Cg_endo -65.05 150.49 87.88 Favored 'Trans proline' 0 C--O 1.24 0.599 0 C-N-CA 122.513 2.142 . . . . 0.0 112.228 178.505 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.524 ' HG2' ' SG ' ' A' ' 52' ' ' CYS . 77.8 mtp -66.16 -13.66 60.57 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.851 -177.849 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 30.7 p30 -84.39 -12.78 53.85 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 121.507 0.67 . . . . 0.0 110.929 -178.456 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.446 ' OG ' ' HG2' ' A' ' 58' ' ' PRO . 70.6 m -87.79 -20.42 26.15 Favored 'General case' 0 C--N 1.309 -1.176 0 N-CA-C 112.407 0.521 . . . . 0.0 112.407 -178.072 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.586 HD11 ' SG ' ' A' ' 52' ' ' CYS . 1.4 pp -127.05 171.98 10.9 Favored 'General case' 0 C--N 1.309 -1.187 0 N-CA-C 113.487 0.921 . . . . 0.0 113.487 -176.327 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.468 ' O ' ' HA ' ' A' ' 90' ' ' VAL . 46.6 mtm180 -122.88 122.45 38.66 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.25 -0.886 . . . . 0.0 110.55 -177.358 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -105.5 118.63 37.07 Favored 'General case' 0 C--N 1.313 -1.007 0 CA-C-O 121.173 0.511 . . . . 0.0 111.248 179.561 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.464 ' HA ' HG12 ' A' ' 71' ' ' ILE . 0.0 OUTLIER -146.26 164.58 31.87 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 121.41 0.624 . . . . 0.0 111.034 179.613 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 88.1 t80 -142.88 134.92 27.12 Favored 'General case' 0 C--N 1.31 -1.143 0 N-CA-C 108.978 -0.749 . . . . 0.0 108.978 179.455 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 49.95 26.94 2.19 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 123.96 0.904 . . . . 0.0 112.268 -178.968 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 85.1 21.5 55.02 Favored Glycine 0 CA--C 1.523 0.534 0 C-N-CA 120.99 -0.624 . . . . 0.0 113.57 -178.598 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 6.0 pt20 -128.23 134.91 49.07 Favored 'General case' 0 C--N 1.322 -0.622 0 O-C-N 122.245 -0.562 . . . . 0.0 109.548 179.69 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -64.52 145.01 56.78 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-O 121.677 0.751 . . . . 0.0 111.09 177.473 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.464 HG12 ' HA ' ' A' ' 65' ' ' LEU . 22.3 mm -97.15 118.11 42.99 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.29 0 CA-C-O 121.142 0.496 . . . . 0.0 110.117 179.634 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -89.67 162.55 15.54 Favored 'General case' 0 N--CA 1.437 -1.116 0 N-CA-C 109.457 -0.572 . . . . 0.0 109.457 -179.83 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' ASP . . . . . 0.441 ' HB3' ' HB3' ' A' ' 45' ' ' LYS . 67.4 m-20 -65.47 -25.43 67.49 Favored 'General case' 0 C--N 1.313 -0.993 0 CA-C-O 121.609 0.719 . . . . 0.0 110.318 179.093 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 7.4 m-80 -97.46 9.21 42.99 Favored 'General case' 0 C--N 1.312 -1.041 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.178 -179.254 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' HIS . . . . . 0.515 ' O ' ' HB2' ' A' ' 44' ' ' LEU . 2.2 m170 -84.54 141.2 30.9 Favored 'General case' 0 CA--C 1.504 -0.798 0 N-CA-C 109.398 -0.593 . . . . 0.0 109.398 179.234 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.411 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 70.7 p -118.65 154.64 52.65 Favored Pre-proline 0 C--N 1.306 -1.324 0 C-N-CA 121.099 -0.24 . . . . 0.0 110.435 -179.891 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_exo -59.99 -39.47 70.34 Favored 'Trans proline' 0 N--CA 1.457 -0.637 0 C-N-CA 122.37 2.047 . . . . 0.0 111.459 179.861 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' LYS . . . . . 0.511 ' HG3' ' N ' ' A' ' 79' ' ' GLU . 37.6 pttt -68.96 -38.53 79.45 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 120.974 0.416 . . . . 0.0 111.163 -178.463 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.511 ' N ' ' HG3' ' A' ' 78' ' ' LYS . 11.1 mm-40 -72.4 -34.07 67.61 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-O 120.994 0.426 . . . . 0.0 110.896 -178.266 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.437 HD21 ' CG ' ' A' ' 75' ' ' HIS . 5.8 mt -84.63 2.11 43.07 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.24 0.543 . . . . 0.0 111.021 179.624 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 73.84 41.2 42.5 Favored Glycine 0 C--O 1.237 0.335 0 C-N-CA 120.99 -0.624 . . . . 0.0 112.964 177.199 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 63.9 mtt -100.01 164.88 11.8 Favored 'General case' 0 C--N 1.313 -1.012 0 N-CA-C 109.233 -0.654 . . . . 0.0 109.233 178.857 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' GLU . . . . . 0.413 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 11.5 pt-20 -144.23 -170.4 3.35 Favored 'General case' 0 C--N 1.31 -1.12 0 N-CA-C 110.096 -0.335 . . . . 0.0 110.096 178.606 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -64.44 141.53 58.74 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 120.707 0.289 . . . . 0.0 110.372 178.926 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 73.42 1.2 3.9 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 123.558 0.743 . . . . 0.0 112.211 176.814 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' ASP . . . . . 0.413 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 1.5 t70 -61.89 160.87 11.35 Favored 'General case' 0 N--CA 1.476 0.871 0 CA-C-O 121.364 0.602 . . . . 0.0 111.521 -179.546 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.411 ' HA ' ' O ' ' A' ' 25' ' ' LYS . 7.8 p -128.45 143.91 39.57 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.953 0 CA-C-O 121.429 0.633 . . . . 0.0 111.494 -177.09 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 88' ' ' ILE . . . . . 0.436 ' HB ' HG22 ' A' ' 26' ' ' VAL . 3.7 mp -113.2 151.92 15.0 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.802 0 N-CA-C 109.245 -0.65 . . . . 0.0 109.245 179.144 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.424 ' O ' HD13 ' A' ' 65' ' ' LEU . 6.2 tp10 -104.69 137.06 43.07 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.947 0.403 . . . . 0.0 110.47 -176.531 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 90' ' ' VAL . . . . . 0.468 ' HA ' ' O ' ' A' ' 63' ' ' ARG . 95.2 t -128.54 132.45 67.9 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.852 0 CA-C-O 121.282 0.563 . . . . 0.0 111.482 179.088 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 77.1 m-85 -115.0 179.17 4.03 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 178.663 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 7.9 tp60 -106.65 144.61 33.06 Favored 'General case' 0 C--N 1.311 -1.096 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 178.614 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' GLU . . . . . 0.416 ' HB3' ' HG3' ' A' ' 63' ' ' ARG . 7.4 pt-20 -131.88 17.44 4.68 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.103 0.478 . . . . 0.0 110.706 176.253 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 23.2 mt-30 -62.32 -167.92 0.02 OUTLIER 'General case' 0 C--O 1.238 0.494 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.805 177.179 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 14.8 t -170.14 -179.32 3.09 Favored 'General case' 0 N--CA 1.439 -0.986 0 O-C-N 121.406 -0.809 . . . . 0.0 110.184 -175.807 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -156.93 -36.7 0.02 OUTLIER Glycine 0 N--CA 1.441 -1.013 0 N-CA-C 110.831 -0.908 . . . . 0.0 110.831 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.431 -1.633 0 N-CA-C 110.68 -0.968 . . . . 0.0 110.68 179.303 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.6 ptm . . . . . 0 N--CA 1.484 1.232 0 CA-C-O 120.925 0.393 . . . . 0.0 111.388 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 22.7 t -72.61 -72.02 0.26 Allowed 'General case' 0 C--N 1.318 -0.796 0 O-C-N 122.254 -0.279 . . . . 0.0 111.586 -178.008 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -117.23 -25.68 7.01 Favored 'General case' 0 C--N 1.326 -0.422 0 O-C-N 121.769 -0.582 . . . . 0.0 112.275 -177.355 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -96.07 177.41 5.75 Favored 'General case' 0 C--N 1.308 -1.233 0 CA-C-O 120.959 0.409 . . . . 0.0 111.979 -178.535 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -64.47 -176.48 0.24 Allowed 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 123.326 0.651 . . . . 0.0 112.288 -179.126 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -162.31 151.03 15.0 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.127 -178.283 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.458 ' HA ' ' HD3' ' A' ' 8' ' ' PRO . 75.5 mmtt -126.06 130.91 23.85 Favored Pre-proline 0 N--CA 1.445 -0.723 0 O-C-N 122.294 -0.254 . . . . 0.0 110.452 179.32 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.458 ' HD3' ' HA ' ' A' ' 7' ' ' LYS . 6.9 Cg_exo -71.11 -63.18 0.04 OUTLIER 'Trans proline' 0 N--CA 1.462 -0.328 0 C-N-CA 122.823 2.349 . . . . 0.0 111.514 178.334 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 40.1 m -139.5 -175.88 4.35 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 178.9 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 23.6 m -49.58 107.18 0.13 Allowed 'General case' 0 CA--C 1.529 0.172 0 CA-C-O 121.066 0.46 . . . . 0.0 110.884 177.419 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' GLU . . . . . 0.405 ' O ' ' HB2' ' A' ' 15' ' ' ASP . 12.8 tt0 -73.42 117.02 14.67 Favored 'General case' 0 N--CA 1.444 -0.738 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.107 -178.585 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -80.19 -72.78 0.39 Allowed 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 112.803 0.668 . . . . 0.0 112.803 -175.462 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.476 HD12 ' N ' ' A' ' 14' ' ' GLY . 4.0 pp -71.74 -29.0 64.04 Favored 'General case' 0 CA--C 1.51 -0.56 0 N-CA-C 112.537 0.569 . . . . 0.0 112.537 -177.023 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.476 ' N ' HD12 ' A' ' 13' ' ' LEU . . . -99.91 34.04 5.8 Favored Glycine 0 C--N 1.302 -1.359 0 C-N-CA 120.304 -0.95 . . . . 0.0 112.736 -179.561 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.405 ' HB2' ' O ' ' A' ' 11' ' ' GLU . 18.4 t70 -78.42 140.16 38.69 Favored 'General case' 0 C--N 1.319 -0.749 0 O-C-N 122.309 -0.524 . . . . 0.0 111.538 -179.092 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 2.8 mptp? -120.72 172.61 7.75 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.083 0.468 . . . . 0.0 110.082 177.741 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 14.2 ptmm? -161.33 174.99 12.73 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-O 121.065 0.459 . . . . 0.0 110.178 177.821 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.541 ' HB2' ' CE1' ' A' ' 21' ' ' TYR . 0.1 OUTLIER -96.33 -172.26 2.49 Favored 'General case' 0 C--N 1.311 -1.078 0 N-CA-C 109.708 -0.478 . . . . 0.0 109.708 178.753 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 127.44 119.55 2.25 Favored Glycine 0 N--CA 1.446 -0.686 0 C-N-CA 120.619 -0.8 . . . . 0.0 112.466 179.417 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.456 ' O ' ' HG3' ' A' ' 39' ' ' LYS . 44.6 mt-10 68.28 48.17 0.92 Allowed 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 121.445 0.64 . . . . 0.0 110.708 178.27 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.541 ' CE1' ' HB2' ' A' ' 18' ' ' GLU . 30.9 p90 -126.03 161.33 27.81 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-O 121.534 0.683 . . . . 0.0 111.497 -178.332 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.408 ' HB ' ' HA ' ' A' ' 84' ' ' GLU . 18.5 pt -118.45 172.59 5.64 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.041 0 CA-C-N 115.419 -0.809 . . . . 0.0 110.427 -179.395 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 31.5 mtmt -116.98 142.37 47.03 Favored 'General case' 0 C--N 1.299 -1.618 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 -179.04 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.0 mp -136.79 164.71 27.63 Favored 'General case' 0 C--N 1.308 -1.198 0 CA-C-O 121.187 0.518 . . . . 0.0 110.713 175.218 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.407 ' HE2' ' HB3' ' A' ' 25' ' ' LYS . 5.3 tmmm? -136.79 143.18 43.05 Favored 'General case' 0 C--N 1.313 -1.003 0 CA-C-O 121.254 0.55 . . . . 0.0 110.544 -178.982 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.558 HG23 ' HZ ' ' A' ' 36' ' ' PHE . 1.0 OUTLIER -114.62 142.16 28.42 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.251 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.651 -179.647 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.45 HD13 ' HG2' ' A' ' 33' ' ' GLU . 32.9 mm -111.05 97.59 5.94 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.007 0 N-CA-C 108.117 -1.068 . . . . 0.0 108.117 175.752 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' GLY . . . . . 0.592 ' HA2' ' HB ' ' A' ' 90' ' ' VAL . . . -65.86 167.74 33.76 Favored Glycine 0 N--CA 1.437 -1.286 0 C-N-CA 120.506 -0.854 . . . . 0.0 113.127 178.924 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.22 -18.8 28.8 Favored 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 112.586 0.587 . . . . 0.0 112.586 177.753 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -102.76 13.49 34.28 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-O 121.519 0.676 . . . . 0.0 109.932 179.861 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 49.7 m 73.68 21.38 2.81 Favored 'General case' 0 CA--C 1.509 -0.617 0 CA-C-O 122.629 1.204 . . . . 0.0 108.39 -178.508 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -67.68 96.14 0.53 Allowed 'General case' 0 N--CA 1.424 -1.745 0 CA-C-N 113.362 -1.744 . . . . 0.0 111.474 -178.641 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.483 ' HA ' ' O ' ' A' ' 26' ' ' VAL . 15.0 mt-10 -78.74 104.32 9.28 Favored 'General case' 0 CA--C 1.496 -1.107 0 CA-C-O 121.138 0.494 . . . . 0.0 110.69 177.447 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.532 HG21 ' HA ' ' A' ' 51' ' ' TYR . 33.1 mm -97.67 132.58 42.14 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.319 0 N-CA-C 108.159 -1.052 . . . . 0.0 108.159 175.457 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 12.4 m170 -116.92 121.95 42.91 Favored 'General case' 0 C--N 1.317 -0.823 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 -176.958 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.558 ' HZ ' HG23 ' A' ' 26' ' ' VAL . 1.5 p90 -137.93 162.26 34.5 Favored 'General case' 0 C--N 1.308 -1.225 0 CA-C-O 121.379 0.609 . . . . 0.0 111.292 -177.38 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.42 ' HE2' ' HE2' ' A' ' 21' ' ' TYR . 15.5 mtpt -124.38 115.84 21.61 Favored 'General case' 0 C--N 1.313 -0.979 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.646 -178.793 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 32.8 m -134.03 166.48 28.75 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.435 0 CA-C-O 121.073 0.463 . . . . 0.0 110.735 -178.296 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.515 ' O ' HG22 ' A' ' 42' ' ' THR . 84.2 tttt -89.65 167.85 12.59 Favored 'General case' 0 C--N 1.313 -1.021 0 O-C-N 122.035 -0.416 . . . . 0.0 110.538 -178.541 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -79.11 -37.12 39.48 Favored 'General case' 0 N--CA 1.464 0.26 0 N-CA-C 112.626 0.602 . . . . 0.0 112.626 -178.131 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 13.5 t -93.84 19.86 8.36 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-O 121.079 0.466 . . . . 0.0 111.688 -176.682 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' THR . . . . . 0.515 HG22 ' O ' ' A' ' 39' ' ' LYS . 6.7 t -99.76 173.28 6.77 Favored 'General case' 0 C--N 1.32 -0.708 0 O-C-N 122.006 -0.434 . . . . 0.0 109.961 179.844 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 5.6 m-70 -88.04 142.31 27.88 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-O 121.491 0.662 . . . . 0.0 111.354 179.116 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.599 ' O ' ' HG3' ' A' ' 48' ' ' LYS . 0.2 OUTLIER -69.92 -18.34 63.37 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.54 -0.755 . . . . 0.0 109.725 -179.19 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.676 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -53.89 -44.71 70.71 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-N 115.849 -0.614 . . . . 0.0 112.305 -177.932 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.484 ' N ' ' HD3' ' A' ' 45' ' ' LYS . 21.8 ptmt -67.41 -28.17 67.69 Favored 'General case' 0 CA--C 1.517 -0.29 0 CA-C-O 121.449 0.643 . . . . 0.0 110.538 -178.156 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.538 ' HB3' HD13 ' A' ' 44' ' ' LEU . 7.9 tt -72.08 -47.44 51.39 Favored 'General case' 0 C--N 1.313 -1.01 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.886 179.083 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.599 ' HG3' ' O ' ' A' ' 44' ' ' LEU . 29.5 mtpt -58.69 -48.3 81.59 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.419 -179.233 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.676 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 5.6 pt-20 -68.83 -31.9 71.21 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.709 -179.281 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.401 ' O ' ' HG2' ' A' ' 54' ' ' ARG . 28.8 t -67.44 -46.11 74.07 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-O 121.028 0.442 . . . . 0.0 111.234 -178.998 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.532 ' HA ' HG21 ' A' ' 34' ' ' ILE . 2.0 p90 -75.83 -32.78 59.95 Favored 'General case' 0 N--CA 1.445 -0.683 0 C-N-CA 119.801 -0.76 . . . . 0.0 110.544 -177.217 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' CYS . . . . . 0.547 ' SG ' ' HG2' ' A' ' 59' ' ' MET . 86.8 m -62.58 -44.41 96.38 Favored 'General case' 0 C--O 1.238 0.489 0 CA-C-O 120.85 0.357 . . . . 0.0 110.792 179.163 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 11.8 pt20 -67.96 -32.97 73.77 Favored 'General case' 0 N--CA 1.447 -0.585 0 C-N-CA 120.668 -0.413 . . . . 0.0 110.527 -179.828 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.401 ' HG2' ' O ' ' A' ' 50' ' ' SER . 15.9 mmt180 -57.78 -45.07 86.49 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-O 121.292 0.568 . . . . 0.0 111.115 177.433 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 32.8 mt-30 -71.36 -20.62 62.14 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.629 179.441 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 79.98 30.51 42.52 Favored Glycine 0 N--CA 1.441 -1.03 0 C-N-CA 120.861 -0.685 . . . . 0.0 111.558 -179.774 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 25.9 m -129.21 152.79 80.01 Favored Pre-proline 0 C--N 1.323 -0.555 0 O-C-N 122.502 -0.411 . . . . 0.0 110.723 -178.592 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' PRO . . . . . 0.431 ' HG2' ' OG ' ' A' ' 61' ' ' SER . 43.2 Cg_endo -71.45 150.61 58.27 Favored 'Trans proline' 0 N--CA 1.455 -0.772 0 C-N-CA 122.347 2.031 . . . . 0.0 111.903 177.538 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.547 ' HG2' ' SG ' ' A' ' 52' ' ' CYS . 79.8 mtp -70.37 -9.93 57.63 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.451 -177.443 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 33.6 p30 -84.52 -16.4 42.46 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.241 0.543 . . . . 0.0 111.365 -179.244 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.431 ' OG ' ' HG2' ' A' ' 58' ' ' PRO . 69.2 m -89.72 -20.63 23.36 Favored 'General case' 0 C--N 1.311 -1.101 0 N-CA-C 112.877 0.695 . . . . 0.0 112.877 -175.367 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.475 HD11 ' SG ' ' A' ' 52' ' ' CYS . 1.4 pp -124.09 170.95 10.17 Favored 'General case' 0 C--N 1.306 -1.309 0 N-CA-C 112.945 0.72 . . . . 0.0 112.945 -177.446 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.479 ' O ' ' HA ' ' A' ' 90' ' ' VAL . 47.2 mtm180 -121.66 120.76 35.67 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.674 -0.693 . . . . 0.0 110.844 -177.099 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -102.64 115.33 30.36 Favored 'General case' 0 C--N 1.311 -1.105 0 CA-C-O 121.084 0.469 . . . . 0.0 111.024 179.166 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.462 ' C ' HD22 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -144.38 164.15 31.67 Favored 'General case' 0 N--CA 1.445 -0.688 0 CA-C-O 121.469 0.652 . . . . 0.0 111.238 -179.769 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 83.2 t80 -143.62 134.15 24.88 Favored 'General case' 0 C--N 1.309 -1.192 0 N-CA-C 109.565 -0.532 . . . . 0.0 109.565 179.192 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.417 ' HG2' HE21 ' A' ' 69' ' ' GLN . 6.9 pt-20 49.91 26.86 2.13 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 124.214 1.006 . . . . 0.0 112.75 -179.99 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 87.45 20.89 50.44 Favored Glycine 0 N--CA 1.447 -0.613 0 C-N-CA 120.949 -0.643 . . . . 0.0 113.211 -179.596 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' GLN . . . . . 0.417 HE21 ' HG2' ' A' ' 67' ' ' GLU . 2.9 pt20 -128.55 134.34 48.62 Favored 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 108.766 -0.827 . . . . 0.0 108.766 179.181 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.443 ' HE ' ' HB2' ' A' ' 70' ' ' ARG . 0.0 OUTLIER -72.44 144.95 47.94 Favored 'General case' 0 C--N 1.309 -1.157 0 O-C-N 121.66 -0.65 . . . . 0.0 110.706 179.349 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.417 HG21 HD12 ' A' ' 44' ' ' LEU . 22.3 mm -91.44 121.61 42.06 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.243 0 CA-C-O 121.321 0.582 . . . . 0.0 110.791 -178.276 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.423 ' O ' ' HB2' ' A' ' 75' ' ' HIS . . . -94.47 162.2 13.91 Favored 'General case' 0 N--CA 1.435 -1.18 0 N-CA-C 109.384 -0.598 . . . . 0.0 109.384 179.185 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 46.4 m-20 -69.42 -26.28 64.54 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-O 121.435 0.636 . . . . 0.0 110.558 -178.986 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 5.5 m-80 -93.19 4.72 53.52 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-O 121.311 0.577 . . . . 0.0 109.655 -178.763 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' HIS . . . . . 0.598 ' O ' ' HB2' ' A' ' 44' ' ' LEU . 8.4 m170 -83.13 146.22 28.78 Favored 'General case' 0 CA--C 1.496 -1.099 0 CA-C-N 116.222 -0.444 . . . . 0.0 109.906 -179.349 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 57.3 p -120.86 154.42 57.58 Favored Pre-proline 0 C--N 1.304 -1.412 0 C-N-CA 120.815 -0.354 . . . . 0.0 111.209 178.894 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -58.93 -39.72 78.38 Favored 'Trans proline' 0 C--N 1.348 0.508 0 C-N-CA 122.673 2.249 . . . . 0.0 111.758 179.334 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' LYS . . . . . 0.493 ' HG3' ' N ' ' A' ' 79' ' ' GLU . 29.0 pttt -68.92 -36.37 77.92 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.208 0.528 . . . . 0.0 110.792 -178.301 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.493 ' N ' ' HG3' ' A' ' 78' ' ' LYS . 33.5 mm-40 -72.38 -41.16 66.64 Favored 'General case' 0 N--CA 1.444 -0.74 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.903 -179.124 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 5.5 mt -78.35 -3.51 43.43 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.084 0.468 . . . . 0.0 111.402 -179.011 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 78.14 45.0 10.63 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 121.001 -0.619 . . . . 0.0 112.858 177.153 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 61.0 mtt -105.05 164.98 11.4 Favored 'General case' 0 C--N 1.313 -1.019 0 N-CA-C 110.008 -0.367 . . . . 0.0 110.008 179.162 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -145.21 -169.64 3.25 Favored 'General case' 0 C--N 1.314 -0.97 0 N-CA-C 109.915 -0.402 . . . . 0.0 109.915 177.54 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.408 ' HA ' ' HB ' ' A' ' 22' ' ' ILE . 13.9 pt-20 -70.54 139.67 51.6 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 121.117 0.484 . . . . 0.0 110.98 -179.63 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 75.43 2.46 3.84 Favored 'General case' 0 C--O 1.239 0.531 0 C-N-CA 124.487 1.115 . . . . 0.0 111.266 179.969 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 7.9 t0 -62.34 157.54 19.57 Favored 'General case' 0 C--O 1.239 0.51 0 CA-C-O 121.37 0.605 . . . . 0.0 110.639 177.9 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 7.7 p -125.45 142.94 40.7 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.231 0 CA-C-O 121.457 0.646 . . . . 0.0 111.533 -176.485 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 3.6 mp -113.15 152.05 14.93 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.924 0 N-CA-C 108.809 -0.811 . . . . 0.0 108.809 178.704 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.4 ' O ' HD13 ' A' ' 65' ' ' LEU . 13.8 tp10 -106.61 139.3 41.28 Favored 'General case' 0 C--N 1.314 -0.962 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 -176.4 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 90' ' ' VAL . . . . . 0.592 ' HB ' ' HA2' ' A' ' 28' ' ' GLY . 88.0 t -130.61 136.08 59.07 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.084 0 CA-C-O 121.358 0.599 . . . . 0.0 110.747 178.694 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 88.2 m-85 -120.39 -178.9 3.8 Favored 'General case' 0 C--N 1.311 -1.099 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 178.813 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 7.5 tp60 -105.76 148.96 26.89 Favored 'General case' 0 C--N 1.307 -1.247 0 N-CA-C 109.512 -0.551 . . . . 0.0 109.512 178.559 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -137.37 17.91 2.94 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-O 121.053 0.454 . . . . 0.0 111.076 175.975 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 22.1 mt-30 -60.57 -164.01 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.732 0 CA-C-O 121.747 0.784 . . . . 0.0 112.588 178.647 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 10.4 t -158.41 165.53 34.46 Favored 'General case' 0 N--CA 1.444 -0.763 0 O-C-N 121.766 -0.584 . . . . 0.0 109.847 -175.444 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -113.27 111.11 2.63 Favored Glycine 0 N--CA 1.441 -0.972 0 C-N-CA 120.682 -0.77 . . . . 0.0 111.852 179.235 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.442 -0.943 0 CA-C-O 119.044 -0.864 . . . . 0.0 111.591 179.977 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 28.4 ttt . . . . . 0 N--CA 1.474 0.735 0 CA-C-O 121.323 0.582 . . . . 0.0 110.984 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 45.8 m -123.97 -59.68 1.49 Allowed 'General case' 0 C--N 1.315 -0.917 0 CA-C-O 121.188 0.518 . . . . 0.0 110.022 177.068 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -109.87 -40.95 4.63 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 121.865 0.84 . . . . 0.0 109.356 177.401 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 9.0 pt20 -66.22 136.85 56.45 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-N 114.743 -1.117 . . . . 0.0 112.684 -176.592 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -121.36 160.42 24.07 Favored 'General case' 0 C--N 1.313 -1.001 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 174.695 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -138.9 125.61 20.8 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-O 121.25 0.548 . . . . 0.0 110.989 -179.022 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.426 ' HD3' ' O ' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -158.6 134.55 6.15 Favored Pre-proline 0 C--N 1.314 -0.958 0 CA-C-N 115.791 -0.641 . . . . 0.0 110.624 -179.056 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_exo -56.17 119.94 7.46 Favored 'Trans proline' 0 C--O 1.235 0.365 0 C-N-CA 122.892 2.395 . . . . 0.0 112.774 179.962 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 48.2 m -163.03 151.91 14.64 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.226 178.935 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 40.5 m 62.9 88.56 0.09 Allowed 'General case' 0 CA--C 1.536 0.42 0 CA-C-O 121.652 0.739 . . . . 0.0 111.824 179.112 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -110.12 115.27 29.44 Favored 'General case' 0 C--N 1.308 -1.198 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 178.427 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -119.95 105.11 10.75 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-O 120.986 0.422 . . . . 0.0 110.552 -178.893 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.425 ' O ' HD12 ' A' ' 13' ' ' LEU . 4.0 pp -151.5 150.74 30.73 Favored 'General case' 0 N--CA 1.437 -1.107 0 CA-C-O 121.296 0.569 . . . . 0.0 110.78 176.757 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 116.83 13.04 8.11 Favored Glycine 0 C--N 1.302 -1.312 0 CA-C-N 115.478 -0.783 . . . . 0.0 111.871 178.402 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 37.6 t70 -76.52 130.56 38.1 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-O 121.158 0.504 . . . . 0.0 109.962 179.344 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 12.5 ptpt -155.16 -164.74 1.85 Allowed 'General case' 0 C--N 1.307 -1.269 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.335 -176.311 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 7.9 ptpt -53.9 159.52 1.7 Allowed 'General case' 0 C--O 1.236 0.382 0 CA-C-O 122.206 1.003 . . . . 0.0 112.642 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.486 ' HB2' ' CE1' ' A' ' 21' ' ' TYR . 7.3 pt-20 -77.54 95.32 4.49 Favored 'General case' 0 C--N 1.305 -1.364 0 CA-C-N 114.66 -1.154 . . . . 0.0 112.947 -178.878 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -144.06 132.55 4.91 Favored Glycine 0 C--N 1.309 -0.946 0 N-CA-C 111.531 -0.628 . . . . 0.0 111.531 174.351 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 63.04 38.08 11.18 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-O 121.803 0.811 . . . . 0.0 110.063 -179.302 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.486 ' CE1' ' HB2' ' A' ' 18' ' ' GLU . 39.5 p90 -106.62 177.05 4.97 Favored 'General case' 0 C--N 1.311 -1.084 0 CA-C-N 115.256 -0.884 . . . . 0.0 110.028 -178.66 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.455 ' HB ' ' HA ' ' A' ' 84' ' ' GLU . 18.6 pt -126.34 171.75 14.53 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.279 0 CA-C-O 121.305 0.574 . . . . 0.0 109.775 178.334 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 9.1 mtmt -118.27 140.57 49.61 Favored 'General case' 0 C--N 1.298 -1.667 0 N-CA-C 109.152 -0.684 . . . . 0.0 109.152 -178.387 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.5 mp -137.04 162.28 33.75 Favored 'General case' 0 C--N 1.305 -1.36 0 CA-C-O 121.354 0.597 . . . . 0.0 110.827 176.375 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.47 ' HG3' ' CD2' ' A' ' 35' ' ' HIS . 3.7 tmmt? -134.68 143.73 47.39 Favored 'General case' 0 C--N 1.308 -1.235 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.396 179.974 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.608 HG11 ' CD1' ' A' ' 51' ' ' TYR . 0.9 OUTLIER -114.29 141.13 31.71 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.538 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.3 178.576 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 32.0 mm -111.43 99.22 8.24 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.025 0 N-CA-C 108.403 -0.962 . . . . 0.0 108.403 175.414 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' GLY . . . . . 0.56 ' HA2' ' HB ' ' A' ' 90' ' ' VAL . . . -66.0 164.24 40.11 Favored Glycine 0 N--CA 1.424 -2.162 0 C-N-CA 120.63 -0.795 . . . . 0.0 113.625 179.124 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.41 ' HG3' ' H ' ' A' ' 29' ' ' GLN . 0.0 OUTLIER -62.06 -23.72 66.65 Favored 'General case' 0 C--N 1.308 -1.207 0 C-N-CA 123.785 0.834 . . . . 0.0 110.528 177.902 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -91.78 11.55 24.31 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.279 -0.873 . . . . 0.0 109.518 179.197 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 48.0 m 70.17 14.98 7.63 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-O 121.785 0.802 . . . . 0.0 110.319 -179.254 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 8.4 t -73.34 103.86 4.16 Favored 'General case' 0 N--CA 1.443 -0.801 0 CA-C-N 115.082 -0.963 . . . . 0.0 110.469 179.397 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.46 ' HA ' ' O ' ' A' ' 26' ' ' VAL . 1.3 mp0 -85.11 107.47 17.21 Favored 'General case' 0 CA--C 1.511 -0.543 0 CA-C-O 121.246 0.546 . . . . 0.0 109.981 178.834 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.423 HG21 ' HA ' ' A' ' 51' ' ' TYR . 29.8 mm -100.42 138.75 23.71 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.283 0 N-CA-C 109.72 -0.474 . . . . 0.0 109.72 -179.194 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' HIS . . . . . 0.47 ' CD2' ' HG3' ' A' ' 25' ' ' LYS . 11.6 m170 -118.38 131.38 56.3 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 -179.305 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.508 ' HZ ' HG23 ' A' ' 26' ' ' VAL . 1.1 p90 -146.91 151.08 36.46 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-O 121.207 0.527 . . . . 0.0 111.305 -177.38 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 41.9 mmtm -108.78 119.61 40.05 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 -179.558 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 35.6 m -137.37 161.04 35.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-O 121.397 0.618 . . . . 0.0 111.331 -179.167 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.481 ' O ' HG22 ' A' ' 42' ' ' THR . 10.5 mmmt -83.28 161.12 21.56 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.78 178.896 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -74.71 -36.27 62.71 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-O 121.001 0.429 . . . . 0.0 111.319 179.833 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 8.5 t -94.19 10.76 32.65 Favored 'General case' 0 N--CA 1.443 -0.803 0 CA-C-O 121.405 0.621 . . . . 0.0 111.766 -177.085 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' THR . . . . . 0.481 HG22 ' O ' ' A' ' 39' ' ' LYS . 2.0 t -92.48 169.09 10.82 Favored 'General case' 0 C--N 1.323 -0.55 0 O-C-N 121.688 -0.633 . . . . 0.0 109.862 -178.857 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 27.9 m170 -82.77 141.89 32.0 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-O 121.483 0.659 . . . . 0.0 111.821 -179.795 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.645 ' O ' ' HG3' ' A' ' 48' ' ' LYS . 0.2 OUTLIER -70.48 -18.14 62.97 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 115.421 -0.808 . . . . 0.0 109.922 -179.662 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.669 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -52.32 -45.31 65.55 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.068 -0.514 . . . . 0.0 112.117 -178.467 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.42 ' N ' ' HD3' ' A' ' 45' ' ' LYS . 16.3 ptmt -65.63 -29.59 70.18 Favored 'General case' 0 C--O 1.218 -0.581 0 CA-C-O 121.42 0.629 . . . . 0.0 110.47 -178.066 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.599 ' HB3' HD13 ' A' ' 44' ' ' LEU . 7.9 tt -73.86 -45.7 49.42 Favored 'General case' 0 C--N 1.309 -1.188 0 CA-C-N 115.481 -0.781 . . . . 0.0 109.716 179.939 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.645 ' HG3' ' O ' ' A' ' 44' ' ' LEU . 26.9 mtpt -58.7 -50.17 74.86 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-O 121.38 0.609 . . . . 0.0 110.156 -179.15 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.669 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 8.3 pt-20 -68.33 -33.76 74.89 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.865 -178.294 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 31.3 t -65.46 -46.74 78.65 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-O 121.201 0.524 . . . . 0.0 111.341 -178.674 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.608 ' CD1' HG11 ' A' ' 26' ' ' VAL . 1.6 p90 -76.43 -33.14 58.79 Favored 'General case' 0 N--CA 1.441 -0.878 0 C-N-CA 120.061 -0.656 . . . . 0.0 110.541 -176.836 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' CYS . . . . . 0.502 ' SG ' HD11 ' A' ' 62' ' ' LEU . 88.1 m -62.36 -45.36 93.53 Favored 'General case' 0 CA--C 1.509 -0.609 0 CA-C-O 121.098 0.475 . . . . 0.0 110.674 -179.97 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 13.5 pt20 -69.49 -32.36 71.19 Favored 'General case' 0 N--CA 1.441 -0.908 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.545 -179.269 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 30.8 mmt180 -57.2 -40.48 77.52 Favored 'General case' 0 C--N 1.342 0.278 0 CA-C-O 121.25 0.548 . . . . 0.0 110.834 176.937 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 30.9 mt-30 -78.25 -21.04 50.5 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.874 179.616 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 80.73 34.03 28.94 Favored Glycine 0 N--CA 1.443 -0.883 0 C-N-CA 120.946 -0.645 . . . . 0.0 112.163 179.705 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 34.7 m -134.25 150.44 74.07 Favored Pre-proline 0 C--N 1.325 -0.469 0 O-C-N 122.567 -0.373 . . . . 0.0 110.553 -179.918 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' PRO . . . . . 0.49 ' HG2' ' OG ' ' A' ' 61' ' ' SER . 37.1 Cg_endo -66.8 150.18 83.37 Favored 'Trans proline' 0 C--O 1.239 0.56 0 C-N-CA 122.496 2.131 . . . . 0.0 112.354 179.243 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.469 ' HG2' ' SG ' ' A' ' 52' ' ' CYS . 78.2 mtp -70.39 -14.32 62.51 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.396 -177.163 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 2.0 p-10 -88.73 -9.16 52.91 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-O 121.031 0.443 . . . . 0.0 111.899 -178.547 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.49 ' OG ' ' HG2' ' A' ' 58' ' ' PRO . 73.1 m -94.2 -16.51 23.61 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 112.195 0.442 . . . . 0.0 112.195 179.67 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.502 HD11 ' SG ' ' A' ' 52' ' ' CYS . 1.3 pp -125.44 162.49 24.72 Favored 'General case' 0 C--N 1.315 -0.896 0 N-CA-C 113.056 0.762 . . . . 0.0 113.056 -178.796 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.555 ' HB2' ' HB2' ' A' ' 91' ' ' TYR . 3.2 mmp_? -109.19 118.4 36.64 Favored 'General case' 0 C--N 1.311 -1.07 0 CA-C-N 115.078 -0.965 . . . . 0.0 110.801 -177.876 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.432 ' HB3' ' OH ' ' A' ' 51' ' ' TYR . 0.2 OUTLIER -102.54 113.05 26.08 Favored 'General case' 0 C--N 1.304 -1.372 0 CA-C-O 121.102 0.477 . . . . 0.0 110.388 176.044 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.454 ' C ' HD22 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -142.67 163.6 32.38 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-O 121.555 0.693 . . . . 0.0 111.231 -179.226 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 89.7 t80 -143.41 134.48 25.64 Favored 'General case' 0 C--N 1.309 -1.173 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 179.323 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 49.25 27.59 1.92 Allowed 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 124.04 0.936 . . . . 0.0 112.421 -179.51 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 85.64 22.28 50.88 Favored Glycine 0 CA--C 1.521 0.461 0 C-N-CA 121.069 -0.586 . . . . 0.0 113.167 -179.676 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 5.3 pt20 -129.81 135.67 48.69 Favored 'General case' 0 C--N 1.323 -0.556 0 O-C-N 122.235 -0.567 . . . . 0.0 109.697 179.887 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -64.8 148.31 51.51 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-O 121.55 0.691 . . . . 0.0 110.988 177.764 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.459 HG21 HD12 ' A' ' 44' ' ' LEU . 22.6 mm -100.0 117.3 44.98 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.407 0 CA-C-O 121.101 0.476 . . . . 0.0 109.954 178.435 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.432 ' O ' ' HB2' ' A' ' 75' ' ' HIS . . . -93.79 163.77 13.39 Favored 'General case' 0 N--CA 1.436 -1.137 0 N-CA-C 109.755 -0.461 . . . . 0.0 109.755 -179.898 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 26.4 m-20 -69.82 -24.52 63.48 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-O 121.354 0.597 . . . . 0.0 111.064 -178.141 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 7.1 m-80 -95.38 5.56 51.31 Favored 'General case' 0 C--N 1.313 -1.001 0 CA-C-O 121.414 0.626 . . . . 0.0 109.42 -179.802 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' HIS . . . . . 0.56 ' O ' ' HB2' ' A' ' 44' ' ' LEU . 2.3 m170 -84.08 147.28 27.46 Favored 'General case' 0 CA--C 1.503 -0.853 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 -179.874 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.466 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 68.7 p -123.07 155.15 64.7 Favored Pre-proline 0 C--N 1.306 -1.316 0 CA-C-O 120.548 0.213 . . . . 0.0 110.949 179.255 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_exo -59.96 -38.62 77.43 Favored 'Trans proline' 0 N--CA 1.458 -0.581 0 C-N-CA 122.435 2.09 . . . . 0.0 111.277 178.724 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' LYS . . . . . 0.519 ' HG3' ' N ' ' A' ' 79' ' ' GLU . 33.7 pttt -67.09 -40.1 86.89 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.232 -178.663 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.519 ' N ' ' HG3' ' A' ' 78' ' ' LYS . 65.7 mm-40 -72.88 -36.85 67.43 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-O 121.178 0.513 . . . . 0.0 110.937 -178.763 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.466 ' HG ' ' O ' ' A' ' 76' ' ' THR . 5.4 mt -79.64 -3.02 45.31 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.198 0.523 . . . . 0.0 110.895 -179.651 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 75.51 42.16 27.97 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 121.145 -0.55 . . . . 0.0 112.9 177.635 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 64.0 mtt -99.78 162.75 12.81 Favored 'General case' 0 C--N 1.312 -1.054 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 179.111 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' GLU . . . . . 0.525 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 11.3 pt-20 -142.42 -170.42 3.18 Favored 'General case' 0 C--N 1.31 -1.115 0 N-CA-C 109.975 -0.38 . . . . 0.0 109.975 177.641 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.455 ' HA ' ' HB ' ' A' ' 22' ' ' ILE . 11.3 pt-20 -70.65 143.84 51.29 Favored 'General case' 0 N--CA 1.441 -0.886 0 C-N-CA 120.121 -0.631 . . . . 0.0 110.644 -179.132 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 74.51 3.0 4.22 Favored 'General case' 0 C--N 1.322 -0.587 0 C-N-CA 124.078 0.951 . . . . 0.0 111.192 178.818 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' ASP . . . . . 0.525 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 1.8 t0 -63.11 158.48 19.64 Favored 'General case' 0 CA--C 1.513 -0.463 0 CA-C-O 121.325 0.584 . . . . 0.0 110.727 178.452 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 9.3 p -127.66 144.25 38.1 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.539 0 CA-C-O 121.351 0.595 . . . . 0.0 111.077 -177.496 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' ILE . . . . . 0.444 ' HB ' HG22 ' A' ' 26' ' ' VAL . 3.6 mp -112.24 149.91 14.66 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.066 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 178.129 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.419 ' O ' HD13 ' A' ' 65' ' ' LEU . 8.9 tp10 -104.72 137.52 42.41 Favored 'General case' 0 C--N 1.312 -1.041 0 N-CA-C 109.611 -0.514 . . . . 0.0 109.611 -176.001 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 90' ' ' VAL . . . . . 0.56 ' HB ' ' HA2' ' A' ' 28' ' ' GLY . 65.3 t -126.12 131.9 71.13 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.895 0 CA-C-O 121.186 0.517 . . . . 0.0 111.08 178.81 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 91' ' ' TYR . . . . . 0.555 ' HB2' ' HB2' ' A' ' 63' ' ' ARG . 67.3 m-85 -114.18 176.15 5.16 Favored 'General case' 0 C--N 1.315 -0.909 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 179.644 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 10.4 tp60 -109.19 130.49 55.49 Favored 'General case' 0 C--N 1.304 -1.392 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 179.513 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -118.49 17.52 13.71 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 121.207 0.527 . . . . 0.0 110.45 178.038 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 94' ' ' GLN . . . . . 0.455 ' CG ' ' HB3' ' A' ' 61' ' ' SER . 99.5 mt-30 -64.36 -168.66 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.592 177.416 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 12.8 t -174.98 -174.64 0.79 Allowed 'General case' 0 C--N 1.317 -0.818 0 O-C-N 121.373 -0.829 . . . . 0.0 109.938 -174.711 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -103.53 -35.73 3.48 Favored Glycine 0 N--CA 1.437 -1.29 0 C-N-CA 121.03 -0.605 . . . . 0.0 111.603 179.783 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.439 -1.134 0 CA-C-O 118.466 -1.186 . . . . 0.0 111.335 -179.676 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 11.9 mmt . . . . . 0 N--CA 1.484 1.264 0 CA-C-O 120.94 0.4 . . . . 0.0 111.712 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 31.4 t -107.97 -15.62 14.49 Favored 'General case' 0 C--N 1.309 -1.187 0 CA-C-O 121.193 0.52 . . . . 0.0 111.492 -177.99 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -119.3 -9.87 9.83 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.911 0.862 . . . . 0.0 110.202 -178.499 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -83.61 -51.46 7.28 Favored 'General case' 0 C--N 1.306 -1.285 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.59 -178.581 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -78.2 149.27 33.72 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-O 121.308 0.575 . . . . 0.0 111.933 -176.755 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -75.06 130.71 39.76 Favored 'General case' 0 C--N 1.317 -0.809 0 N-CA-C 109.224 -0.658 . . . . 0.0 109.224 175.267 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 14.2 ptmm? -129.79 138.76 33.82 Favored Pre-proline 0 C--N 1.31 -1.147 0 O-C-N 122.172 -0.33 . . . . 0.0 110.628 -177.815 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -52.31 111.8 0.71 Allowed 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 123.046 2.497 . . . . 0.0 112.882 -178.195 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 15.0 m -104.64 -0.03 28.01 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.782 179.742 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 36.5 m -64.05 133.05 52.34 Favored 'General case' 0 C--O 1.234 0.249 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 177.972 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' GLU . . . . . 0.447 ' HA ' ' NZ ' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -92.71 162.9 13.96 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 121.72 0.771 . . . . 0.0 112.451 -175.321 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 27.2 m-20 -126.05 81.95 2.03 Favored 'General case' 0 CA--C 1.507 -0.688 0 CA-C-N 115.218 -0.901 . . . . 0.0 108.657 177.907 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.473 ' H ' HD12 ' A' ' 13' ' ' LEU . 5.6 mp -65.9 -56.98 8.96 Favored 'General case' 0 C--N 1.307 -1.252 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.378 -178.874 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 59.02 61.31 7.49 Favored Glycine 0 N--CA 1.448 -0.516 0 N-CA-C 110.113 -1.195 . . . . 0.0 110.113 -176.656 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -54.95 123.87 14.88 Favored 'General case' 0 C--O 1.239 0.551 0 C-N-CA 123.097 0.559 . . . . 0.0 112.063 -175.255 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 21.8 ptmt -159.61 -172.88 3.87 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.43 -0.804 . . . . 0.0 109.193 -179.67 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 56.0 mtpt -90.37 -172.66 3.52 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 121.197 0.522 . . . . 0.0 111.431 179.036 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 -85.1 -175.52 5.78 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-O 121.406 0.622 . . . . 0.0 112.013 -176.529 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 102.69 140.31 10.91 Favored Glycine 0 N--CA 1.445 -0.749 0 CA-C-N 115.891 -0.595 . . . . 0.0 112.507 179.325 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.614 ' O ' ' HG3' ' A' ' 39' ' ' LYS . 52.9 mm-40 71.31 27.24 3.19 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 123.188 0.595 . . . . 0.0 112.148 176.25 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 42.6 p90 -126.2 164.97 19.79 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-O 121.615 0.721 . . . . 0.0 112.091 -177.944 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.426 ' HB ' ' HA ' ' A' ' 84' ' ' GLU . 23.4 pt -119.33 171.94 6.98 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.012 0 CA-C-N 115.372 -0.831 . . . . 0.0 110.13 177.612 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.5 ' HD3' ' N ' ' A' ' 23' ' ' LYS . 0.0 OUTLIER -121.14 143.07 49.3 Favored 'General case' 0 C--N 1.305 -1.35 0 N-CA-C 108.815 -0.809 . . . . 0.0 108.815 -178.751 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.5 mp -136.28 159.34 42.06 Favored 'General case' 0 C--N 1.3 -1.559 0 CA-C-O 121.194 0.521 . . . . 0.0 110.982 176.662 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.42 ' O ' ' HA ' ' A' ' 87' ' ' VAL . 5.3 tmmm? -126.82 142.45 51.54 Favored 'General case' 0 N--CA 1.439 -0.999 0 CA-C-O 121.513 0.673 . . . . 0.0 110.458 -179.404 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.501 HG11 ' CD1' ' A' ' 51' ' ' TYR . 0.9 OUTLIER -117.57 142.23 32.72 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.458 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.975 -179.581 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.506 ' O ' ' HB ' ' A' ' 90' ' ' VAL . 48.5 mm -103.68 118.63 51.07 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.289 0 N-CA-C 107.164 -1.421 . . . . 0.0 107.164 174.318 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' GLY . . . . . 0.444 ' HA2' ' HB ' ' A' ' 90' ' ' VAL . . . -90.71 162.94 29.37 Favored Glycine 0 N--CA 1.419 -2.462 0 C-N-CA 120.049 -1.072 . . . . 0.0 111.717 -176.021 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.87 -25.32 64.97 Favored 'General case' 0 C--N 1.309 -1.153 0 CA-C-O 121.653 0.74 . . . . 0.0 110.72 176.356 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -82.0 1.44 35.57 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.199 177.451 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 9.7 m 73.52 13.18 4.53 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 122.216 1.008 . . . . 0.0 109.017 -175.413 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 2.9 t -76.91 116.46 17.59 Favored 'General case' 0 N--CA 1.44 -0.93 0 CA-C-N 114.46 -1.246 . . . . 0.0 110.475 -178.978 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.407 ' HG2' ' CD1' ' A' ' 27' ' ' ILE . 45.1 mt-10 -89.49 110.78 21.58 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.286 0.565 . . . . 0.0 109.857 177.638 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.416 HG21 ' HA ' ' A' ' 51' ' ' TYR . 39.1 mm -99.8 137.76 26.28 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.44 0 N-CA-C 109.724 -0.472 . . . . 0.0 109.724 -178.928 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 12.5 m170 -117.91 132.41 56.41 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 108.648 -0.871 . . . . 0.0 108.648 179.514 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.472 ' HZ ' HG23 ' A' ' 26' ' ' VAL . 1.3 p90 -145.39 168.0 21.56 Favored 'General case' 0 C--N 1.31 -1.11 0 CA-C-O 121.025 0.441 . . . . 0.0 111.026 -178.485 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 88.9 mttt -126.93 115.86 19.92 Favored 'General case' 0 N--CA 1.445 -0.677 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.542 -177.013 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 33.1 m -134.54 162.52 38.74 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 CA-C-O 120.964 0.411 . . . . 0.0 110.153 179.517 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.614 ' HG3' ' O ' ' A' ' 20' ' ' GLU . 81.6 tttt -89.01 165.78 14.33 Favored 'General case' 0 C--N 1.31 -1.128 0 O-C-N 122.011 -0.431 . . . . 0.0 110.859 -179.155 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -73.45 -36.79 65.94 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 112.675 0.62 . . . . 0.0 112.675 -177.156 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 10.1 t -93.34 13.64 20.84 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 120.926 0.393 . . . . 0.0 111.814 -177.695 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' THR . . . . . 0.547 HG22 ' O ' ' A' ' 39' ' ' LYS . 3.4 t -95.37 173.14 7.67 Favored 'General case' 0 C--N 1.321 -0.664 0 C-N-CA 120.11 -0.636 . . . . 0.0 110.366 -179.248 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 11.7 m-70 -92.39 141.65 28.3 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-O 121.432 0.634 . . . . 0.0 111.699 -178.854 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.476 ' HB2' ' O ' ' A' ' 75' ' ' HIS . 0.8 OUTLIER -63.87 -18.27 64.01 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.437 -0.801 . . . . 0.0 111.279 179.31 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.461 ' HA ' ' HD3' ' A' ' 48' ' ' LYS . 0.0 OUTLIER -51.07 -40.43 58.32 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.801 -179.751 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.612 ' O ' ' HG3' ' A' ' 49' ' ' GLU . 19.2 mtpp -66.88 -46.0 76.3 Favored 'General case' 0 CA--C 1.488 -1.417 0 CA-C-O 121.95 0.881 . . . . 0.0 109.286 178.253 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.431 ' HB3' HD13 ' A' ' 44' ' ' LEU . 9.0 tt -60.14 -49.68 76.68 Favored 'General case' 0 C--N 1.291 -1.948 0 CA-C-N 114.616 -1.175 . . . . 0.0 110.11 -176.044 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.526 ' HA ' ' CE2' ' A' ' 51' ' ' TYR . 29.9 mtpt -59.26 -46.51 88.32 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.745 -0.661 . . . . 0.0 111.018 179.46 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.612 ' HG3' ' O ' ' A' ' 46' ' ' LYS . 1.4 pp20? -71.92 -30.68 65.59 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 121.336 0.589 . . . . 0.0 110.406 -178.346 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.406 ' O ' ' HG2' ' A' ' 53' ' ' GLN . 17.8 m -70.42 -42.64 71.35 Favored 'General case' 0 N--CA 1.44 -0.954 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.943 -179.338 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.526 ' CE2' ' HA ' ' A' ' 48' ' ' LYS . 3.0 p90 -76.3 -32.87 58.98 Favored 'General case' 0 C--N 1.321 -0.649 0 C-N-CA 119.3 -0.96 . . . . 0.0 110.102 179.182 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' CYS . . . . . 0.574 ' SG ' HD11 ' A' ' 62' ' ' LEU . 47.4 m -60.82 -44.08 97.39 Favored 'General case' 0 CA--C 1.512 -0.483 0 CA-C-O 120.975 0.417 . . . . 0.0 110.691 177.749 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' GLN . . . . . 0.406 ' HG2' ' O ' ' A' ' 50' ' ' SER . 12.3 pt20 -66.76 -35.06 79.21 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.58 179.463 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 2.5 mmm180 -59.02 -30.12 67.77 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-O 121.006 0.432 . . . . 0.0 111.246 177.024 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 34.4 mt-30 -90.4 -21.74 21.8 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 120.953 0.406 . . . . 0.0 110.844 179.602 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 78.85 34.03 35.5 Favored Glycine 0 N--CA 1.444 -0.772 0 C-N-CA 120.492 -0.861 . . . . 0.0 111.897 179.722 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 33.4 m -134.02 150.18 73.64 Favored Pre-proline 0 C--N 1.327 -0.401 0 O-C-N 122.543 -0.386 . . . . 0.0 110.417 -179.213 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' PRO . . . . . 0.513 ' HG2' ' OG ' ' A' ' 61' ' ' SER . 28.6 Cg_endo -64.12 150.9 87.39 Favored 'Trans proline' 0 N--CA 1.46 -0.498 0 C-N-CA 122.681 2.254 . . . . 0.0 112.269 179.199 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.436 ' HG2' ' SG ' ' A' ' 52' ' ' CYS . 74.4 mtp -73.07 -10.32 59.67 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.12 -178.142 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' ASN . . . . . 0.421 ' OD1' ' HB2' ' A' ' 58' ' ' PRO . 2.2 p-10 -91.87 -9.68 42.43 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.232 -179.457 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.513 ' OG ' ' HG2' ' A' ' 58' ' ' PRO . 68.4 m -93.87 -12.89 27.94 Favored 'General case' 0 C--N 1.317 -0.807 0 N-CA-C 113.127 0.788 . . . . 0.0 113.127 -179.406 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.574 HD11 ' SG ' ' A' ' 52' ' ' CYS . 1.3 pp -128.26 165.56 20.28 Favored 'General case' 0 C--N 1.308 -1.213 0 O-C-N 121.638 -0.664 . . . . 0.0 112.726 -179.349 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.586 ' HB2' ' HB2' ' A' ' 91' ' ' TYR . 3.7 mmp_? -111.95 118.12 34.61 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.814 -177.361 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -103.06 113.75 27.48 Favored 'General case' 0 C--N 1.302 -1.461 0 CA-C-O 120.94 0.4 . . . . 0.0 110.559 176.026 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.461 ' C ' HD22 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -142.25 161.21 38.61 Favored 'General case' 0 N--CA 1.445 -0.685 0 CA-C-O 121.605 0.716 . . . . 0.0 111.438 -179.455 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 93.7 t80 -144.63 136.73 26.1 Favored 'General case' 0 C--N 1.311 -1.093 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 179.061 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.465 ' HG2' HE21 ' A' ' 69' ' ' GLN . 7.7 pt-20 48.88 27.06 1.48 Allowed 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 124.358 1.063 . . . . 0.0 112.631 -179.368 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 84.62 25.43 42.42 Favored Glycine 0 N--CA 1.447 -0.593 0 C-N-CA 120.806 -0.712 . . . . 0.0 113.025 -179.112 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' GLN . . . . . 0.465 HE21 ' HG2' ' A' ' 67' ' ' GLU . 3.4 pt20 -131.95 137.66 48.02 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 178.896 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -74.31 145.36 44.0 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-O 121.324 0.583 . . . . 0.0 109.747 178.492 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.403 HG21 HD12 ' A' ' 44' ' ' LEU . 23.6 mm -90.36 119.93 38.33 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.606 0 CA-C-O 121.15 0.5 . . . . 0.0 110.622 -178.508 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -90.64 163.46 14.53 Favored 'General case' 0 N--CA 1.437 -1.075 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 179.636 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' ASP . . . . . 0.446 ' HB3' ' HB3' ' A' ' 45' ' ' LYS . 59.6 m-20 -71.17 -21.38 62.17 Favored 'General case' 0 C--N 1.313 -1.007 0 CA-C-O 121.627 0.727 . . . . 0.0 110.362 -179.818 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 9.0 m-80 -97.73 6.83 47.4 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.735 -0.666 . . . . 0.0 109.504 179.528 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' HIS . . . . . 0.476 ' O ' ' HB2' ' A' ' 44' ' ' LEU . 3.4 m170 -82.81 140.74 32.78 Favored 'General case' 0 CA--C 1.508 -0.664 0 N-CA-C 109.538 -0.542 . . . . 0.0 109.538 178.858 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.425 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 67.0 p -117.73 154.77 51.08 Favored Pre-proline 0 C--N 1.309 -1.154 0 CA-C-O 120.45 0.166 . . . . 0.0 110.703 179.601 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -59.57 -39.79 71.74 Favored 'Trans proline' 0 N--CA 1.458 -0.576 0 C-N-CA 122.439 2.093 . . . . 0.0 111.43 179.129 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' LYS . . . . . 0.489 ' HG3' ' N ' ' A' ' 79' ' ' GLU . 28.2 pttt -67.77 -38.92 84.06 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.225 -178.013 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.489 ' N ' ' HG3' ' A' ' 78' ' ' LYS . 9.4 mm-40 -73.32 -36.26 66.18 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.929 0.395 . . . . 0.0 110.953 -178.291 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.447 HD21 ' CG ' ' A' ' 75' ' ' HIS . 5.8 mt -82.3 2.72 30.72 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.212 0.529 . . . . 0.0 110.996 -179.704 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 72.62 39.6 55.58 Favored Glycine 0 N--CA 1.453 -0.188 0 C-N-CA 120.962 -0.637 . . . . 0.0 112.618 177.745 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 65.0 mtt -98.55 162.5 13.11 Favored 'General case' 0 C--N 1.312 -1.046 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 179.514 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -143.59 -170.74 3.37 Favored 'General case' 0 C--N 1.306 -1.293 0 CA-C-O 120.803 0.335 . . . . 0.0 110.201 -179.563 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.426 ' HA ' ' HB ' ' A' ' 22' ' ' ILE . 5.6 pt-20 -70.84 136.01 48.44 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 120.994 0.426 . . . . 0.0 110.829 179.875 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 16.1 mm-40 74.25 5.58 4.64 Favored 'General case' 0 C--O 1.238 0.485 0 C-N-CA 124.008 0.923 . . . . 0.0 111.813 178.356 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 6.2 t0 -60.54 160.37 9.09 Favored 'General case' 0 C--O 1.238 0.453 0 CA-C-O 121.271 0.558 . . . . 0.0 110.874 176.109 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.42 ' HA ' ' O ' ' A' ' 25' ' ' LYS . 7.5 p -126.54 143.62 39.42 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.002 0 CA-C-O 121.255 0.55 . . . . 0.0 111.443 -177.238 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 88' ' ' ILE . . . . . 0.419 ' HB ' HG22 ' A' ' 26' ' ' VAL . 3.7 mp -116.1 153.72 17.68 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 179.063 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -106.11 138.76 41.73 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.923 0.392 . . . . 0.0 110.37 -176.737 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' VAL . . . . . 0.561 ' HA ' ' O ' ' A' ' 63' ' ' ARG . 89.4 t -128.33 134.38 64.96 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-O 121.389 0.614 . . . . 0.0 111.475 178.987 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 91' ' ' TYR . . . . . 0.586 ' HB2' ' HB2' ' A' ' 63' ' ' ARG . 70.4 m-85 -116.31 176.24 5.19 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.85 -0.614 . . . . 0.0 109.693 178.536 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 92' ' ' GLN . . . . . 0.428 ' HG3' ' H ' ' A' ' 94' ' ' GLN . 9.3 tp60 -108.41 129.58 55.25 Favored 'General case' 0 C--N 1.31 -1.109 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 178.429 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -119.26 20.77 12.5 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.079 0.466 . . . . 0.0 110.629 178.177 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' GLN . . . . . 0.441 ' CG ' ' HB3' ' A' ' 61' ' ' SER . 99.5 mt-30 -63.22 -162.05 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 121.412 0.625 . . . . 0.0 111.878 178.472 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 7.7 t -154.95 159.32 40.33 Favored 'General case' 0 C--N 1.309 -1.156 0 O-C-N 121.63 -0.669 . . . . 0.0 110.148 -175.632 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 159.6 -58.34 0.32 Allowed Glycine 0 N--CA 1.44 -1.071 0 N-CA-C 111.346 -0.701 . . . . 0.0 111.346 179.959 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.437 -1.279 0 CA-C-O 118.645 -1.086 . . . . 0.0 111.393 -179.755 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.7 ptm . . . . . 0 N--CA 1.481 1.111 0 CA-C-O 121.473 0.654 . . . . 0.0 110.805 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 66.4 m -164.9 -29.89 0.03 OUTLIER 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.864 -175.984 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 25.7 m-20 -75.02 3.19 8.82 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 116.568 -0.287 . . . . 0.0 111.764 -178.569 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 2.1 pt20 -165.37 173.9 10.65 Favored 'General case' 0 N--CA 1.444 -0.741 0 N-CA-C 108.514 -0.921 . . . . 0.0 108.514 -178.116 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -110.89 167.76 10.0 Favored 'General case' 0 C--N 1.311 -1.069 0 N-CA-C 109.897 -0.409 . . . . 0.0 109.897 177.83 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -155.65 133.04 10.95 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 109.726 -0.472 . . . . 0.0 109.726 179.698 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 16.7 ptpt -156.59 157.22 30.84 Favored Pre-proline 0 C--N 1.312 -1.022 0 CA-C-N 116.694 -0.23 . . . . 0.0 110.724 -178.793 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 36.0 Cg_endo -66.21 -172.88 0.3 Allowed 'Trans proline' 0 C--N 1.35 0.614 0 C-N-CA 122.599 2.199 . . . . 0.0 111.622 177.274 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 5.2 p -91.96 80.27 5.18 Favored 'General case' 0 C--N 1.312 -1.026 0 O-C-N 121.743 -0.598 . . . . 0.0 111.426 -178.407 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 5.8 m -50.35 -57.06 8.78 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-O 121.547 0.689 . . . . 0.0 109.99 176.941 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -104.11 135.18 46.09 Favored 'General case' 0 N--CA 1.437 -1.116 0 N-CA-C 107.657 -1.238 . . . . 0.0 107.657 176.713 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -128.13 138.53 52.55 Favored 'General case' 0 C--N 1.311 -1.084 0 CA-C-O 121.515 0.674 . . . . 0.0 112.434 -173.936 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.674 ' O ' ' HE3' ' A' ' 16' ' ' LYS . 80.2 mt -102.9 147.99 26.22 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.643 -179.459 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -89.58 -30.69 12.83 Favored Glycine 0 C--N 1.305 -1.146 0 C-N-CA 120.367 -0.92 . . . . 0.0 111.656 178.139 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -105.92 107.93 19.19 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-O 121.208 0.527 . . . . 0.0 109.966 178.651 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.674 ' HE3' ' O ' ' A' ' 13' ' ' LEU . 89.7 mttt -122.18 134.37 54.72 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-O 121.109 0.48 . . . . 0.0 111.955 -176.467 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.441 ' HE2' ' N ' ' A' ' 17' ' ' LYS . 0.0 OUTLIER 176.86 178.08 0.26 Allowed 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 177.856 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -161.43 149.02 14.97 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 121.174 0.511 . . . . 0.0 110.747 176.96 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 178.04 -177.47 48.38 Favored Glycine 0 N--CA 1.436 -1.318 0 N-CA-C 110.798 -0.921 . . . . 0.0 110.798 -179.671 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.4 ' O ' ' HE3' ' A' ' 39' ' ' LYS . 33.6 mm-40 66.26 43.69 2.7 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-O 121.389 0.614 . . . . 0.0 110.42 179.042 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 12.3 p90 -124.62 164.94 18.79 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-O 121.539 0.685 . . . . 0.0 111.805 -178.012 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.436 ' HB ' ' HA ' ' A' ' 84' ' ' GLU . 27.9 pt -112.58 173.19 2.79 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.976 0 CA-C-N 115.436 -0.802 . . . . 0.0 109.38 178.06 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 6.8 mtmt -112.37 145.9 39.28 Favored 'General case' 0 C--N 1.289 -2.055 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 -178.914 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.6 mp -140.84 160.29 40.37 Favored 'General case' 0 C--N 1.302 -1.459 0 CA-C-O 121.21 0.529 . . . . 0.0 110.797 173.799 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.407 ' O ' ' HA ' ' A' ' 87' ' ' VAL . 5.1 tmmm? -132.74 142.69 49.16 Favored 'General case' 0 C--N 1.312 -1.039 0 CA-C-O 121.391 0.615 . . . . 0.0 110.721 -179.088 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.556 HG23 ' HZ ' ' A' ' 36' ' ' PHE . 0.9 OUTLIER -117.27 141.18 36.94 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.439 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.608 -179.991 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.462 ' O ' ' HB ' ' A' ' 90' ' ' VAL . 43.7 mm -104.24 114.77 44.72 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.037 0 N-CA-C 107.409 -1.33 . . . . 0.0 107.409 174.378 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' GLY . . . . . 0.473 ' HA2' ' HB ' ' A' ' 90' ' ' VAL . . . -87.01 162.84 34.21 Favored Glycine 0 N--CA 1.423 -2.207 0 C-N-CA 119.856 -1.164 . . . . 0.0 111.241 -177.337 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.68 -30.07 30.02 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-O 121.116 0.484 . . . . 0.0 112.258 177.175 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -93.55 13.62 21.34 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-O 121.272 0.558 . . . . 0.0 110.193 -179.301 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 23.6 m 74.65 21.01 2.28 Favored 'General case' 0 CA--C 1.504 -0.811 0 CA-C-O 122.623 1.201 . . . . 0.0 108.396 -178.91 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.443 ' HB2' HE21 ' A' ' 55' ' ' GLN . 2.5 m -68.78 94.57 0.61 Allowed 'General case' 0 N--CA 1.425 -1.721 0 CA-C-N 113.295 -1.775 . . . . 0.0 111.763 -179.164 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.494 ' HA ' ' O ' ' A' ' 26' ' ' VAL . 37.9 mt-10 -82.33 104.08 12.38 Favored 'General case' 0 CA--C 1.506 -0.746 0 C-N-CA 120.369 -0.532 . . . . 0.0 110.265 176.968 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.478 HG21 ' HA ' ' A' ' 51' ' ' TYR . 36.8 mm -100.18 133.73 42.21 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.767 0 N-CA-C 108.963 -0.755 . . . . 0.0 108.963 178.419 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 12.5 m170 -113.34 128.81 56.58 Favored 'General case' 0 C--N 1.316 -0.854 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 -179.43 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.556 ' HZ ' HG23 ' A' ' 26' ' ' VAL . 1.1 p90 -140.91 149.08 41.43 Favored 'General case' 0 C--N 1.306 -1.301 0 CA-C-O 121.488 0.661 . . . . 0.0 111.311 -177.937 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 96.3 mttt -113.97 105.65 13.49 Favored 'General case' 0 C--N 1.31 -1.117 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.859 -178.691 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.496 ' HB ' HG21 ' A' ' 42' ' ' THR . 14.6 m -129.88 162.58 37.29 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.277 -177.592 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.4 ' HE3' ' O ' ' A' ' 20' ' ' GLU . 46.3 mtpt -79.46 178.32 8.2 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-O 121.731 0.777 . . . . 0.0 112.093 -178.779 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -87.59 -31.03 20.06 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.538 -0.756 . . . . 0.0 109.91 178.3 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 10.2 t -92.87 13.0 21.76 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 115.617 -0.719 . . . . 0.0 111.465 -177.631 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' THR . . . . . 0.496 HG21 ' HB ' ' A' ' 38' ' ' VAL . 6.4 t -94.56 162.83 13.64 Favored 'General case' 0 C--N 1.318 -0.795 0 O-C-N 122.029 -0.419 . . . . 0.0 109.974 -178.371 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' HIS . . . . . 0.516 ' O ' ' HG3' ' A' ' 46' ' ' LYS . 24.5 m170 -85.37 141.15 30.21 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-O 121.033 0.444 . . . . 0.0 110.149 177.838 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.643 ' O ' ' HG3' ' A' ' 48' ' ' LYS . 0.5 OUTLIER -63.76 -20.28 65.64 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.888 -179.898 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.702 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -50.7 -47.29 59.04 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 112.173 0.435 . . . . 0.0 112.173 -178.476 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.516 ' HG3' ' O ' ' A' ' 43' ' ' HIS . 0.0 OUTLIER -68.84 -30.11 68.59 Favored 'General case' 0 C--O 1.222 -0.363 0 CA-C-O 121.165 0.507 . . . . 0.0 110.964 -178.872 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.462 HD12 HG21 ' A' ' 38' ' ' VAL . 7.8 tt -72.19 -48.53 42.53 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.549 178.559 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.643 ' HG3' ' O ' ' A' ' 44' ' ' LEU . 24.4 mtpt -57.16 -46.6 82.63 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-O 121.374 0.607 . . . . 0.0 110.46 -178.463 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.702 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 8.3 pt-20 -71.95 -32.94 67.79 Favored 'General case' 0 C--N 1.312 -1.052 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.692 -179.166 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.556 ' O ' ' HG2' ' A' ' 54' ' ' ARG . 23.2 t -62.18 -46.23 89.88 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-O 121.01 0.433 . . . . 0.0 110.699 -179.178 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.487 ' CD1' HG11 ' A' ' 26' ' ' VAL . 2.4 p90 -75.39 -33.0 60.96 Favored 'General case' 0 N--CA 1.441 -0.924 0 C-N-CA 119.744 -0.783 . . . . 0.0 110.701 -178.064 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' CYS . . . . . 0.552 ' SG ' ' HG2' ' A' ' 59' ' ' MET . 97.0 m -63.08 -45.89 90.0 Favored 'General case' 0 CA--C 1.509 -0.615 0 CA-C-O 121.08 0.467 . . . . 0.0 110.644 179.607 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -66.8 -34.45 77.85 Favored 'General case' 0 N--CA 1.442 -0.847 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.476 -179.499 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.556 ' HG2' ' O ' ' A' ' 50' ' ' SER . 40.0 mmt180 -57.23 -40.44 77.56 Favored 'General case' 0 C--N 1.349 0.572 0 CA-C-O 121.105 0.478 . . . . 0.0 111.153 176.813 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.443 HE21 ' HB2' ' A' ' 32' ' ' SER . 30.0 mt-30 -77.24 -21.45 53.73 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.028 0.442 . . . . 0.0 110.982 -179.335 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 80.63 38.28 17.41 Favored Glycine 0 N--CA 1.443 -0.863 0 C-N-CA 120.674 -0.774 . . . . 0.0 111.793 -179.908 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 29.9 m -140.67 149.19 55.98 Favored Pre-proline 0 C--N 1.327 -0.392 0 N-CA-C 110.172 -0.307 . . . . 0.0 110.172 -179.952 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' PRO . . . . . 0.406 ' HG2' ' OG ' ' A' ' 61' ' ' SER . 30.3 Cg_endo -66.07 150.7 85.1 Favored 'Trans proline' 0 C--O 1.241 0.674 0 C-N-CA 122.325 2.016 . . . . 0.0 111.964 178.529 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.552 ' HG2' ' SG ' ' A' ' 52' ' ' CYS . 81.2 mtp -69.19 -8.87 49.66 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.95 -176.845 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 22.8 p30 -91.94 -12.46 33.36 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-O 121.134 0.492 . . . . 0.0 111.534 -178.476 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.406 ' OG ' ' HG2' ' A' ' 58' ' ' PRO . 75.3 m -84.28 -23.14 30.46 Favored 'General case' 0 N--CA 1.442 -0.831 0 CA-C-O 121.225 0.536 . . . . 0.0 111.391 179.848 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.532 HD11 ' SG ' ' A' ' 52' ' ' CYS . 2.0 pp -131.82 151.96 51.32 Favored 'General case' 0 C--N 1.309 -1.183 0 CA-C-O 121.549 0.69 . . . . 0.0 112.204 -178.231 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.441 ' HG3' ' HB2' ' A' ' 91' ' ' TYR . 1.1 ptp180 -109.97 139.96 44.51 Favored 'General case' 0 C--N 1.312 -1.06 0 CA-C-O 121.5 0.667 . . . . 0.0 112.657 -179.417 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -112.3 119.71 39.23 Favored 'General case' 0 C--N 1.311 -1.077 0 CA-C-N 114.96 -1.018 . . . . 0.0 110.726 -177.969 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.455 ' C ' HD22 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -142.79 164.23 30.65 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-O 121.327 0.584 . . . . 0.0 111.101 178.955 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 88.4 t80 -145.68 134.12 21.94 Favored 'General case' 0 C--N 1.312 -1.053 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 179.091 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.431 ' HG2' HE21 ' A' ' 69' ' ' GLN . 6.5 pt-20 49.1 28.08 1.98 Allowed 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 124.155 0.982 . . . . 0.0 112.102 -179.351 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 84.55 25.26 43.37 Favored Glycine 0 N--CA 1.447 -0.571 0 C-N-CA 120.848 -0.692 . . . . 0.0 113.195 -178.906 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' GLN . . . . . 0.431 HE21 ' HG2' ' A' ' 67' ' ' GLU . 3.0 pt20 -131.63 134.68 46.25 Favored 'General case' 0 C--N 1.32 -0.695 0 O-C-N 122.21 -0.582 . . . . 0.0 109.893 178.681 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.451 ' H ' ' HD3' ' A' ' 70' ' ' ARG . 0.0 OUTLIER -65.77 144.1 57.09 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-O 121.553 0.692 . . . . 0.0 110.43 176.767 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 23.3 mm -94.5 119.79 42.98 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.573 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 179.471 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -98.02 162.9 13.0 Favored 'General case' 0 N--CA 1.438 -1.031 0 CA-C-O 120.909 0.385 . . . . 0.0 110.0 -178.237 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' ASP . . . . . 0.488 ' HB3' ' HB3' ' A' ' 45' ' ' LYS . 62.0 m-20 -67.65 -23.75 65.37 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-O 121.375 0.607 . . . . 0.0 111.381 -178.511 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 3.1 m-80 -97.25 4.93 50.77 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-O 121.433 0.635 . . . . 0.0 109.69 -178.719 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' HIS . . . . . 0.527 ' O ' ' HB2' ' A' ' 44' ' ' LEU . 5.9 m170 -84.72 142.69 29.67 Favored 'General case' 0 CA--C 1.504 -0.826 0 CA-C-N 116.187 -0.46 . . . . 0.0 109.768 179.908 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 81.8 p -117.29 154.0 50.13 Favored Pre-proline 0 C--N 1.304 -1.401 0 CA-C-N 116.631 -0.259 . . . . 0.0 110.792 179.177 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_exo -60.33 -37.71 80.16 Favored 'Trans proline' 0 N--CA 1.456 -0.68 0 C-N-CA 122.435 2.09 . . . . 0.0 111.204 179.298 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' LYS . . . . . 0.464 ' HG3' ' N ' ' A' ' 79' ' ' GLU . 34.5 pttt -68.93 -35.88 77.32 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.14 -178.279 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.464 ' N ' ' HG3' ' A' ' 78' ' ' LYS . 14.4 mm-40 -76.61 -37.35 56.57 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-O 121.039 0.447 . . . . 0.0 111.322 -178.898 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.458 HD21 ' CG ' ' A' ' 75' ' ' HIS . 5.2 mt -78.72 -5.16 52.42 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.241 0.543 . . . . 0.0 110.627 179.626 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 78.73 43.43 11.72 Favored Glycine 0 N--CA 1.45 -0.368 0 CA-C-N 115.884 -0.598 . . . . 0.0 112.883 176.99 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 61.1 mtt -101.89 162.29 13.02 Favored 'General case' 0 C--N 1.312 -1.025 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 178.652 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -138.14 -170.98 2.92 Favored 'General case' 0 C--N 1.313 -1.016 0 N-CA-C 110.04 -0.356 . . . . 0.0 110.04 179.506 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.436 ' HA ' ' HB ' ' A' ' 22' ' ' ILE . 8.8 pt-20 -70.11 129.38 39.25 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-O 121.273 0.559 . . . . 0.0 111.049 179.755 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 76.25 11.98 2.78 Favored 'General case' 0 C--N 1.316 -0.865 0 C-N-CA 124.312 1.045 . . . . 0.0 112.399 178.216 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -66.11 167.24 10.34 Favored 'General case' 0 C--O 1.239 0.551 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.107 174.332 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.407 ' HA ' ' O ' ' A' ' 25' ' ' LYS . 8.8 p -129.39 145.27 35.99 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.105 0 CA-C-O 121.298 0.57 . . . . 0.0 111.751 -176.928 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 3.8 mp -115.82 153.71 17.37 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.741 0 N-CA-C 108.63 -0.878 . . . . 0.0 108.63 178.824 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -106.35 137.66 43.92 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 120.981 0.42 . . . . 0.0 110.491 -176.149 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' VAL . . . . . 0.473 ' HB ' ' HA2' ' A' ' 28' ' ' GLY . 97.9 t -129.61 135.89 60.43 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.909 0 CA-C-O 121.254 0.55 . . . . 0.0 110.821 178.971 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 91' ' ' TYR . . . . . 0.441 ' HB2' ' HG3' ' A' ' 63' ' ' ARG . 84.5 m-85 -122.77 171.75 8.95 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.065 179.853 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 92' ' ' GLN . . . . . 0.415 ' HG3' ' H ' ' A' ' 94' ' ' GLN . 9.0 tp60 -97.49 135.83 38.78 Favored 'General case' 0 C--N 1.308 -1.205 0 N-CA-C 109.779 -0.452 . . . . 0.0 109.779 179.482 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -126.58 19.94 7.29 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 121.306 0.574 . . . . 0.0 110.764 176.994 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' GLN . . . . . 0.415 ' H ' ' HG3' ' A' ' 92' ' ' GLN . 24.5 mt-30 -66.43 -155.16 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.736 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.241 175.042 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 8.2 t -166.17 101.74 0.63 Allowed 'General case' 0 C--N 1.318 -0.797 0 CA-C-O 122.287 1.041 . . . . 0.0 110.929 -178.597 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -146.11 95.41 0.17 Allowed Glycine 0 N--CA 1.437 -1.267 0 CA-C-N 115.078 -0.965 . . . . 0.0 112.191 179.388 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.12 0 CA-C-O 118.384 -1.231 . . . . 0.0 111.281 178.419 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 47.1 ttm . . . . . 0 N--CA 1.47 0.534 0 CA-C-O 120.859 0.361 . . . . 0.0 111.676 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 8.6 p -89.14 24.44 2.14 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 112.502 0.556 . . . . 0.0 112.502 -176.423 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 62.92 43.04 7.08 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-O 121.432 0.634 . . . . 0.0 110.768 179.693 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 40.3 mt-30 -57.62 106.44 0.34 Allowed 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.159 -0.928 . . . . 0.0 110.686 179.443 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.533 ' H ' ' CD ' ' A' ' 5' ' ' GLU . 0.1 OUTLIER -84.08 168.26 16.04 Favored 'General case' 0 C--N 1.309 -1.18 0 CA-C-N 115.532 -0.758 . . . . 0.0 111.416 -176.858 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -100.76 141.23 33.92 Favored 'General case' 0 N--CA 1.438 -1.044 0 CA-C-N 115.971 -0.559 . . . . 0.0 109.785 178.509 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 22.0 ptmt -139.59 152.36 68.5 Favored Pre-proline 0 C--N 1.31 -1.132 0 N-CA-C 109.406 -0.59 . . . . 0.0 109.406 -179.318 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 21.0 Cg_exo -62.54 104.86 0.38 Allowed 'Trans proline' 0 C--O 1.236 0.418 0 C-N-CA 122.399 2.066 . . . . 0.0 111.539 178.673 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 3.1 p -80.04 114.62 19.09 Favored 'General case' 0 C--N 1.305 -1.363 0 CA-C-N 115.839 -0.618 . . . . 0.0 111.046 179.929 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 7.7 m -80.6 84.04 6.26 Favored 'General case' 0 N--CA 1.442 -0.858 0 CA-C-O 121.638 0.732 . . . . 0.0 110.216 179.715 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 -143.75 139.21 29.31 Favored 'General case' 0 C--N 1.311 -1.107 0 CA-C-N 115.705 -0.68 . . . . 0.0 109.742 -179.203 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -78.64 -22.84 46.27 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 120.885 0.374 . . . . 0.0 111.683 -177.518 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 80.9 mt -63.18 -77.6 0.05 Allowed 'General case' 0 C--O 1.234 0.242 0 N-CA-C 111.976 0.362 . . . . 0.0 111.976 -178.732 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 68.17 77.35 0.36 Allowed Glycine 0 N--CA 1.446 -0.666 0 N-CA-C 110.465 -1.054 . . . . 0.0 110.465 -177.02 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -60.07 143.9 50.92 Favored 'General case' 0 C--O 1.238 0.478 0 CA-C-O 121.273 0.559 . . . . 0.0 111.234 -176.867 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 71.9 mmtt -89.69 -166.09 1.51 Allowed 'General case' 0 C--N 1.309 -1.176 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.172 -178.133 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 45.7 tttm -80.35 160.68 25.35 Favored 'General case' 0 N--CA 1.434 -1.254 0 O-C-N 122.036 -0.415 . . . . 0.0 111.146 -179.669 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.447 ' CD ' ' H ' ' A' ' 18' ' ' GLU . 1.9 mp0 -45.64 118.49 1.81 Allowed 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 115.56 -0.746 . . . . 0.0 111.603 -179.978 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -159.14 6.02 0.13 Allowed Glycine 0 C--N 1.317 -0.49 0 N-CA-C 111.547 -0.621 . . . . 0.0 111.547 178.879 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -122.58 35.17 4.94 Favored 'General case' 0 C--N 1.311 -1.073 0 CA-C-O 121.605 0.716 . . . . 0.0 109.799 -178.826 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.442 ' CE1' ' HB3' ' A' ' 37' ' ' LYS . 51.8 p90 -113.18 157.2 21.99 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.121 -178.027 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 29.0 pt -104.21 173.47 1.36 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.961 0 CA-C-O 121.785 0.803 . . . . 0.0 110.632 178.801 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.422 ' HE3' ' HG3' ' A' ' 85' ' ' GLU . 11.2 mtmt -115.57 145.86 42.28 Favored 'General case' 0 C--N 1.295 -1.781 0 CA-C-N 115.791 -0.641 . . . . 0.0 109.54 -178.356 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.0 mp -141.03 163.48 32.85 Favored 'General case' 0 C--N 1.306 -1.289 0 CA-C-O 121.213 0.53 . . . . 0.0 111.335 174.25 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.538 ' NZ ' HD11 ' A' ' 27' ' ' ILE . 3.1 tmmt? -135.52 144.26 46.21 Favored 'General case' 0 N--CA 1.445 -0.71 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.568 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.559 ' O ' ' HA ' ' A' ' 33' ' ' GLU . 0.9 OUTLIER -114.41 142.48 26.97 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.121 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.891 179.886 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.538 HD11 ' NZ ' ' A' ' 25' ' ' LYS . 41.4 mm -110.94 97.71 6.09 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.842 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 176.079 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' GLY . . . . . 0.565 ' HA2' ' HB ' ' A' ' 90' ' ' VAL . . . -66.21 165.06 39.71 Favored Glycine 0 N--CA 1.434 -1.476 0 C-N-CA 120.646 -0.787 . . . . 0.0 113.918 178.691 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.407 ' HG3' ' H ' ' A' ' 29' ' ' GLN . 0.0 OUTLIER -56.91 -19.48 18.04 Favored 'General case' 0 C--N 1.315 -0.933 0 C-N-CA 124.286 1.034 . . . . 0.0 112.411 178.906 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.406 ' O ' ' HB2' ' A' ' 31' ' ' SER . 23.4 t70 -106.9 13.4 27.76 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.521 0.677 . . . . 0.0 110.03 -179.039 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' SER . . . . . 0.406 ' HB2' ' O ' ' A' ' 30' ' ' ASP . 62.6 m 74.72 23.6 1.78 Allowed 'General case' 0 CA--C 1.506 -0.742 0 CA-C-O 122.768 1.271 . . . . 0.0 108.076 -178.076 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 9.6 m -71.09 91.51 0.91 Allowed 'General case' 0 N--CA 1.426 -1.655 0 CA-C-N 113.384 -1.734 . . . . 0.0 110.411 179.096 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.559 ' HA ' ' O ' ' A' ' 26' ' ' VAL . 24.8 mt-10 -83.09 107.33 15.59 Favored 'General case' 0 CA--C 1.511 -0.555 0 CA-C-O 121.279 0.561 . . . . 0.0 110.887 -179.816 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 28.2 mm -103.65 138.12 29.43 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.242 0 N-CA-C 109.147 -0.686 . . . . 0.0 109.147 178.637 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' HIS . . . . . 0.42 ' CD2' ' HG3' ' A' ' 25' ' ' LYS . 12.3 m170 -115.45 133.64 55.84 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 -179.915 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.535 ' HZ ' HG23 ' A' ' 26' ' ' VAL . 0.9 OUTLIER -146.6 165.31 29.89 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-O 121.141 0.496 . . . . 0.0 111.035 -177.997 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.442 ' HB3' ' CE1' ' A' ' 21' ' ' TYR . 64.7 mmtt -123.79 115.33 21.18 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.14 -0.482 . . . . 0.0 109.912 -177.683 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.407 ' HB ' HG21 ' A' ' 42' ' ' THR . 20.3 m -136.79 154.5 31.85 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-O 120.91 0.386 . . . . 0.0 110.346 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.55 ' O ' HG22 ' A' ' 42' ' ' THR . 83.4 tttt -81.14 163.03 23.4 Favored 'General case' 0 C--N 1.314 -0.955 0 O-C-N 121.837 -0.54 . . . . 0.0 111.07 -178.663 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' MET . . . . . 0.47 ' O ' ' HG2' ' A' ' 78' ' ' LYS . 0.0 OUTLIER -68.64 -39.59 80.68 Favored 'General case' 0 N--CA 1.466 0.327 0 O-C-N 121.905 -0.497 . . . . 0.0 111.986 -177.785 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 14.9 t -93.23 13.39 21.37 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-O 121.167 0.508 . . . . 0.0 111.742 -175.777 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' THR . . . . . 0.55 HG22 ' O ' ' A' ' 39' ' ' LYS . 2.2 t -92.95 164.37 13.32 Favored 'General case' 0 C--N 1.323 -0.57 0 O-C-N 121.833 -0.542 . . . . 0.0 110.34 -179.031 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' HIS . . . . . 0.498 ' O ' ' HG2' ' A' ' 46' ' ' LYS . 17.2 m170 -77.12 139.55 39.99 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.42 0.628 . . . . 0.0 111.146 178.93 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.626 ' HB2' ' O ' ' A' ' 75' ' ' HIS . 0.2 OUTLIER -70.03 -17.6 63.27 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 115.68 -0.691 . . . . 0.0 109.516 -179.224 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.754 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -53.94 -45.64 71.31 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.963 -178.456 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.498 ' HG2' ' O ' ' A' ' 43' ' ' HIS . 13.6 ptmm? -63.5 -30.15 71.32 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 121.563 0.697 . . . . 0.0 110.61 -178.649 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.591 ' HB3' HD13 ' A' ' 44' ' ' LEU . 8.2 tt -72.44 -48.91 37.42 Favored 'General case' 0 C--N 1.31 -1.139 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.085 179.37 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.589 ' HD3' ' HA ' ' A' ' 45' ' ' LYS . 27.0 mtpt -58.57 -46.84 86.07 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 121.321 0.581 . . . . 0.0 110.619 -178.292 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.754 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 5.9 pt-20 -70.3 -31.55 68.94 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.683 -179.167 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 26.6 t -67.28 -45.85 75.39 Favored 'General case' 0 N--CA 1.455 -0.193 0 CA-C-O 121.102 0.477 . . . . 0.0 111.32 -179.129 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.453 ' CD1' HG11 ' A' ' 26' ' ' VAL . 2.1 p90 -76.03 -32.53 59.4 Favored 'General case' 0 N--CA 1.443 -0.784 0 C-N-CA 119.613 -0.835 . . . . 0.0 110.359 -176.992 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' CYS . . . . . 0.506 ' SG ' ' HG2' ' A' ' 59' ' ' MET . 85.1 m -63.01 -43.65 98.19 Favored 'General case' 0 CA--C 1.513 -0.449 0 CA-C-O 120.969 0.414 . . . . 0.0 110.864 178.878 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 12.7 pt20 -68.74 -33.58 74.15 Favored 'General case' 0 N--CA 1.448 -0.546 0 C-N-CA 120.513 -0.475 . . . . 0.0 110.419 -179.638 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.483 ' CZ ' ' HA ' ' A' ' 54' ' ' ARG . 3.2 mmp_? -57.79 -43.45 85.62 Favored 'General case' 0 C--N 1.341 0.236 0 CA-C-O 121.233 0.54 . . . . 0.0 111.117 177.319 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 30.9 mt-30 -75.33 -20.24 59.16 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 121.222 0.534 . . . . 0.0 110.814 179.299 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 79.94 29.39 47.02 Favored Glycine 0 N--CA 1.446 -0.698 0 C-N-CA 121.056 -0.592 . . . . 0.0 112.044 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 34.7 m -129.47 148.99 71.57 Favored Pre-proline 0 C--N 1.322 -0.607 0 O-C-N 122.48 -0.423 . . . . 0.0 110.981 -178.527 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' PRO . . . . . 0.518 ' HG2' ' OG ' ' A' ' 61' ' ' SER . 33.5 Cg_endo -66.99 150.87 82.82 Favored 'Trans proline' 0 N--CA 1.456 -0.728 0 C-N-CA 122.459 2.106 . . . . 0.0 112.296 178.713 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.506 ' HG2' ' SG ' ' A' ' 52' ' ' CYS . 75.8 mtp -70.61 -8.83 54.57 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.589 -177.086 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' ASN . . . . . 0.42 ' OD1' ' HB2' ' A' ' 58' ' ' PRO . 1.8 p-10 -92.37 -9.74 40.68 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.662 -179.466 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.518 ' OG ' ' HG2' ' A' ' 58' ' ' PRO . 70.0 m -89.64 -22.78 22.13 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-O 121.016 0.436 . . . . 0.0 111.703 -179.182 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 1.2 pp -126.05 171.15 11.05 Favored 'General case' 0 C--N 1.314 -0.978 0 O-C-N 121.965 -0.46 . . . . 0.0 111.996 -178.69 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.507 ' CG ' ' HB3' ' A' ' 93' ' ' GLU . 57.1 mtp180 -122.38 122.8 39.88 Favored 'General case' 0 CA--C 1.506 -0.744 0 CA-C-O 120.967 0.413 . . . . 0.0 110.663 -177.698 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -100.83 115.01 29.33 Favored 'General case' 0 C--N 1.304 -1.384 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.614 177.671 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.458 ' C ' HD22 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -143.87 162.01 37.21 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-O 121.46 0.648 . . . . 0.0 111.396 179.728 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 87.1 t80 -143.18 135.56 27.28 Favored 'General case' 0 C--N 1.306 -1.304 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 179.002 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.445 ' HG2' HE21 ' A' ' 69' ' ' GLN . 9.9 pt-20 49.62 31.12 3.98 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.057 0.943 . . . . 0.0 112.166 -179.564 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 84.94 14.24 70.13 Favored Glycine 0 N--CA 1.447 -0.612 0 CA-C-N 116.019 -0.537 . . . . 0.0 113.447 179.025 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' GLN . . . . . 0.445 HE21 ' HG2' ' A' ' 67' ' ' GLU . 2.7 pt20 -122.25 135.16 54.71 Favored 'General case' 0 C--N 1.317 -0.807 0 O-C-N 122.139 -0.624 . . . . 0.0 109.505 -178.737 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.46 140.57 48.35 Favored 'General case' 0 C--N 1.313 -1.005 0 CA-C-O 121.44 0.638 . . . . 0.0 109.961 178.843 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.451 HG21 HD12 ' A' ' 44' ' ' LEU . 22.8 mm -86.74 121.76 38.04 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.517 0 CA-C-O 121.075 0.464 . . . . 0.0 110.344 -178.338 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.416 ' O ' ' HB2' ' A' ' 75' ' ' HIS . . . -95.75 161.15 14.14 Favored 'General case' 0 N--CA 1.434 -1.246 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 179.667 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 48.5 m-20 -66.01 -27.89 68.46 Favored 'General case' 0 C--N 1.311 -1.108 0 CA-C-O 121.352 0.596 . . . . 0.0 110.925 -178.689 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 8.0 m-80 -91.92 1.64 57.05 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-O 121.107 0.48 . . . . 0.0 109.97 -178.793 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' HIS . . . . . 0.626 ' O ' ' HB2' ' A' ' 44' ' ' LEU . 7.6 m170 -81.02 146.75 30.5 Favored 'General case' 0 CA--C 1.498 -1.033 0 N-CA-C 109.778 -0.453 . . . . 0.0 109.778 -179.381 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.431 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 80.5 p -122.13 155.69 60.98 Favored Pre-proline 0 C--N 1.303 -1.44 0 C-N-CA 121.086 -0.245 . . . . 0.0 111.072 178.897 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_exo -60.79 -36.91 82.02 Favored 'Trans proline' 0 N--CA 1.46 -0.46 0 C-N-CA 122.385 2.056 . . . . 0.0 111.086 178.962 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' LYS . . . . . 0.47 ' HG2' ' O ' ' A' ' 40' ' ' MET . 16.4 ptmt -67.47 -38.92 85.13 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.848 -0.614 . . . . 0.0 111.376 -179.306 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -77.96 -32.71 51.58 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.602 -178.317 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.438 HD21 ' CG ' ' A' ' 75' ' ' HIS . 5.5 mt -83.16 0.92 43.05 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.137 0.494 . . . . 0.0 110.733 179.27 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 72.86 44.45 37.66 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 121.158 -0.544 . . . . 0.0 112.975 176.746 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 62.9 mtt -102.52 166.33 10.59 Favored 'General case' 0 C--N 1.313 -0.998 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 179.285 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' GLU . . . . . 0.435 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 11.3 pt-20 -140.8 -171.28 3.21 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-O 120.717 0.294 . . . . 0.0 110.65 178.829 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -69.15 126.91 31.27 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-O 121.687 0.756 . . . . 0.0 111.698 -177.948 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' GLU . . . . . 0.422 ' HG3' ' HE3' ' A' ' 23' ' ' LYS . 44.0 mt-10 76.2 13.34 2.61 Favored 'General case' 0 C--N 1.316 -0.859 0 C-N-CA 124.745 1.218 . . . . 0.0 111.498 178.03 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 86' ' ' ASP . . . . . 0.435 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 4.3 t0 -59.43 162.05 5.19 Favored 'General case' 0 C--O 1.239 0.549 0 CA-C-N 115.456 -0.793 . . . . 0.0 109.842 173.965 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 12.1 p -125.78 143.76 38.22 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.467 0 CA-C-O 121.342 0.591 . . . . 0.0 111.086 -176.415 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 3.8 mp -113.4 153.26 14.98 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.994 0 N-CA-C 109.087 -0.708 . . . . 0.0 109.087 179.207 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -105.72 138.7 41.47 Favored 'General case' 0 C--N 1.314 -0.946 0 CA-C-O 120.992 0.425 . . . . 0.0 109.932 -176.652 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' VAL . . . . . 0.565 ' HB ' ' HA2' ' A' ' 28' ' ' GLY . 91.4 t -131.04 134.73 61.14 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.066 0 CA-C-O 121.382 0.611 . . . . 0.0 110.733 179.394 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 92.0 m-85 -121.87 -178.92 3.97 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-N 115.913 -0.585 . . . . 0.0 109.511 179.543 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 8.1 tp60 -103.32 144.94 30.7 Favored 'General case' 0 C--N 1.307 -1.275 0 N-CA-C 109.747 -0.464 . . . . 0.0 109.747 179.135 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' GLU . . . . . 0.507 ' HB3' ' CG ' ' A' ' 63' ' ' ARG . 10.1 pt-20 -135.31 21.14 3.41 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.322 0.582 . . . . 0.0 110.684 176.12 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 80.8 mt-30 -60.77 -169.29 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.449 0 CA-C-N 115.595 -0.73 . . . . 0.0 111.209 176.048 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 13.4 t -158.19 166.76 31.62 Favored 'General case' 0 C--N 1.313 -1.004 0 O-C-N 121.685 -0.634 . . . . 0.0 109.86 -176.297 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -146.46 130.47 3.68 Favored Glycine 0 N--CA 1.438 -1.167 0 N-CA-C 111.409 -0.676 . . . . 0.0 111.409 179.774 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.44 -1.096 0 CA-C-O 118.507 -1.163 . . . . 0.0 111.425 179.667 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 67.5 mtt . . . . . 0 N--CA 1.479 0.992 0 CA-C-O 120.952 0.406 . . . . 0.0 111.117 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 39.6 m -134.43 -11.29 2.46 Favored 'General case' 0 CA--C 1.543 0.675 0 CA-C-O 120.916 0.388 . . . . 0.0 111.682 -178.529 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 28.3 m-20 -98.43 17.05 19.82 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-O 121.415 0.626 . . . . 0.0 110.424 -179.417 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 9.3 pt20 -73.47 4.43 4.83 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.768 -0.651 . . . . 0.0 112.198 -179.664 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 23.3 tt0 -64.16 160.71 17.78 Favored 'General case' 0 N--CA 1.437 -1.11 0 CA-C-O 121.448 0.642 . . . . 0.0 110.522 178.764 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -141.05 169.28 17.91 Favored 'General case' 0 C--N 1.303 -1.456 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 179.717 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.425 ' HD2' ' N ' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -135.37 150.55 72.78 Favored Pre-proline 0 C--N 1.299 -1.616 0 CA-C-N 116.693 -0.23 . . . . 0.0 110.476 -178.652 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -68.76 -162.75 0.08 OUTLIER 'Trans proline' 0 CA--C 1.532 0.398 0 C-N-CA 122.808 2.339 . . . . 0.0 112.12 179.95 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 44.1 m -128.08 86.17 2.44 Favored 'General case' 0 C--N 1.31 -1.137 0 O-C-N 121.723 -0.611 . . . . 0.0 110.449 -179.116 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 38.4 m -131.41 -42.15 1.07 Allowed 'General case' 0 C--N 1.314 -0.947 0 N-CA-C 109.386 -0.598 . . . . 0.0 109.386 178.258 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -63.32 154.86 30.41 Favored 'General case' 0 C--O 1.238 0.496 0 N-CA-C 108.632 -0.877 . . . . 0.0 108.632 175.753 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -75.58 77.42 2.59 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.781 0.8 . . . . 0.0 111.757 -177.352 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 81.3 mt -63.5 -62.61 1.56 Allowed 'General case' 0 C--N 1.307 -1.247 0 CA-C-N 114.68 -1.146 . . . . 0.0 109.803 177.116 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 155.89 -46.14 0.52 Allowed Glycine 0 CA--C 1.498 -1.006 0 N-CA-C 110.723 -0.951 . . . . 0.0 110.723 177.823 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -71.24 121.33 18.22 Favored 'General case' 0 C--N 1.312 -1.023 0 N-CA-C 109.398 -0.593 . . . . 0.0 109.398 177.812 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 57.8 mttp -129.04 161.51 29.81 Favored 'General case' 0 C--N 1.313 -1.02 0 CA-C-O 120.979 0.418 . . . . 0.0 110.901 -176.83 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 24.4 mtpp -132.05 173.83 10.82 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.593 178.674 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -156.66 163.38 39.38 Favored 'General case' 0 N--CA 1.439 -0.99 0 CA-C-O 121.133 0.492 . . . . 0.0 111.097 179.273 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 102.37 130.98 7.18 Favored Glycine 0 N--CA 1.442 -0.953 0 CA-C-N 116.033 -0.53 . . . . 0.0 112.436 179.973 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.487 ' O ' ' HG3' ' A' ' 39' ' ' LYS . 25.4 tt0 67.35 22.37 9.53 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 123.701 0.8 . . . . 0.0 112.108 177.271 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 43.7 p90 -113.36 162.97 15.45 Favored 'General case' 0 C--N 1.321 -0.663 0 O-C-N 121.669 -0.645 . . . . 0.0 110.514 178.479 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.409 ' HB ' ' HA ' ' A' ' 84' ' ' GLU . 28.2 pt -121.5 172.01 9.31 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.236 0 CA-C-O 121.325 0.583 . . . . 0.0 110.365 178.785 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 1.5 mppt? -119.12 145.41 45.98 Favored 'General case' 0 C--N 1.298 -1.638 0 N-CA-C 108.744 -0.835 . . . . 0.0 108.744 -179.356 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.4 mp -138.36 164.59 28.92 Favored 'General case' 0 C--N 1.303 -1.444 0 CA-C-O 121.332 0.587 . . . . 0.0 111.089 176.19 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.426 ' O ' ' HA ' ' A' ' 87' ' ' VAL . 5.5 tmmm? -133.26 143.02 48.82 Favored 'General case' 0 N--CA 1.434 -1.228 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.358 -178.965 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.532 ' O ' ' HA ' ' A' ' 33' ' ' GLU . 0.9 OUTLIER -114.4 142.68 26.24 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.377 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.039 -179.261 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.432 HD13 ' HG2' ' A' ' 33' ' ' GLU . 46.5 mm -105.04 115.16 46.37 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.028 0 N-CA-C 107.505 -1.295 . . . . 0.0 107.505 175.042 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' GLY . . . . . 0.433 ' HA2' ' HB ' ' A' ' 90' ' ' VAL . . . -82.77 166.9 45.54 Favored Glycine 0 N--CA 1.42 -2.37 0 C-N-CA 120.202 -0.999 . . . . 0.0 111.748 -176.58 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.38 -23.07 65.53 Favored 'General case' 0 C--N 1.305 -1.343 0 CA-C-O 121.527 0.68 . . . . 0.0 111.023 178.395 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -103.4 15.36 29.26 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.429 0.633 . . . . 0.0 109.493 178.704 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 29.2 t 73.12 16.85 4.2 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 123.771 0.828 . . . . 0.0 111.139 179.526 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 12.5 t -73.45 111.57 8.71 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 116.154 -0.476 . . . . 0.0 109.822 179.477 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.532 ' HA ' ' O ' ' A' ' 26' ' ' VAL . 43.9 mt-10 -88.37 108.64 19.45 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 121.376 0.607 . . . . 0.0 110.701 179.768 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 27.0 mm -98.37 137.22 26.51 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.269 0 N-CA-C 109.233 -0.654 . . . . 0.0 109.233 179.741 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 12.8 m170 -115.75 133.1 56.37 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 -179.846 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.513 ' HZ ' HG23 ' A' ' 26' ' ' VAL . 1.2 p90 -147.79 165.13 31.48 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-O 121.147 0.499 . . . . 0.0 111.552 -178.428 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 9.4 ptpp? -119.91 125.23 47.94 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.173 0.511 . . . . 0.0 110.94 179.713 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 33.9 m -140.56 154.94 22.45 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 178.773 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.487 ' HG3' ' O ' ' A' ' 20' ' ' GLU . 83.9 tttt -87.87 162.81 16.73 Favored 'General case' 0 C--N 1.306 -1.29 0 O-C-N 121.796 -0.565 . . . . 0.0 111.442 -178.02 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -78.45 15.26 1.02 Allowed 'General case' 0 N--CA 1.479 1.018 0 O-C-N 121.856 -0.527 . . . . 0.0 112.25 -177.03 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 14.4 t -138.66 3.34 2.28 Favored 'General case' 0 C--N 1.308 -1.236 0 CA-C-O 121.23 0.538 . . . . 0.0 110.784 -177.162 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' THR . . . . . 0.439 HG22 ' O ' ' A' ' 39' ' ' LYS . 7.3 t -96.84 166.22 11.73 Favored 'General case' 0 N--CA 1.44 -0.97 0 CA-C-O 120.913 0.387 . . . . 0.0 110.357 -175.355 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' HIS . . . . . 0.401 ' HB3' ' O ' ' A' ' 73' ' ' ASP . 63.4 m170 -84.63 144.12 28.81 Favored 'General case' 0 C--N 1.314 -0.974 0 CA-C-O 121.498 0.666 . . . . 0.0 111.276 -178.896 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.543 ' O ' ' HG2' ' A' ' 48' ' ' LYS . 0.9 OUTLIER -65.7 -15.0 62.39 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.423 -0.808 . . . . 0.0 111.129 178.975 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.677 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -52.07 -48.37 64.71 Favored 'General case' 0 C--O 1.222 -0.391 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.803 -179.481 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 20.5 ptmt -67.03 -31.65 72.33 Favored 'General case' 0 C--O 1.208 -1.117 0 CA-C-O 120.894 0.378 . . . . 0.0 110.892 -179.943 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.408 ' HB3' HD13 ' A' ' 44' ' ' LEU . 8.6 tt -71.19 -49.97 38.02 Favored 'General case' 0 C--N 1.307 -1.241 0 CA-C-O 121.021 0.438 . . . . 0.0 110.766 -178.834 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.543 ' HG2' ' O ' ' A' ' 44' ' ' LEU . 6.1 ptmm? -62.41 -41.16 98.47 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.657 -178.207 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.677 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 8.7 pt-20 -72.04 -34.2 68.59 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-O 121.09 0.472 . . . . 0.0 110.417 178.072 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 5.4 m -65.06 -43.53 91.97 Favored 'General case' 0 C--O 1.234 0.262 0 N-CA-C 112.296 0.48 . . . . 0.0 112.296 -178.118 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.483 ' CD1' HG11 ' A' ' 26' ' ' VAL . 2.1 p90 -76.03 -33.38 59.63 Favored 'General case' 0 N--CA 1.444 -0.767 0 C-N-CA 119.326 -0.95 . . . . 0.0 110.189 -178.951 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' CYS . . . . . 0.509 ' SG ' HD11 ' A' ' 62' ' ' LEU . 91.6 m -62.42 -44.91 95.31 Favored 'General case' 0 CA--C 1.511 -0.544 0 CA-C-O 121.199 0.523 . . . . 0.0 110.611 179.556 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 13.2 pt20 -67.35 -34.79 78.04 Favored 'General case' 0 N--CA 1.443 -0.78 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.533 -179.032 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 2.3 mmp_? -56.3 -43.06 78.52 Favored 'General case' 0 C--N 1.346 0.427 0 CA-C-O 121.045 0.45 . . . . 0.0 111.232 177.331 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 29.5 mt-30 -73.86 -21.46 60.1 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.127 0.489 . . . . 0.0 110.931 179.631 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 84.68 28.12 33.19 Favored Glycine 0 N--CA 1.444 -0.769 0 C-N-CA 120.814 -0.707 . . . . 0.0 112.247 179.501 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 31.4 m -128.83 150.2 74.36 Favored Pre-proline 0 C--N 1.327 -0.405 0 O-C-N 122.418 -0.46 . . . . 0.0 110.753 -178.706 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' PRO . . . . . 0.478 ' HG2' ' OG ' ' A' ' 61' ' ' SER . 28.8 Cg_endo -65.39 153.96 75.83 Favored 'Trans proline' 0 N--CA 1.456 -0.715 0 C-N-CA 122.216 1.944 . . . . 0.0 111.5 177.115 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.459 ' HG2' ' SG ' ' A' ' 52' ' ' CYS . 77.3 mtp -74.97 -8.63 57.07 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.437 -176.201 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 24.2 p30 -90.55 -12.13 38.03 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-O 121.102 0.477 . . . . 0.0 111.596 -178.225 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.478 ' OG ' ' HG2' ' A' ' 58' ' ' PRO . 64.3 m -83.95 -21.08 31.93 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-O 121.24 0.543 . . . . 0.0 111.275 -179.234 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.509 HD11 ' SG ' ' A' ' 52' ' ' CYS . 1.2 pp -129.9 173.04 11.06 Favored 'General case' 0 C--N 1.309 -1.179 0 CA-C-O 121.479 0.657 . . . . 0.0 112.667 -176.932 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.47 ' HG3' ' HB2' ' A' ' 91' ' ' TYR . 1.1 ptp180 -129.35 132.64 47.12 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 115.53 -0.759 . . . . 0.0 111.741 -179.659 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.481 ' CZ ' ' HE2' ' A' ' 48' ' ' LYS . 0.1 OUTLIER -107.66 120.29 41.82 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-N 115.187 -0.915 . . . . 0.0 110.758 -177.662 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.465 ' C ' HD22 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -145.51 163.91 33.24 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-O 121.491 0.662 . . . . 0.0 111.173 179.72 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 80.3 t80 -146.29 135.59 22.84 Favored 'General case' 0 C--N 1.307 -1.267 0 N-CA-C 109.199 -0.667 . . . . 0.0 109.199 178.503 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.417 ' HG2' HE21 ' A' ' 69' ' ' GLN . 7.2 pt-20 49.89 28.57 2.89 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 124.126 0.971 . . . . 0.0 112.387 179.525 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 85.03 22.69 51.83 Favored Glycine 0 N--CA 1.445 -0.742 0 C-N-CA 121.146 -0.55 . . . . 0.0 112.96 179.596 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' GLN . . . . . 0.417 HE21 ' HG2' ' A' ' 67' ' ' GLU . 2.6 pt20 -130.15 134.41 47.3 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 179.085 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 1.3 ppt_? -71.98 148.39 45.98 Favored 'General case' 0 C--N 1.31 -1.142 0 CA-C-O 121.298 0.57 . . . . 0.0 110.252 178.303 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 23.4 mm -95.39 123.23 47.46 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.226 0 O-C-N 121.919 -0.488 . . . . 0.0 110.901 -177.757 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -99.46 164.56 12.05 Favored 'General case' 0 N--CA 1.447 -0.596 0 N-CA-C 110.168 -0.308 . . . . 0.0 110.168 179.704 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' ASP . . . . . 0.401 ' O ' ' HB3' ' A' ' 43' ' ' HIS . 31.7 m-20 -64.87 -28.06 69.29 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.239 0.542 . . . . 0.0 111.015 -179.298 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 3.3 m-80 -96.12 5.59 50.75 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 121.097 0.475 . . . . 0.0 110.06 -177.373 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' HIS . . . . . 0.475 ' CG ' HD21 ' A' ' 80' ' ' LEU . 3.4 m170 -83.17 140.52 32.53 Favored 'General case' 0 CA--C 1.502 -0.896 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 179.788 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.439 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 59.9 p -119.08 155.7 53.0 Favored Pre-proline 0 C--N 1.306 -1.311 0 C-N-CA 120.985 -0.286 . . . . 0.0 110.936 179.469 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_exo -61.82 -37.87 63.73 Favored 'Trans proline' 0 N--CA 1.46 -0.461 0 C-N-CA 122.465 2.11 . . . . 0.0 111.341 179.808 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' LYS . . . . . 0.476 ' HG3' ' N ' ' A' ' 79' ' ' GLU . 34.1 pttt -68.04 -36.01 79.19 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.621 -179.344 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.476 ' N ' ' HG3' ' A' ' 78' ' ' LYS . 11.2 mm-40 -74.01 -42.5 60.25 Favored 'General case' 0 CA--C 1.512 -0.511 0 CA-C-O 121.18 0.514 . . . . 0.0 111.01 -179.576 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.475 HD21 ' CG ' ' A' ' 75' ' ' HIS . 5.7 mt -76.19 -6.45 51.35 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.037 0.446 . . . . 0.0 111.237 -178.246 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 80.57 46.9 7.08 Favored Glycine 0 N--CA 1.447 -0.575 0 C-N-CA 120.862 -0.685 . . . . 0.0 112.744 177.885 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 59.3 mtt -106.64 164.32 12.18 Favored 'General case' 0 C--N 1.314 -0.942 0 O-C-N 122.51 -0.406 . . . . 0.0 109.982 178.437 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -138.18 -169.35 2.55 Favored 'General case' 0 C--N 1.313 -0.987 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 178.256 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.429 ' O ' ' HB2' ' A' ' 85' ' ' GLU . 11.5 pt-20 -78.44 134.32 37.38 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-O 121.545 0.688 . . . . 0.0 111.719 -178.893 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 85' ' ' GLU . . . . . 0.429 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 37.7 mt-10 78.97 8.22 1.97 Allowed 'General case' 0 C--N 1.325 -0.468 0 C-N-CA 125.104 1.361 . . . . 0.0 111.539 -179.426 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 4.6 t0 -63.26 166.52 6.15 Favored 'General case' 0 C--O 1.239 0.539 0 CA-C-N 115.734 -0.667 . . . . 0.0 110.472 175.687 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.426 ' HA ' ' O ' ' A' ' 25' ' ' LYS . 8.3 p -129.08 143.63 40.65 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.076 0 CA-C-O 121.358 0.599 . . . . 0.0 111.654 -176.754 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 3.5 mp -113.58 154.87 14.9 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 179.18 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 11.0 tp10 -107.88 138.9 43.32 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-O 121.032 0.444 . . . . 0.0 110.686 -176.262 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' VAL . . . . . 0.433 ' HB ' ' HA2' ' A' ' 28' ' ' GLY . 97.6 t -129.92 135.29 61.44 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.92 0 CA-C-O 121.362 0.601 . . . . 0.0 110.883 178.872 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 91' ' ' TYR . . . . . 0.47 ' HB2' ' HG3' ' A' ' 63' ' ' ARG . 81.2 m-85 -121.78 173.91 7.18 Favored 'General case' 0 C--N 1.31 -1.147 0 CA-C-N 116.115 -0.493 . . . . 0.0 109.915 178.856 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 9.5 tp60 -101.09 148.83 24.61 Favored 'General case' 0 C--N 1.306 -1.315 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 179.903 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -143.34 21.14 1.89 Allowed 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.075 0.464 . . . . 0.0 110.998 177.419 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 97.6 mt-30 -54.35 -174.1 0.0 OUTLIER 'General case' 0 CA--C 1.54 0.592 0 CA-C-O 121.511 0.672 . . . . 0.0 112.576 177.19 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 5.3 t -86.37 -33.72 20.43 Favored 'General case' 0 C--N 1.314 -0.971 0 O-C-N 121.492 -0.755 . . . . 0.0 111.423 -172.319 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 141.72 -56.69 0.58 Allowed Glycine 0 N--CA 1.445 -0.74 0 C-N-CA 120.649 -0.786 . . . . 0.0 112.265 178.622 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.441 -0.976 0 CA-C-O 118.303 -1.276 . . . . 0.0 111.406 179.715 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 71.7 mtm . . . . . 0 N--CA 1.471 0.604 0 N-CA-C 111.876 0.324 . . . . 0.0 111.876 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 49.4 m -104.98 -71.97 0.72 Allowed 'General case' 0 C--N 1.331 -0.204 0 O-C-N 121.57 -0.706 . . . . 0.0 112.557 -178.206 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -114.29 22.35 13.83 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.581 0.705 . . . . 0.0 111.201 -175.036 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -100.07 3.5 44.09 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-O 122.023 0.916 . . . . 0.0 109.759 -179.0 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -145.5 156.75 43.91 Favored 'General case' 0 C--N 1.298 -1.642 0 CA-C-N 114.781 -1.099 . . . . 0.0 110.205 -177.887 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -146.05 161.21 40.64 Favored 'General case' 0 C--N 1.314 -0.944 0 N-CA-C 110.073 -0.343 . . . . 0.0 110.073 179.245 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 20.5 ptmt -151.98 154.86 33.17 Favored Pre-proline 0 C--N 1.318 -0.778 0 N-CA-C 110.002 -0.37 . . . . 0.0 110.002 -179.57 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -58.58 122.71 12.11 Favored 'Trans proline' 0 C--O 1.241 0.656 0 C-N-CA 122.77 2.314 . . . . 0.0 111.599 179.985 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 45.3 t -148.3 159.23 44.2 Favored 'General case' 0 N--CA 1.436 -1.153 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 -178.037 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 10.7 t -86.45 -7.73 58.18 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 121.459 0.647 . . . . 0.0 109.664 178.155 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 29.4 mt-10 -139.04 138.28 37.03 Favored 'General case' 0 CA--C 1.503 -0.834 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.768 178.687 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 -79.79 134.84 36.37 Favored 'General case' 0 C--N 1.311 -1.082 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.48 -179.86 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 72.0 mt -105.6 159.42 15.97 Favored 'General case' 0 C--N 1.308 -1.198 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.1 -178.965 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 151.37 49.86 0.02 OUTLIER Glycine 0 C--N 1.312 -0.767 0 N-CA-C 110.489 -1.044 . . . . 0.0 110.489 -177.667 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -73.9 131.19 41.22 Favored 'General case' 0 C--N 1.319 -0.74 0 C-N-CA 122.852 0.461 . . . . 0.0 111.296 -177.108 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 45.7 mtmt -134.93 169.38 17.49 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.077 -178.464 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 21.7 ptmt -75.23 159.53 31.44 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.083 0.468 . . . . 0.0 110.705 179.509 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 34.2 mt-10 -113.23 -178.86 3.48 Favored 'General case' 0 C--N 1.309 -1.165 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.568 178.715 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.499 ' H ' ' HD1' ' A' ' 21' ' ' TYR . . . 143.69 119.05 1.34 Allowed Glycine 0 N--CA 1.448 -0.505 0 N-CA-C 111.864 -0.495 . . . . 0.0 111.864 179.677 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 68.23 48.08 0.94 Allowed 'General case' 0 N--CA 1.476 0.841 0 CA-C-O 121.701 0.763 . . . . 0.0 109.462 179.135 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.519 ' CE2' ' HD2' ' A' ' 37' ' ' LYS . 47.2 p90 -122.41 158.92 28.65 Favored 'General case' 0 C--N 1.313 -1.013 0 CA-C-O 121.683 0.754 . . . . 0.0 111.796 -175.255 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.475 ' HB ' ' HA ' ' A' ' 84' ' ' GLU . 23.9 pt -116.59 172.29 4.78 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.25 0 CA-C-N 115.294 -0.867 . . . . 0.0 109.206 176.442 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.494 ' HG2' ' HG2' ' A' ' 37' ' ' LYS . 34.6 mtmt -110.66 148.85 31.39 Favored 'General case' 0 C--N 1.298 -1.635 0 N-CA-C 109.75 -0.463 . . . . 0.0 109.75 179.739 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.6 mp -140.53 154.22 46.47 Favored 'General case' 0 C--N 1.3 -1.58 0 CA-C-O 121.345 0.593 . . . . 0.0 110.664 171.916 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.466 ' O ' ' HA ' ' A' ' 87' ' ' VAL . 5.4 tmmm? -128.41 143.84 51.05 Favored 'General case' 0 C--N 1.308 -1.212 0 CA-C-O 121.376 0.608 . . . . 0.0 110.334 -178.546 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.509 HG23 ' HZ ' ' A' ' 36' ' ' PHE . 0.9 OUTLIER -115.96 140.16 39.18 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.494 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.249 -179.132 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.402 HD13 ' HG2' ' A' ' 33' ' ' GLU . 46.8 mm -103.81 112.12 36.09 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.28 0 N-CA-C 107.194 -1.41 . . . . 0.0 107.194 174.496 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' GLY . . . . . 0.49 ' HA2' ' HB ' ' A' ' 90' ' ' VAL . . . -80.87 166.58 48.94 Favored Glycine 0 N--CA 1.428 -1.89 0 C-N-CA 120.181 -1.009 . . . . 0.0 111.493 -176.92 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.92 -20.07 64.83 Favored 'General case' 0 C--N 1.314 -0.978 0 CA-C-O 121.567 0.699 . . . . 0.0 110.902 177.481 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -97.16 12.97 30.87 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 121.685 0.755 . . . . 0.0 109.568 177.653 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 21.7 m 69.81 14.64 8.02 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.744 -179.055 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 7.9 t -72.79 116.93 13.87 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.533 -179.215 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.498 ' HA ' ' O ' ' A' ' 26' ' ' VAL . 41.7 mt-10 -89.44 106.33 18.38 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.214 0.531 . . . . 0.0 110.791 178.333 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 29.5 mm -96.44 136.11 28.36 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.426 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 178.574 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 12.5 m170 -115.62 131.35 56.96 Favored 'General case' 0 C--N 1.321 -0.674 0 N-CA-C 109.783 -0.451 . . . . 0.0 109.783 -178.373 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.509 ' HZ ' HG23 ' A' ' 26' ' ' VAL . 2.1 p90 -147.2 149.09 32.26 Favored 'General case' 0 C--N 1.309 -1.163 0 CA-C-O 121.33 0.586 . . . . 0.0 111.379 -179.311 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.519 ' HD2' ' CE2' ' A' ' 21' ' ' TYR . 38.1 mtmt -110.03 123.3 49.43 Favored 'General case' 0 C--N 1.313 -0.979 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.418 178.774 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.479 HG21 HD12 ' A' ' 47' ' ' LEU . 22.5 m -141.33 165.19 19.19 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.96 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 179.816 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.433 ' O ' HG22 ' A' ' 42' ' ' THR . 48.0 mtpt -84.81 176.71 8.34 Favored 'General case' 0 C--N 1.308 -1.237 0 CA-C-O 121.566 0.698 . . . . 0.0 111.517 179.854 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.38 -33.99 20.34 Favored 'General case' 0 C--N 1.307 -1.27 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.25 178.672 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 9.0 t -94.06 25.32 3.78 Favored 'General case' 0 N--CA 1.444 -0.732 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.24 -177.765 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' THR . . . . . 0.433 HG22 ' O ' ' A' ' 39' ' ' LYS . 7.0 t -108.08 172.6 6.74 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 109.711 -0.477 . . . . 0.0 109.711 178.85 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 43' ' ' HIS . . . . . 0.423 ' O ' ' HG3' ' A' ' 46' ' ' LYS . 47.8 m170 -92.92 143.89 25.8 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-O 121.501 0.667 . . . . 0.0 111.479 -179.618 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.539 ' HB2' ' O ' ' A' ' 75' ' ' HIS . 0.7 OUTLIER -68.13 -17.3 64.32 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.564 178.469 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.514 ' HA ' ' HD3' ' A' ' 48' ' ' LYS . 0.0 OUTLIER -54.82 -44.94 74.3 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.883 -179.361 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.581 ' O ' ' HB2' ' A' ' 50' ' ' SER . 0.0 OUTLIER -74.0 -26.12 60.27 Favored 'General case' 0 N--CA 1.439 -1.009 0 CA-C-O 121.296 0.57 . . . . 0.0 110.493 -179.176 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.479 HD12 HG21 ' A' ' 38' ' ' VAL . 8.7 tt -72.96 -52.03 16.09 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.605 178.464 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.514 ' HD3' ' HA ' ' A' ' 45' ' ' LYS . 6.1 ptmm? -59.7 -41.04 89.88 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.98 0.419 . . . . 0.0 111.557 -178.695 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.47 -31.12 65.16 Favored 'General case' 0 C--N 1.318 -0.779 0 C-N-CA 120.437 -0.505 . . . . 0.0 110.564 178.247 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.581 ' HB2' ' O ' ' A' ' 46' ' ' LYS . 8.6 t -66.23 -42.89 88.04 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.481 -178.398 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.463 ' CD2' ' HA ' ' A' ' 48' ' ' LYS . 3.4 p90 -76.51 -32.85 58.55 Favored 'General case' 0 N--CA 1.446 -0.625 0 C-N-CA 119.672 -0.811 . . . . 0.0 110.502 -179.473 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 52' ' ' CYS . . . . . 0.464 ' SG ' HD11 ' A' ' 62' ' ' LEU . 90.8 m -63.77 -45.03 91.65 Favored 'General case' 0 CA--C 1.509 -0.625 0 CA-C-O 121.229 0.537 . . . . 0.0 110.291 179.07 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' GLN . . . . . 0.44 ' HG2' ' O ' ' A' ' 50' ' ' SER . 13.8 pt20 -66.46 -33.96 76.88 Favored 'General case' 0 N--CA 1.444 -0.734 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.319 -178.987 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 2.2 mmp_? -56.05 -39.16 71.6 Favored 'General case' 0 C--N 1.349 0.571 0 CA-C-O 121.244 0.545 . . . . 0.0 111.08 176.204 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 29.6 mt-30 -82.32 -22.07 35.78 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.363 -178.482 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 83.6 29.54 32.32 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 120.43 -0.891 . . . . 0.0 111.721 179.736 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 21.0 m -129.11 149.9 73.89 Favored Pre-proline 0 C--O 1.238 0.495 0 O-C-N 122.519 -0.401 . . . . 0.0 110.692 -177.955 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' PRO . . . . . 0.512 ' HG2' ' OG ' ' A' ' 61' ' ' SER . 34.3 Cg_endo -65.78 149.71 86.6 Favored 'Trans proline' 0 C--O 1.238 0.483 0 C-N-CA 122.487 2.125 . . . . 0.0 112.383 178.445 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.446 ' HG2' ' SG ' ' A' ' 52' ' ' CYS . 73.4 mtp -74.25 -9.31 58.48 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.514 -177.28 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 2.0 p-10 -91.73 -8.32 47.26 Favored 'General case' 0 C--N 1.311 -1.068 0 CA-C-O 121.142 0.496 . . . . 0.0 111.266 -179.09 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.512 ' OG ' ' HG2' ' A' ' 58' ' ' PRO . 71.0 m -91.76 -20.32 21.65 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 121.012 0.434 . . . . 0.0 111.946 -179.785 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.464 HD11 ' SG ' ' A' ' 52' ' ' CYS . 1.9 pp -130.4 155.21 46.78 Favored 'General case' 0 C--N 1.315 -0.931 0 N-CA-C 112.629 0.603 . . . . 0.0 112.629 -179.229 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.553 ' O ' ' HA ' ' A' ' 90' ' ' VAL . 40.2 mtm-85 -105.79 130.23 53.82 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.576 -177.943 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -107.12 116.12 31.37 Favored 'General case' 0 C--N 1.309 -1.191 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.458 178.131 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.464 ' C ' HD22 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -141.89 163.2 33.54 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 121.464 0.65 . . . . 0.0 111.353 179.704 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 90.5 t80 -145.07 138.04 26.41 Favored 'General case' 0 C--N 1.308 -1.218 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 179.602 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.479 ' HG2' HE21 ' A' ' 69' ' ' GLN . 6.8 pt-20 49.86 26.76 2.06 Favored 'General case' 0 N--CA 1.485 1.314 0 C-N-CA 123.997 0.919 . . . . 0.0 112.118 -179.261 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 82.66 23.11 56.94 Favored Glycine 0 CA--C 1.522 0.512 0 C-N-CA 120.525 -0.845 . . . . 0.0 113.087 -177.618 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' GLN . . . . . 0.479 HE21 ' HG2' ' A' ' 67' ' ' GLU . 2.6 pt20 -129.57 134.36 47.69 Favored 'General case' 0 C--N 1.319 -0.735 0 O-C-N 122.177 -0.601 . . . . 0.0 109.471 179.797 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.45 ' CD ' ' H ' ' A' ' 70' ' ' ARG . 0.2 OUTLIER -68.31 143.59 55.14 Favored 'General case' 0 C--N 1.307 -1.278 0 CA-C-O 121.53 0.681 . . . . 0.0 110.612 176.662 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.422 HG21 HD12 ' A' ' 44' ' ' LEU . 25.1 mm -90.26 122.94 42.18 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.468 0 CA-C-O 121.055 0.455 . . . . 0.0 110.866 -178.148 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.414 ' O ' ' HB2' ' A' ' 75' ' ' HIS . . . -96.04 163.12 13.26 Favored 'General case' 0 N--CA 1.436 -1.153 0 N-CA-C 109.701 -0.481 . . . . 0.0 109.701 178.8 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 73' ' ' ASP . . . . . 0.434 ' HB3' ' HB3' ' A' ' 45' ' ' LYS . 36.5 m-20 -68.53 -24.07 64.6 Favored 'General case' 0 C--N 1.31 -1.113 0 CA-C-O 121.645 0.736 . . . . 0.0 110.547 -179.644 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 12.0 m-80 -97.4 8.45 44.56 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.725 -0.67 . . . . 0.0 109.956 -178.984 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' HIS . . . . . 0.539 ' O ' ' HB2' ' A' ' 44' ' ' LEU . 4.5 m170 -85.91 140.57 30.25 Favored 'General case' 0 CA--C 1.502 -0.887 0 CA-C-N 115.982 -0.554 . . . . 0.0 109.568 179.426 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 81.9 p -117.83 155.34 50.98 Favored Pre-proline 0 C--N 1.306 -1.317 0 C-N-CA 120.945 -0.302 . . . . 0.0 111.343 179.237 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -59.94 -40.97 57.47 Favored 'Trans proline' 0 C--N 1.347 0.453 0 C-N-CA 122.756 2.304 . . . . 0.0 111.625 179.517 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' LYS . . . . . 0.493 ' HG3' ' N ' ' A' ' 79' ' ' GLU . 35.2 pttt -67.04 -37.21 83.7 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.204 0.525 . . . . 0.0 110.813 -178.775 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.493 ' N ' ' HG3' ' A' ' 78' ' ' LYS . 23.6 mm-40 -72.3 -41.82 66.19 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-O 121.007 0.432 . . . . 0.0 111.051 -179.128 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.445 HD21 ' CG ' ' A' ' 75' ' ' HIS . 4.6 mt -77.21 -9.1 58.57 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.068 0.461 . . . . 0.0 111.123 -178.885 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 82.42 44.05 7.62 Favored Glycine 0 C--O 1.237 0.323 0 C-N-CA 120.739 -0.743 . . . . 0.0 113.004 178.121 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 55.3 mtt -103.62 162.71 12.83 Favored 'General case' 0 C--N 1.317 -0.843 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 178.414 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -143.45 -165.43 2.09 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 121.06 0.457 . . . . 0.0 111.017 178.934 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.475 ' HA ' ' HB ' ' A' ' 22' ' ' ILE . 9.0 pt-20 -68.55 117.41 10.26 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-O 121.737 0.779 . . . . 0.0 112.743 -177.454 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 11.3 tt0 82.07 14.46 0.51 Allowed 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 125.435 1.494 . . . . 0.0 110.944 175.851 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -62.44 166.57 5.01 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-N 115.54 -0.755 . . . . 0.0 110.445 176.423 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.466 ' HA ' ' O ' ' A' ' 25' ' ' LYS . 10.4 p -126.9 146.02 33.51 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.072 0 CA-C-O 121.451 0.643 . . . . 0.0 111.897 -175.925 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 3.6 mp -116.05 153.76 17.63 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.752 0 N-CA-C 108.764 -0.828 . . . . 0.0 108.764 177.507 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 13.5 tp10 -106.15 137.9 43.28 Favored 'General case' 0 C--N 1.319 -0.723 0 O-C-N 122.073 -0.392 . . . . 0.0 110.83 -176.822 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' VAL . . . . . 0.553 ' HA ' ' O ' ' A' ' 63' ' ' ARG . 95.2 t -127.31 131.8 70.13 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-O 121.251 0.548 . . . . 0.0 111.553 178.85 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 63.9 m-85 -116.13 174.95 5.77 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.101 -0.5 . . . . 0.0 109.829 179.461 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 10.2 tp60 -103.06 128.17 50.04 Favored 'General case' 0 C--N 1.312 -1.038 0 N-CA-C 110.058 -0.349 . . . . 0.0 110.058 178.047 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 93' ' ' GLU . . . . . 0.434 ' HB3' ' CG ' ' A' ' 63' ' ' ARG . 11.6 pt-20 -119.7 19.44 12.53 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.151 0.5 . . . . 0.0 110.9 177.904 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 97.3 mt-30 -57.94 -169.45 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.586 0 CA-C-O 121.445 0.641 . . . . 0.0 111.615 176.263 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 9.9 t -157.22 164.94 37.19 Favored 'General case' 0 N--CA 1.437 -1.112 0 O-C-N 121.521 -0.737 . . . . 0.0 110.105 -175.355 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -95.23 -168.12 35.86 Favored Glycine 0 N--CA 1.437 -1.266 0 C-N-CA 121.027 -0.606 . . . . 0.0 111.828 -179.687 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.436 -1.35 0 CA-C-O 118.123 -1.376 . . . . 0.0 110.777 -179.494 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.48 1.069 0 N-CA-C 111.752 0.278 . . . . 0.0 111.752 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 10.8 m -94.36 -33.45 13.17 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.495 0.664 . . . . 0.0 111.112 -177.89 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -121.25 106.75 11.79 Favored 'General case' 0 N--CA 1.425 -1.688 0 N-CA-C 107.47 -1.307 . . . . 0.0 107.47 179.929 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 19.2 mm-40 -90.5 175.89 6.9 Favored 'General case' 0 C--N 1.283 -2.299 0 CA-C-N 115.086 -0.961 . . . . 0.0 110.832 -175.061 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -80.76 150.51 29.23 Favored 'General case' 0 N--CA 1.439 -1.024 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 178.784 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -146.14 149.91 34.89 Favored 'General case' 0 C--N 1.305 -1.342 0 CA-C-O 120.993 0.425 . . . . 0.0 109.906 -179.047 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 6.0 ptpp? -128.6 154.6 79.61 Favored Pre-proline 0 N--CA 1.43 -1.437 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 -179.332 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -55.57 -20.98 29.13 Favored 'Trans proline' 0 CA--C 1.539 0.737 0 C-N-CA 123.103 2.535 . . . . 0.0 113.722 -178.521 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 45.2 t -77.36 -26.39 51.9 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.464 0.649 . . . . 0.0 109.811 178.349 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 58.2 m -80.74 114.12 19.41 Favored 'General case' 0 N--CA 1.44 -0.962 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.459 179.606 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 3.7 tm-20 -78.41 112.05 15.04 Favored 'General case' 0 N--CA 1.439 -0.986 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 178.51 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -138.79 -171.26 3.04 Favored 'General case' 0 N--CA 1.437 -1.084 0 N-CA-C 107.558 -1.275 . . . . 0.0 107.558 -179.429 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 68.9 mt -102.87 169.25 8.71 Favored 'General case' 0 C--N 1.304 -1.372 0 O-C-N 121.515 -0.741 . . . . 0.0 111.44 -176.411 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 92.65 19.49 37.49 Favored Glycine 0 N--CA 1.439 -1.145 0 N-CA-C 110.683 -0.967 . . . . 0.0 110.683 -176.627 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -52.0 -26.76 11.41 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 124.021 0.928 . . . . 0.0 112.857 179.701 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.537 ' H ' ' HD2' ' A' ' 16' ' ' LYS . 0.1 OUTLIER -74.34 122.38 22.83 Favored 'General case' 0 C--N 1.297 -1.68 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 179.617 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 6.1 mmmm -131.22 135.79 47.68 Favored 'General case' 0 C--N 1.305 -1.363 0 CA-C-O 122.0 0.905 . . . . 0.0 113.28 -175.315 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -61.32 157.0 17.49 Favored 'General case' 0 C--N 1.307 -1.267 0 CA-C-N 114.387 -1.279 . . . . 0.0 111.487 174.133 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 127.25 -37.24 2.41 Favored Glycine 0 N--CA 1.444 -0.809 0 N-CA-C 111.135 -0.786 . . . . 0.0 111.135 -177.6 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.433 ' HB2' ' HE3' ' A' ' 39' ' ' LYS . 49.3 mt-10 -120.17 47.54 1.74 Allowed 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 179.013 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.423 ' CD1' ' HB3' ' A' ' 37' ' ' LYS . 26.6 p90 -110.03 160.61 16.29 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-O 121.859 0.837 . . . . 0.0 113.071 -176.009 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.411 ' HB ' ' HA ' ' A' ' 84' ' ' GLU . 26.3 pt -109.15 173.21 2.0 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.098 0 CA-C-N 114.693 -1.139 . . . . 0.0 109.233 177.319 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 16.2 mtmt -113.66 142.81 45.56 Favored 'General case' 0 C--N 1.293 -1.869 0 N-CA-C 109.384 -0.599 . . . . 0.0 109.384 -178.174 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.401 HD13 ' CG2' ' A' ' 38' ' ' VAL . 5.6 mp -137.83 159.72 41.22 Favored 'General case' 0 C--N 1.302 -1.491 0 CA-C-O 121.216 0.531 . . . . 0.0 110.851 174.605 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.539 ' HG3' ' CD2' ' A' ' 35' ' ' HIS . 3.1 tmmt? -131.63 143.87 50.63 Favored 'General case' 0 N--CA 1.433 -1.299 0 CA-C-O 121.259 0.552 . . . . 0.0 110.638 -179.592 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.536 HG11 ' CD1' ' A' ' 51' ' ' TYR . 0.9 OUTLIER -112.06 141.06 28.72 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.429 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.182 178.672 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.426 HD11 ' NZ ' ' A' ' 25' ' ' LYS . 41.6 mm -106.46 115.84 48.92 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.133 0 N-CA-C 107.641 -1.244 . . . . 0.0 107.641 175.214 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' GLY . . . . . 0.441 ' HA2' ' HB ' ' A' ' 90' ' ' VAL . . . -86.14 169.47 41.99 Favored Glycine 0 N--CA 1.416 -2.651 0 C-N-CA 120.302 -0.951 . . . . 0.0 111.689 -177.008 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.25 -22.15 66.84 Favored 'General case' 0 C--N 1.299 -1.604 0 CA-C-O 121.634 0.73 . . . . 0.0 110.579 178.671 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -102.25 14.63 31.45 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.506 -0.77 . . . . 0.0 109.44 -179.338 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 46.2 m 69.99 19.71 6.8 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 115.574 -0.739 . . . . 0.0 111.005 179.812 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 11.1 t -76.71 114.55 15.58 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.172 178.86 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.45 ' HA ' ' O ' ' A' ' 26' ' ' VAL . 24.1 mt-10 -90.01 113.44 25.12 Favored 'General case' 0 CA--C 1.502 -0.896 0 CA-C-O 121.159 0.504 . . . . 0.0 110.696 177.614 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 30.1 mm -102.59 130.07 53.14 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.909 0 N-CA-C 108.152 -1.055 . . . . 0.0 108.152 176.378 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' HIS . . . . . 0.539 ' CD2' ' HG3' ' A' ' 25' ' ' LYS . 11.0 m170 -117.55 116.25 26.73 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 -177.148 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.518 ' HZ ' HG23 ' A' ' 26' ' ' VAL . 0.9 OUTLIER -129.28 170.08 14.06 Favored 'General case' 0 C--N 1.304 -1.397 0 CA-C-O 121.18 0.514 . . . . 0.0 111.452 -175.254 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.423 ' HB3' ' CD1' ' A' ' 21' ' ' TYR . 61.1 mmtt -121.44 121.64 38.0 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 -178.798 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.435 HG21 HD12 ' A' ' 47' ' ' LEU . 33.0 m -139.84 156.13 25.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-O 120.93 0.395 . . . . 0.0 110.439 179.545 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.527 ' O ' HG22 ' A' ' 42' ' ' THR . 79.2 tttt -86.55 163.13 17.65 Favored 'General case' 0 C--N 1.314 -0.94 0 O-C-N 121.964 -0.46 . . . . 0.0 110.794 -178.732 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 40' ' ' MET . . . . . 0.483 ' O ' ' HG2' ' A' ' 78' ' ' LYS . 0.0 OUTLIER -71.89 -37.93 70.07 Favored 'General case' 0 CA--C 1.519 -0.238 0 N-CA-C 112.234 0.457 . . . . 0.0 112.234 -177.026 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 14.9 t -92.71 15.11 15.23 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-O 121.343 0.592 . . . . 0.0 111.608 -177.027 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' THR . . . . . 0.527 HG22 ' O ' ' A' ' 39' ' ' LYS . 2.3 t -96.48 169.74 9.7 Favored 'General case' 0 C--N 1.32 -0.684 0 O-C-N 121.485 -0.76 . . . . 0.0 110.224 -179.267 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 29.8 m170 -85.81 142.24 29.07 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-O 121.4 0.619 . . . . 0.0 111.163 179.535 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.611 ' HB2' ' O ' ' A' ' 75' ' ' HIS . 0.2 OUTLIER -69.21 -17.16 63.75 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.559 -0.746 . . . . 0.0 109.686 -179.115 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.659 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -53.88 -45.65 71.13 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-N 115.728 -0.669 . . . . 0.0 112.602 -177.9 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.536 ' O ' ' HB2' ' A' ' 50' ' ' SER . 0.1 OUTLIER -69.89 -25.02 63.49 Favored 'General case' 0 C--O 1.219 -0.536 0 CA-C-O 121.297 0.57 . . . . 0.0 110.795 -178.266 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.558 ' HB3' HD13 ' A' ' 44' ' ' LEU . 7.8 tt -73.4 -47.29 43.14 Favored 'General case' 0 C--N 1.312 -1.062 0 CA-C-N 115.927 -0.579 . . . . 0.0 109.776 177.282 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.598 ' HG3' ' O ' ' A' ' 44' ' ' LEU . 26.7 mtpt -57.81 -47.59 82.16 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.605 -179.277 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.659 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 5.0 pt-20 -69.97 -34.52 73.5 Favored 'General case' 0 C--N 1.313 -0.981 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.446 -179.058 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.536 ' HB2' ' O ' ' A' ' 46' ' ' LYS . 7.9 t -65.63 -43.88 88.17 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.351 -177.682 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.536 ' CD1' HG11 ' A' ' 26' ' ' VAL . 1.7 p90 -76.51 -33.7 58.62 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 119.727 -0.789 . . . . 0.0 110.531 -178.593 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 52' ' ' CYS . . . . . 0.507 ' SG ' HD11 ' A' ' 62' ' ' LEU . 98.6 m -62.54 -44.54 96.1 Favored 'General case' 0 C--O 1.239 0.545 0 CA-C-O 121.252 0.549 . . . . 0.0 110.657 179.327 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 14.0 pt20 -69.28 -33.78 73.73 Favored 'General case' 0 N--CA 1.442 -0.832 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.508 -179.228 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 2.1 mmp_? -57.47 -40.05 77.72 Favored 'General case' 0 C--N 1.349 0.569 0 CA-C-O 121.179 0.514 . . . . 0.0 111.377 177.625 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 33.2 mt-30 -78.1 -20.96 51.17 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.236 0.541 . . . . 0.0 110.964 -179.819 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 82.86 29.1 35.83 Favored Glycine 0 N--CA 1.445 -0.72 0 C-N-CA 120.896 -0.668 . . . . 0.0 112.138 -179.542 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 34.6 m -128.39 150.85 75.44 Favored Pre-proline 0 C--N 1.325 -0.467 0 N-CA-C 110.211 -0.292 . . . . 0.0 110.211 -179.826 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' PRO . . . . . 0.582 ' HG2' ' OG ' ' A' ' 61' ' ' SER . 31.1 Cg_endo -70.61 152.84 65.18 Favored 'Trans proline' 0 N--CA 1.455 -0.755 0 C-N-CA 122.212 1.941 . . . . 0.0 112.212 179.349 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.41 ' HG2' ' SG ' ' A' ' 52' ' ' CYS . 81.2 mtp -68.65 -10.19 54.59 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 121.092 0.472 . . . . 0.0 111.729 -176.532 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 60' ' ' ASN . . . . . 0.512 ' OD1' ' HB2' ' A' ' 58' ' ' PRO . 2.1 p-10 -91.16 -11.99 36.78 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-O 121.137 0.494 . . . . 0.0 111.114 -179.991 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.582 ' OG ' ' HG2' ' A' ' 58' ' ' PRO . 74.9 m -83.21 -23.6 32.76 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-O 121.088 0.47 . . . . 0.0 111.87 -178.481 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.507 HD11 ' SG ' ' A' ' 52' ' ' CYS . 1.1 pp -124.65 171.79 9.77 Favored 'General case' 0 C--N 1.305 -1.369 0 N-CA-C 113.117 0.784 . . . . 0.0 113.117 -175.796 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.457 ' O ' ' HA ' ' A' ' 90' ' ' VAL . 51.3 mtm180 -121.11 113.88 20.65 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.584 -0.735 . . . . 0.0 110.851 -177.375 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -98.21 116.41 30.36 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-O 121.194 0.521 . . . . 0.0 111.513 179.943 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.495 HD11 ' HG2' ' A' ' 89' ' ' GLU . 0.0 OUTLIER -147.06 166.51 26.65 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 121.186 0.517 . . . . 0.0 110.597 178.956 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 83.0 t80 -147.38 136.13 22.02 Favored 'General case' 0 C--N 1.31 -1.141 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 177.672 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.454 ' HG2' HE21 ' A' ' 69' ' ' GLN . 7.0 pt-20 51.58 26.8 3.51 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 124.31 1.044 . . . . 0.0 112.028 -179.869 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 84.37 22.57 53.88 Favored Glycine 0 N--CA 1.448 -0.535 0 C-N-CA 120.808 -0.71 . . . . 0.0 112.611 -179.145 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' GLN . . . . . 0.454 HE21 ' HG2' ' A' ' 67' ' ' GLU . 2.5 pt20 -128.82 134.27 48.29 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 179.57 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 15.4 ptt180 -68.2 146.98 52.88 Favored 'General case' 0 C--N 1.306 -1.309 0 CA-C-O 121.368 0.604 . . . . 0.0 111.038 178.443 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.459 HG21 HD12 ' A' ' 44' ' ' LEU . 21.8 mm -94.65 117.54 38.63 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.13 0 CA-C-O 121.147 0.498 . . . . 0.0 110.041 179.11 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -95.78 160.99 14.21 Favored 'General case' 0 N--CA 1.435 -1.195 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 179.71 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' ASP . . . . . 0.432 ' CA ' ' HB3' ' A' ' 45' ' ' LYS . 55.1 m-20 -65.33 -22.99 66.89 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-O 121.665 0.745 . . . . 0.0 110.646 -179.511 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 12.4 m-80 -97.07 4.55 51.31 Favored 'General case' 0 C--N 1.311 -1.08 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.132 -178.08 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' HIS . . . . . 0.611 ' O ' ' HB2' ' A' ' 44' ' ' LEU . 4.8 m170 -83.68 146.7 28.09 Favored 'General case' 0 CA--C 1.508 -0.65 0 N-CA-C 109.43 -0.581 . . . . 0.0 109.43 178.874 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.417 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 59.7 p -120.24 155.11 56.26 Favored Pre-proline 0 C--N 1.311 -1.069 0 C-N-CA 120.867 -0.333 . . . . 0.0 111.012 178.3 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -59.22 -40.21 71.24 Favored 'Trans proline' 0 N--CA 1.461 -0.438 0 C-N-CA 122.607 2.205 . . . . 0.0 111.693 179.557 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' LYS . . . . . 0.483 ' HG2' ' O ' ' A' ' 40' ' ' MET . 0.0 OUTLIER -69.47 -36.2 76.34 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.852 0.358 . . . . 0.0 111.617 -178.042 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -74.93 -35.28 62.18 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.882 0.372 . . . . 0.0 111.246 -179.055 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.434 HD21 ' CG ' ' A' ' 75' ' ' HIS . 5.5 mt -80.55 -0.76 39.09 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.245 0.545 . . . . 0.0 110.819 179.728 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 76.36 45.76 13.85 Favored Glycine 0 CA--C 1.509 -0.317 0 CA-C-N 116.062 -0.517 . . . . 0.0 112.794 177.6 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 59.6 mtt -106.37 164.65 11.86 Favored 'General case' 0 C--N 1.311 -1.082 0 O-C-N 122.522 -0.399 . . . . 0.0 110.255 179.422 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' GLU . . . . . 0.451 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 10.0 pt-20 -141.16 -166.24 2.13 Favored 'General case' 0 C--N 1.316 -0.885 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 177.584 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.422 ' O ' ' HB2' ' A' ' 85' ' ' GLU . 6.9 pt-20 -72.93 141.52 47.83 Favored 'General case' 0 N--CA 1.444 -0.774 0 C-N-CA 120.363 -0.535 . . . . 0.0 109.801 177.747 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 85' ' ' GLU . . . . . 0.422 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 66.5 mm-40 72.87 4.92 5.1 Favored 'General case' 0 C--N 1.32 -0.682 0 C-N-CA 123.722 0.809 . . . . 0.0 111.848 -179.109 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 86' ' ' ASP . . . . . 0.451 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 2.3 t70 -60.8 155.41 19.49 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 121.139 0.495 . . . . 0.0 110.179 176.862 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.471 ' HA ' ' O ' ' A' ' 25' ' ' LYS . 8.8 p -125.94 141.78 44.61 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.497 0 CA-C-O 121.406 0.622 . . . . 0.0 111.265 -177.011 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 3.7 mp -110.24 152.52 12.23 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.884 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 179.029 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.495 ' HG2' HD11 ' A' ' 65' ' ' LEU . 3.0 tt0 -103.32 130.9 50.71 Favored 'General case' 0 C--N 1.309 -1.153 0 CA-C-O 121.296 0.57 . . . . 0.0 111.127 -175.507 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 90' ' ' VAL . . . . . 0.457 ' HA ' ' O ' ' A' ' 63' ' ' ARG . 60.6 t -126.73 132.94 69.6 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.948 0 CA-C-O 121.588 0.708 . . . . 0.0 111.242 179.959 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 91' ' ' TYR . . . . . 0.417 ' HB2' ' HB2' ' A' ' 63' ' ' ARG . 76.3 m-85 -116.78 -178.22 3.38 Favored 'General case' 0 C--N 1.309 -1.182 0 CA-C-N 115.639 -0.71 . . . . 0.0 109.724 177.639 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 92' ' ' GLN . . . . . 0.429 ' HG3' ' H ' ' A' ' 94' ' ' GLN . 9.3 tp60 -109.66 145.63 36.18 Favored 'General case' 0 C--N 1.313 -0.982 0 N-CA-C 109.779 -0.452 . . . . 0.0 109.779 179.676 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -137.95 20.35 2.83 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.346 0.593 . . . . 0.0 110.296 175.57 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 94' ' ' GLN . . . . . 0.429 ' H ' ' HG3' ' A' ' 92' ' ' GLN . 25.2 mt-30 -61.91 -164.74 0.01 OUTLIER 'General case' 0 CA--C 1.542 0.645 0 CA-C-N 115.539 -0.755 . . . . 0.0 112.56 178.449 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 9.8 t -177.06 176.82 1.34 Allowed 'General case' 0 N--CA 1.445 -0.723 0 N-CA-C 109.836 -0.431 . . . . 0.0 109.836 -175.38 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -124.66 7.23 8.39 Favored Glycine 0 N--CA 1.44 -1.087 0 N-CA-C 110.021 -1.232 . . . . 0.0 110.021 178.288 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.432 -1.587 0 CA-C-O 118.141 -1.366 . . . . 0.0 110.888 -179.174 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 19.5 mmt . . . . . 0 N--CA 1.476 0.863 0 CA-C-O 121.243 0.544 . . . . 0.0 111.069 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 39.9 m -115.95 2.36 13.49 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.763 179.362 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 65.75 37.83 5.52 Favored 'General case' 0 N--CA 1.479 0.985 0 CA-C-O 121.406 0.622 . . . . 0.0 109.784 -179.166 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 42.0 mt-30 -58.43 -64.62 0.86 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.539 -177.619 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -162.44 158.08 23.33 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-O 120.804 0.335 . . . . 0.0 110.366 -178.664 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -134.74 130.81 36.77 Favored 'General case' 0 C--N 1.314 -0.958 0 CA-C-O 121.133 0.492 . . . . 0.0 110.053 175.655 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 51.5 mttp -120.27 152.27 54.55 Favored Pre-proline 0 N--CA 1.428 -1.55 0 CA-C-N 116.105 -0.498 . . . . 0.0 109.699 -179.423 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.488 ' HB3' ' HB2' ' A' ' 53' ' ' GLN . 17.4 Cg_exo -63.87 108.9 0.98 Allowed 'Trans proline' 0 N--CA 1.449 -1.125 0 C-N-CA 121.935 1.757 . . . . 0.0 109.523 175.32 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 15.8 m -78.3 133.58 37.62 Favored 'General case' 0 C--N 1.306 -1.3 0 CA-C-O 121.442 0.639 . . . . 0.0 111.826 -174.859 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 20.3 m -122.81 115.8 22.62 Favored 'General case' 0 N--CA 1.441 -0.916 0 N-CA-C 109.098 -0.704 . . . . 0.0 109.098 177.925 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -71.48 129.91 39.97 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-O 120.722 0.296 . . . . 0.0 110.552 -179.16 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -58.43 -52.75 64.33 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.622 179.368 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 84.4 mt -55.2 -61.82 2.07 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 121.151 0.5 . . . . 0.0 110.462 176.984 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 90.52 32.64 9.2 Favored Glycine 0 N--CA 1.442 -0.962 0 N-CA-C 111.125 -0.79 . . . . 0.0 111.125 179.52 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -123.98 101.58 7.31 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-O 121.374 0.607 . . . . 0.0 110.084 -178.333 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.422 ' HD3' ' N ' ' A' ' 16' ' ' LYS . 0.1 OUTLIER -107.42 150.0 27.26 Favored 'General case' 0 C--N 1.303 -1.417 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.109 179.692 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 21.1 ptmt -73.06 148.1 44.4 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-O 120.798 0.332 . . . . 0.0 110.195 179.843 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -162.5 -173.06 3.39 Favored 'General case' 0 N--CA 1.44 -0.941 0 CA-C-O 120.914 0.387 . . . . 0.0 110.656 -177.89 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 97.87 124.97 5.07 Favored Glycine 0 CA--C 1.503 -0.688 0 N-CA-C 111.495 -0.642 . . . . 0.0 111.495 -178.948 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 18.1 mm-40 64.21 63.2 0.8 Allowed 'General case' 0 CA--C 1.519 -0.245 0 CA-C-O 121.936 0.874 . . . . 0.0 110.019 -179.485 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.499 ' CZ ' ' HD3' ' A' ' 37' ' ' LYS . 6.3 p90 -132.74 176.25 8.62 Favored 'General case' 0 C--N 1.308 -1.212 0 CA-C-N 115.441 -0.799 . . . . 0.0 111.274 -179.332 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 24.0 pt -115.01 171.95 4.24 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.978 0 CA-C-O 121.372 0.605 . . . . 0.0 109.714 176.925 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 11.6 mtmt -114.61 144.46 43.36 Favored 'General case' 0 C--N 1.294 -1.805 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 -178.74 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.9 mp -139.05 161.3 37.72 Favored 'General case' 0 C--N 1.301 -1.52 0 CA-C-O 121.339 0.59 . . . . 0.0 110.945 175.051 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.437 ' O ' ' HA ' ' A' ' 87' ' ' VAL . 5.6 tmmm? -130.22 142.37 50.57 Favored 'General case' 0 N--CA 1.438 -1.043 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.377 -179.43 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.533 HG23 ' HZ ' ' A' ' 36' ' ' PHE . 0.9 OUTLIER -113.14 142.35 25.85 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.411 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.392 179.844 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 45.0 mm -103.82 113.36 40.49 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.251 0 N-CA-C 107.381 -1.34 . . . . 0.0 107.381 175.147 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -74.64 -177.56 38.74 Favored Glycine 0 N--CA 1.432 -1.598 0 C-N-CA 120.755 -0.736 . . . . 0.0 113.105 -175.649 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.65 ' H ' ' CD ' ' A' ' 29' ' ' GLN . 0.0 OUTLIER -70.0 -26.21 63.97 Favored 'General case' 0 C--N 1.305 -1.367 0 N-CA-C 108.532 -0.914 . . . . 0.0 108.532 -178.672 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 37.0 t70 -102.83 12.51 36.1 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 114.868 -1.06 . . . . 0.0 108.47 177.09 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 49.9 m 71.15 20.66 5.07 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 114.974 -1.012 . . . . 0.0 110.905 -179.141 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 8.2 t -67.7 120.56 14.27 Favored 'General case' 0 N--CA 1.447 -0.597 0 N-CA-C 108.779 -0.823 . . . . 0.0 108.779 177.711 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.524 ' HA ' ' O ' ' A' ' 26' ' ' VAL . 46.5 mt-10 -89.15 108.97 19.9 Favored 'General case' 0 C--N 1.313 -0.986 0 CA-C-O 121.338 0.59 . . . . 0.0 111.217 -178.138 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 38.9 mm -98.54 136.85 27.89 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.562 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 177.68 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 11.7 m170 -117.34 133.31 56.12 Favored 'General case' 0 C--N 1.316 -0.854 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 -178.388 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.533 ' HZ ' HG23 ' A' ' 26' ' ' VAL . 1.7 p90 -147.2 170.35 17.42 Favored 'General case' 0 C--N 1.309 -1.178 0 CA-C-O 121.376 0.608 . . . . 0.0 111.607 -178.35 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.499 ' HD3' ' CZ ' ' A' ' 21' ' ' TYR . 15.1 ptpt -130.7 119.91 23.08 Favored 'General case' 0 C--N 1.314 -0.975 0 CA-C-N 115.584 -0.734 . . . . 0.0 111.027 -178.543 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.426 HG21 HD12 ' A' ' 47' ' ' LEU . 24.4 m -139.84 159.57 27.0 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 116.23 -0.441 . . . . 0.0 109.968 -179.26 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 25.9 mtpp -77.11 176.17 8.96 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-O 121.342 0.592 . . . . 0.0 111.18 179.347 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.5 -35.79 19.39 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.874 178.323 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 13.8 t -93.8 10.52 32.78 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 121.292 0.567 . . . . 0.0 111.607 -176.181 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 7.2 t -94.74 173.65 7.5 Favored 'General case' 0 C--N 1.32 -0.698 0 O-C-N 121.779 -0.575 . . . . 0.0 110.201 -179.617 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 4.8 m-70 -90.4 147.72 23.26 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 121.637 0.732 . . . . 0.0 111.611 -179.101 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.492 ' O ' ' HG2' ' A' ' 48' ' ' LYS . 1.3 mm? -70.23 -13.22 62.08 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.426 -0.806 . . . . 0.0 110.707 178.754 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.542 ' HB3' ' HB2' ' A' ' 73' ' ' ASP . 0.0 OUTLIER -54.26 -43.23 70.77 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.986 -178.899 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -71.19 -33.35 69.88 Favored 'General case' 0 C--O 1.2 -1.536 0 CA-C-O 121.069 0.461 . . . . 0.0 110.443 178.918 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.426 HD12 HG21 ' A' ' 38' ' ' VAL . 9.4 tt -69.14 -50.96 43.16 Favored 'General case' 0 C--N 1.309 -1.187 0 CA-C-O 121.105 0.479 . . . . 0.0 110.793 -178.855 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.492 ' HG2' ' O ' ' A' ' 44' ' ' LEU . 4.5 ptmm? -62.17 -40.62 96.61 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.542 -178.966 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.7 -32.86 68.26 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.11 0.481 . . . . 0.0 110.468 177.986 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.651 ' O ' ' HG2' ' A' ' 54' ' ' ARG . 5.3 m -68.81 -40.98 79.24 Favored 'General case' 0 N--CA 1.45 -0.445 0 N-CA-C 112.52 0.563 . . . . 0.0 112.52 -177.822 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.475 ' CD1' HG11 ' A' ' 26' ' ' VAL . 2.0 p90 -76.45 -33.06 58.76 Favored 'General case' 0 C--N 1.317 -0.809 0 C-N-CA 119.005 -1.078 . . . . 0.0 110.203 179.352 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 52' ' ' CYS . . . . . 0.615 ' SG ' HD11 ' A' ' 62' ' ' LEU . 92.0 m -61.37 -45.65 93.47 Favored 'General case' 0 CA--C 1.511 -0.521 0 CA-C-O 121.221 0.534 . . . . 0.0 110.19 178.597 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 53' ' ' GLN . . . . . 0.488 ' HB2' ' HB3' ' A' ' 8' ' ' PRO . 13.8 pt20 -65.44 -35.67 81.61 Favored 'General case' 0 N--CA 1.442 -0.845 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.536 -179.663 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.651 ' HG2' ' O ' ' A' ' 50' ' ' SER . 41.9 mmt-85 -57.36 -39.1 75.26 Favored 'General case' 0 C--N 1.348 0.524 0 CA-C-O 121.123 0.487 . . . . 0.0 111.388 177.327 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 30.5 mt-30 -78.53 -21.78 48.3 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-O 120.958 0.408 . . . . 0.0 110.783 179.859 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 82.9 29.74 33.85 Favored Glycine 0 N--CA 1.442 -0.931 0 C-N-CA 120.434 -0.888 . . . . 0.0 111.727 179.348 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 35.9 m -130.43 148.26 69.2 Favored Pre-proline 0 C--N 1.323 -0.584 0 O-C-N 122.454 -0.439 . . . . 0.0 110.645 -178.969 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 29.1 Cg_endo -65.78 150.73 85.79 Favored 'Trans proline' 0 N--CA 1.458 -0.602 0 C-N-CA 122.27 1.98 . . . . 0.0 111.72 177.971 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 73.6 mtp -67.49 -7.79 28.51 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-N 116.113 -0.494 . . . . 0.0 112.236 -176.661 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 24.2 p30 -90.41 -12.19 38.22 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 121.387 0.613 . . . . 0.0 111.162 -179.194 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 68.1 m -84.94 -20.32 30.82 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.775 -179.906 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.615 HD11 ' SG ' ' A' ' 52' ' ' CYS . 1.4 pp -136.66 157.44 46.75 Favored 'General case' 0 C--N 1.31 -1.115 0 CA-C-O 121.71 0.767 . . . . 0.0 113.027 -176.545 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.439 ' HG3' ' HB2' ' A' ' 91' ' ' TYR . 1.2 ptp180 -115.68 138.1 51.43 Favored 'General case' 0 C--N 1.314 -0.953 0 CA-C-N 115.049 -0.978 . . . . 0.0 112.376 179.224 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.444 ' CZ ' ' HE2' ' A' ' 48' ' ' LYS . 0.1 OUTLIER -114.14 120.84 41.88 Favored 'General case' 0 C--N 1.313 -0.979 0 CA-C-N 114.983 -1.008 . . . . 0.0 110.541 -176.968 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.453 ' C ' HD22 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -142.94 164.76 29.21 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.33 0.586 . . . . 0.0 111.043 179.298 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 92.3 t80 -147.05 135.33 21.69 Favored 'General case' 0 C--N 1.314 -0.952 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 178.918 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.447 ' HG2' HE21 ' A' ' 69' ' ' GLN . 6.6 pt-20 49.33 26.3 1.54 Allowed 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 124.406 1.082 . . . . 0.0 112.549 -179.17 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 87.57 21.76 46.42 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.913 -0.661 . . . . 0.0 112.934 -179.082 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' GLN . . . . . 0.447 HE21 ' HG2' ' A' ' 67' ' ' GLU . 2.7 pt20 -129.93 136.78 49.87 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 109.365 -0.606 . . . . 0.0 109.365 -179.808 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 3.1 ptt180 -68.67 147.5 51.78 Favored 'General case' 0 C--N 1.308 -1.231 0 CA-C-O 121.585 0.707 . . . . 0.0 111.02 177.671 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 21.8 mm -97.52 118.55 44.19 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.227 0 N-CA-C 109.708 -0.478 . . . . 0.0 109.708 179.014 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -103.28 167.05 10.06 Favored 'General case' 0 N--CA 1.442 -0.864 0 CA-C-O 120.881 0.372 . . . . 0.0 110.211 -178.854 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' ASP . . . . . 0.542 ' HB2' ' HB3' ' A' ' 45' ' ' LYS . 8.6 p-10 -66.6 -22.06 66.13 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.779 -178.236 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 9.2 m-80 -98.93 1.78 45.91 Favored 'General case' 0 CA--C 1.51 -0.568 0 CA-C-O 121.238 0.542 . . . . 0.0 110.205 -178.553 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' HIS . . . . . 0.45 ' CG ' HD21 ' A' ' 80' ' ' LEU . 3.2 m170 -81.06 141.72 34.06 Favored 'General case' 0 C--N 1.318 -0.799 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 179.714 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.426 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 70.2 p -116.64 153.58 49.1 Favored Pre-proline 0 C--N 1.307 -1.245 0 C-N-CA 121.072 -0.251 . . . . 0.0 110.675 179.242 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_exo -61.36 -37.75 69.95 Favored 'Trans proline' 0 N--CA 1.459 -0.549 0 C-N-CA 122.463 2.109 . . . . 0.0 111.557 179.796 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' LYS . . . . . 0.515 ' HG3' ' N ' ' A' ' 79' ' ' GLU . 33.1 pttt -68.83 -38.65 79.97 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.92 -178.713 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.515 ' N ' ' HG3' ' A' ' 78' ' ' LYS . 11.8 mm-40 -72.74 -38.29 67.44 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-O 120.953 0.406 . . . . 0.0 111.098 -178.808 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.45 HD21 ' CG ' ' A' ' 75' ' ' HIS . 5.2 mt -76.46 -6.79 53.29 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-O 121.485 0.66 . . . . 0.0 110.468 179.39 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 79.44 43.08 10.74 Favored Glycine 0 N--CA 1.452 -0.258 0 CA-C-N 115.905 -0.588 . . . . 0.0 112.954 177.201 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 60.6 mtt -102.82 165.6 10.96 Favored 'General case' 0 C--N 1.314 -0.937 0 N-CA-C 109.835 -0.431 . . . . 0.0 109.835 179.126 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -142.66 -171.45 3.43 Favored 'General case' 0 C--N 1.314 -0.952 0 N-CA-C 109.37 -0.604 . . . . 0.0 109.37 177.663 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -71.24 139.01 49.91 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-O 121.435 0.636 . . . . 0.0 111.145 -178.845 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 17.7 tp10 74.51 5.72 4.53 Favored 'General case' 0 C--N 1.321 -0.659 0 C-N-CA 125.012 1.325 . . . . 0.0 111.761 179.229 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -66.22 165.91 12.95 Favored 'General case' 0 C--O 1.238 0.475 0 CA-C-O 121.05 0.452 . . . . 0.0 110.763 176.941 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.437 ' HA ' ' O ' ' A' ' 25' ' ' LYS . 14.9 p -127.55 145.18 35.37 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.876 0 CA-C-O 121.443 0.64 . . . . 0.0 112.054 -175.299 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 3.6 mp -115.56 152.86 17.17 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 177.527 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 -107.19 138.19 43.84 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.038 0.447 . . . . 0.0 110.601 -175.981 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 84.9 t -129.74 137.38 56.85 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.75 0 CA-C-O 121.299 0.571 . . . . 0.0 111.351 -179.3 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 91' ' ' TYR . . . . . 0.439 ' HB2' ' HG3' ' A' ' 63' ' ' ARG . 96.5 m-85 -123.77 167.09 14.49 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.09 178.802 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 7.0 tp60 -95.39 139.01 32.29 Favored 'General case' 0 C--N 1.31 -1.113 0 N-CA-C 109.841 -0.429 . . . . 0.0 109.841 -179.654 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -127.19 18.98 7.02 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.366 0.603 . . . . 0.0 110.281 176.911 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 25.0 mt-30 -63.63 -161.75 0.01 OUTLIER 'General case' 0 CA--C 1.541 0.599 0 CA-C-N 115.472 -0.785 . . . . 0.0 111.203 176.803 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 9.3 t -120.11 -25.44 5.75 Favored 'General case' 0 C--N 1.316 -0.873 0 O-C-N 121.595 -0.691 . . . . 0.0 110.911 -176.862 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 142.01 122.33 1.77 Allowed Glycine 0 N--CA 1.438 -1.187 0 N-CA-C 111.088 -0.805 . . . . 0.0 111.088 -179.826 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.342 0 CA-C-O 118.775 -1.014 . . . . 0.0 111.56 -178.68 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.4 mtt . . . . . 0 N--CA 1.475 0.825 0 CA-C-O 120.92 0.391 . . . . 0.0 110.972 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 73.0 m 67.99 13.54 9.16 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-O 121.882 0.849 . . . . 0.0 110.434 -178.989 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 11.5 p-10 -102.51 1.63 35.3 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-N 114.972 -1.013 . . . . 0.0 110.232 -177.64 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 6.4 pt20 -134.91 15.9 3.56 Favored 'General case' 0 C--N 1.313 -1.012 0 CA-C-O 121.792 0.806 . . . . 0.0 110.093 -174.177 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -137.26 151.88 49.19 Favored 'General case' 0 C--N 1.304 -1.391 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.345 -177.492 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -167.57 146.15 4.79 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 116.184 -0.462 . . . . 0.0 109.917 179.709 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 21.8 ptmt -141.21 145.94 40.76 Favored Pre-proline 0 C--N 1.316 -0.862 0 N-CA-C 110.286 -0.264 . . . . 0.0 110.286 178.76 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 69.8 Cg_endo -77.9 166.54 25.0 Favored 'Trans proline' 0 C--O 1.242 0.683 0 C-N-CA 122.314 2.01 . . . . 0.0 111.597 177.818 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 23.1 t -166.15 173.21 10.46 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 110.007 -0.368 . . . . 0.0 110.007 -178.503 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 23.8 m -145.4 -78.33 0.19 Allowed 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.112 0.482 . . . . 0.0 110.521 179.272 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -154.42 157.58 38.7 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.933 0.397 . . . . 0.0 110.098 -178.76 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -119.04 157.37 27.94 Favored 'General case' 0 C--N 1.315 -0.899 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 178.952 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 1.3 pp -161.06 160.39 30.43 Favored 'General case' 0 C--N 1.316 -0.887 0 O-C-N 121.866 -0.522 . . . . 0.0 110.597 -178.671 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -158.13 30.2 0.48 Allowed Glycine 0 CA--C 1.503 -0.697 0 C-N-CA 121.019 -0.61 . . . . 0.0 112.084 179.008 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -59.66 127.63 32.94 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-O 120.871 0.367 . . . . 0.0 110.4 178.697 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 30.5 mmmt -100.73 -165.05 1.17 Allowed 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.917 0.389 . . . . 0.0 110.499 -178.654 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.566 ' CD ' ' H ' ' A' ' 18' ' ' GLU . 3.7 tmtp? -65.67 172.12 3.69 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.425 0.631 . . . . 0.0 110.685 178.446 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.566 ' H ' ' CD ' ' A' ' 17' ' ' LYS . 1.2 pm0 -157.16 174.92 14.74 Favored 'General case' 0 N--CA 1.434 -1.264 0 CA-C-N 115.984 -0.553 . . . . 0.0 109.642 -177.019 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -120.07 21.66 8.78 Favored Glycine 0 N--CA 1.441 -1.032 0 N-CA-C 110.8 -0.92 . . . . 0.0 110.8 175.632 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 24.9 mm-40 61.11 43.6 11.03 Favored 'General case' 0 C--N 1.344 0.35 0 CA-C-O 121.818 0.818 . . . . 0.0 110.274 -178.955 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.424 ' CE1' ' HB2' ' A' ' 37' ' ' LYS . 55.4 p90 -115.24 -179.55 3.67 Favored 'General case' 0 C--N 1.309 -1.177 0 CA-C-N 115.027 -0.988 . . . . 0.0 109.987 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 26.3 pt -125.68 172.19 13.44 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.889 0 CA-C-O 121.463 0.649 . . . . 0.0 110.593 178.029 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 3.7 mtmt -120.1 141.95 49.34 Favored 'General case' 0 C--N 1.299 -1.599 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 -179.271 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.4 mp -136.02 162.51 32.68 Favored 'General case' 0 C--N 1.305 -1.361 0 CA-C-O 121.283 0.563 . . . . 0.0 111.02 177.218 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.418 ' O ' ' HA ' ' A' ' 87' ' ' VAL . 4.9 tmmm? -131.4 142.54 50.06 Favored 'General case' 0 N--CA 1.437 -1.092 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.386 -179.114 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.515 HG23 ' HZ ' ' A' ' 36' ' ' PHE . 0.9 OUTLIER -113.13 142.05 26.83 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.447 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.232 179.892 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.458 ' O ' ' HB ' ' A' ' 90' ' ' VAL . 43.7 mm -104.32 115.54 46.44 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.952 0 N-CA-C 107.373 -1.343 . . . . 0.0 107.373 175.373 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -78.85 179.09 52.97 Favored Glycine 0 N--CA 1.431 -1.669 0 C-N-CA 120.795 -0.717 . . . . 0.0 113.138 -175.683 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.608 ' H ' ' CD ' ' A' ' 29' ' ' GLN . 0.0 OUTLIER -74.7 -22.26 58.94 Favored 'General case' 0 N--CA 1.436 -1.167 0 CA-C-O 121.996 0.903 . . . . 0.0 108.73 -178.105 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -102.62 12.57 36.19 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.032 -0.985 . . . . 0.0 108.525 176.171 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 37.1 t 73.36 18.09 3.76 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 115.174 -0.921 . . . . 0.0 110.418 -179.541 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 7.9 t -70.44 116.57 10.92 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 179.058 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.493 ' HA ' ' O ' ' A' ' 26' ' ' VAL . 37.0 mt-10 -87.76 110.59 20.57 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-O 121.144 0.497 . . . . 0.0 110.484 179.979 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 32.1 mm -98.57 139.04 21.4 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.573 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 178.235 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 10.1 m170 -119.37 131.73 55.73 Favored 'General case' 0 C--N 1.315 -0.905 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 -178.962 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.515 ' HZ ' HG23 ' A' ' 26' ' ' VAL . 1.4 p90 -146.88 173.42 12.42 Favored 'General case' 0 C--N 1.309 -1.167 0 CA-C-O 121.15 0.5 . . . . 0.0 110.862 -178.463 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.424 ' HB2' ' CE1' ' A' ' 21' ' ' TYR . 17.6 ptpt -134.29 120.65 20.22 Favored 'General case' 0 C--N 1.314 -0.951 0 CA-C-O 121.191 0.519 . . . . 0.0 111.137 -179.144 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 26.3 m -137.97 162.47 31.26 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 N-CA-C 109.406 -0.59 . . . . 0.0 109.406 -179.743 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.512 ' O ' HG22 ' A' ' 42' ' ' THR . 40.6 tttp -86.79 163.26 17.36 Favored 'General case' 0 C--N 1.313 -0.988 0 O-C-N 121.519 -0.738 . . . . 0.0 110.947 -179.596 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' MET . . . . . 0.401 ' H ' ' HG2' ' A' ' 39' ' ' LYS . 0.0 OUTLIER -65.82 -41.72 91.49 Favored 'General case' 0 CA--C 1.517 -0.298 0 N-CA-C 112.79 0.663 . . . . 0.0 112.79 -177.808 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 11.9 t -96.11 13.14 28.22 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-O 121.068 0.461 . . . . 0.0 112.113 -174.988 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' THR . . . . . 0.512 HG22 ' O ' ' A' ' 39' ' ' LYS . 2.0 t -91.03 161.88 14.94 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 179.666 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' HIS . . . . . 0.428 ' O ' ' HG2' ' A' ' 46' ' ' LYS . 42.5 m170 -75.06 138.86 42.44 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-O 121.589 0.709 . . . . 0.0 111.572 -179.979 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.634 HD13 ' HB3' ' A' ' 47' ' ' LEU . 0.2 OUTLIER -67.94 -15.4 63.59 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.219 -0.901 . . . . 0.0 109.972 -179.02 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.679 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -53.35 -45.97 69.36 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.844 -0.616 . . . . 0.0 112.433 -177.952 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.428 ' HG2' ' O ' ' A' ' 43' ' ' HIS . 21.8 ptmt -65.82 -29.37 69.83 Favored 'General case' 0 C--O 1.218 -0.562 0 CA-C-O 121.345 0.593 . . . . 0.0 110.579 -178.528 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.634 ' HB3' HD13 ' A' ' 44' ' ' LEU . 7.7 tt -72.97 -46.47 52.16 Favored 'General case' 0 C--N 1.311 -1.076 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.925 -179.596 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.607 ' HG3' ' O ' ' A' ' 44' ' ' LEU . 26.8 mtpt -58.29 -48.79 79.37 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-O 121.512 0.672 . . . . 0.0 110.185 -179.142 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.679 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 7.0 pt-20 -71.16 -31.32 67.53 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.976 -178.793 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.45 ' O ' ' HG2' ' A' ' 54' ' ' ARG . 38.0 t -65.44 -45.69 82.84 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.979 0.419 . . . . 0.0 111.283 -179.811 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.495 ' CD1' HG11 ' A' ' 26' ' ' VAL . 2.1 p90 -76.47 -32.64 58.49 Favored 'General case' 0 N--CA 1.443 -0.786 0 C-N-CA 119.86 -0.736 . . . . 0.0 110.539 -177.378 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 52' ' ' CYS . . . . . 0.488 ' SG ' ' HG2' ' A' ' 59' ' ' MET . 99.7 m -64.15 -44.15 92.99 Favored 'General case' 0 CA--C 1.509 -0.634 0 CA-C-O 121.105 0.479 . . . . 0.0 110.547 179.436 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 13.5 pt20 -67.73 -33.46 74.92 Favored 'General case' 0 N--CA 1.443 -0.779 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.274 -179.668 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.45 ' HG2' ' O ' ' A' ' 50' ' ' SER . 13.7 mmt180 -57.5 -38.16 74.17 Favored 'General case' 0 C--N 1.348 0.524 0 CA-C-O 121.018 0.437 . . . . 0.0 111.042 177.055 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 34.7 mt-30 -82.19 -22.47 35.96 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.968 -179.746 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 82.94 29.18 35.26 Favored Glycine 0 N--CA 1.443 -0.849 0 C-N-CA 120.548 -0.834 . . . . 0.0 111.886 -179.868 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 33.9 m -125.56 150.9 69.46 Favored Pre-proline 0 C--N 1.325 -0.467 0 O-C-N 122.45 -0.441 . . . . 0.0 110.649 -178.661 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' PRO . . . . . 0.502 ' HG2' ' OG ' ' A' ' 61' ' ' SER . 43.4 Cg_endo -71.01 149.9 59.74 Favored 'Trans proline' 0 N--CA 1.453 -0.871 0 C-N-CA 122.295 1.997 . . . . 0.0 111.856 177.277 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.488 ' HG2' ' SG ' ' A' ' 52' ' ' CYS . 80.6 mtp -70.1 -7.55 42.38 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.779 -177.279 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 31.3 p30 -89.12 -11.98 42.39 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.472 0.653 . . . . 0.0 110.968 179.272 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.502 ' OG ' ' HG2' ' A' ' 58' ' ' PRO . 70.3 m -90.81 -19.05 23.87 Favored 'General case' 0 N--CA 1.439 -0.986 0 N-CA-C 112.459 0.54 . . . . 0.0 112.459 -178.122 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.471 HD11 ' SG ' ' A' ' 52' ' ' CYS . 1.4 pp -128.09 167.89 16.13 Favored 'General case' 0 C--N 1.313 -1.0 0 N-CA-C 113.139 0.792 . . . . 0.0 113.139 -177.674 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.499 ' O ' ' HA ' ' A' ' 90' ' ' VAL . 35.6 mtm180 -118.66 118.29 31.26 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.261 -0.881 . . . . 0.0 110.669 -177.566 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -101.56 112.41 24.95 Favored 'General case' 0 C--N 1.312 -1.037 0 CA-C-O 121.134 0.492 . . . . 0.0 110.723 178.704 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.462 ' C ' HD22 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -141.52 164.62 29.73 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-O 121.528 0.68 . . . . 0.0 111.461 -179.377 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 88.3 t80 -144.77 133.81 22.68 Favored 'General case' 0 C--N 1.308 -1.198 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 177.733 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 49.36 29.59 2.85 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 124.264 1.025 . . . . 0.0 112.288 -178.884 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 87.26 16.28 60.94 Favored Glycine 0 N--CA 1.446 -0.681 0 C-N-CA 120.969 -0.634 . . . . 0.0 113.599 179.593 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 5.1 pt20 -125.86 135.73 52.28 Favored 'General case' 0 C--N 1.32 -0.698 0 O-C-N 122.254 -0.556 . . . . 0.0 109.623 -178.907 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.417 ' HD2' ' H ' ' A' ' 70' ' ' ARG . 0.2 OUTLIER -70.48 148.64 48.05 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-O 121.667 0.746 . . . . 0.0 110.379 177.792 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.486 HG21 HD12 ' A' ' 44' ' ' LEU . 23.4 mm -96.47 122.42 47.95 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.917 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.049 -179.278 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -95.31 166.07 12.07 Favored 'General case' 0 N--CA 1.436 -1.158 0 N-CA-C 109.697 -0.482 . . . . 0.0 109.697 -179.786 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' ASP . . . . . 0.422 ' CA ' ' HB3' ' A' ' 45' ' ' LYS . 11.8 p-10 -71.18 -21.04 62.21 Favored 'General case' 0 C--N 1.31 -1.121 0 CA-C-O 121.4 0.619 . . . . 0.0 110.773 -179.598 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 13.2 m-80 -98.73 4.0 47.71 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-O 121.175 0.512 . . . . 0.0 110.152 179.437 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' HIS . . . . . 0.601 ' O ' ' HB2' ' A' ' 44' ' ' LEU . 3.2 m170 -83.16 146.52 28.59 Favored 'General case' 0 CA--C 1.503 -0.862 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 -179.875 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.499 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 69.0 p -122.25 155.89 61.1 Favored Pre-proline 0 C--N 1.306 -1.308 0 C-N-CA 121.041 -0.264 . . . . 0.0 110.976 178.53 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -60.79 -41.67 44.26 Favored 'Trans proline' 0 N--CA 1.459 -0.533 0 C-N-CA 122.418 2.079 . . . . 0.0 111.01 179.619 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' LYS . . . . . 0.525 ' HG3' ' N ' ' A' ' 79' ' ' GLU . 44.6 pttt -65.28 -41.56 94.04 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.106 -178.618 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.525 ' N ' ' HG3' ' A' ' 78' ' ' LYS . 60.2 mm-40 -71.2 -36.14 71.81 Favored 'General case' 0 N--CA 1.445 -0.725 0 CA-C-O 120.999 0.428 . . . . 0.0 111.176 -177.661 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.499 ' HG ' ' O ' ' A' ' 76' ' ' THR . 5.9 mt -79.22 -6.05 55.71 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.202 0.525 . . . . 0.0 110.908 179.922 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 83.14 42.37 8.07 Favored Glycine 0 N--CA 1.454 -0.16 0 C-N-CA 121.032 -0.604 . . . . 0.0 113.027 177.855 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 61.1 mtt -103.59 165.89 10.76 Favored 'General case' 0 C--N 1.315 -0.914 0 O-C-N 122.314 -0.521 . . . . 0.0 109.885 178.775 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' GLU . . . . . 0.415 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 10.1 pt-20 -137.22 -172.12 3.12 Favored 'General case' 0 C--N 1.312 -1.046 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 178.455 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -76.93 141.88 40.3 Favored 'General case' 0 N--CA 1.444 -0.743 0 C-N-CA 119.52 -0.872 . . . . 0.0 110.56 179.6 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 77.8 3.22 2.96 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 124.779 1.232 . . . . 0.0 110.71 -178.93 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' ASP . . . . . 0.415 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 1.6 t0 -63.05 164.74 7.91 Favored 'General case' 0 C--O 1.239 0.551 0 CA-C-O 121.249 0.547 . . . . 0.0 111.035 177.874 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.418 ' HA ' ' O ' ' A' ' 25' ' ' LYS . 7.9 p -128.34 145.01 36.08 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.067 0 CA-C-O 121.288 0.566 . . . . 0.0 111.338 -176.996 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 3.7 mp -113.88 153.7 15.38 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.825 0 N-CA-C 109.095 -0.705 . . . . 0.0 109.095 177.86 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -104.0 135.95 44.55 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-O 120.918 0.39 . . . . 0.0 110.545 -175.643 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 90' ' ' VAL . . . . . 0.499 ' HA ' ' O ' ' A' ' 63' ' ' ARG . 57.9 t -129.84 134.0 63.8 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.854 0 CA-C-O 121.391 0.615 . . . . 0.0 110.904 178.356 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 83.3 m-85 -122.78 176.0 6.22 Favored 'General case' 0 C--N 1.313 -0.994 0 CA-C-N 115.962 -0.563 . . . . 0.0 109.492 178.819 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 6.7 tp60 -101.08 146.77 27.02 Favored 'General case' 0 C--N 1.305 -1.366 0 N-CA-C 109.705 -0.48 . . . . 0.0 109.705 178.87 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -134.25 20.57 3.71 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.452 0.644 . . . . 0.0 110.454 175.695 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 22.9 mt-30 -67.96 -154.85 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.247 175.928 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 7.4 t -152.0 129.22 11.2 Favored 'General case' 0 C--N 1.316 -0.855 0 O-C-N 121.52 -0.738 . . . . 0.0 111.073 -179.661 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -132.05 -86.41 0.34 Allowed Glycine 0 N--CA 1.436 -1.33 0 CA-C-N 115.762 -0.653 . . . . 0.0 111.485 178.521 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.441 -1.029 0 CA-C-O 118.884 -0.953 . . . . 0.0 111.651 -179.598 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.5 ppp? . . . . . 0 N--CA 1.479 0.996 0 N-CA-C 111.837 0.31 . . . . 0.0 111.837 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 12.3 p -39.27 -66.23 0.31 Allowed 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.902 0.881 . . . . 0.0 111.624 179.508 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -130.22 -4.06 4.41 Favored 'General case' 0 C--N 1.304 -1.405 0 CA-C-O 122.154 0.978 . . . . 0.0 109.117 176.716 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 33.0 mt-30 -100.2 25.93 7.03 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.157 -0.928 . . . . 0.0 111.187 -176.166 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 14.1 pt-20 -70.63 149.5 46.98 Favored 'General case' 0 C--N 1.312 -1.034 0 C-N-CA 120.614 -0.434 . . . . 0.0 109.841 178.963 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -84.48 132.22 34.57 Favored 'General case' 0 C--N 1.31 -1.118 0 CA-C-O 120.925 0.393 . . . . 0.0 110.461 -178.77 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -155.23 146.09 16.36 Favored Pre-proline 0 C--N 1.319 -0.721 0 CA-C-O 120.653 0.263 . . . . 0.0 111.155 -178.504 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.49 ' HA ' ' SD ' ' A' ' 59' ' ' MET . 72.6 Cg_endo -79.14 137.97 13.96 Favored 'Trans proline' 0 C--O 1.241 0.66 0 C-N-CA 122.651 2.234 . . . . 0.0 112.758 179.818 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 30.9 p -77.55 174.11 11.25 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.21 0.529 . . . . 0.0 111.08 176.495 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 14.6 t -120.79 20.41 11.67 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 122.29 1.043 . . . . 0.0 109.405 178.799 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -100.12 166.33 11.07 Favored 'General case' 0 C--N 1.311 -1.073 0 CA-C-N 115.242 -0.89 . . . . 0.0 111.928 -177.852 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.406 ' HA ' ' OE1' ' A' ' 53' ' ' GLN . 22.6 t70 -119.77 8.27 11.14 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-O 121.974 0.892 . . . . 0.0 109.445 177.491 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -145.77 60.35 1.26 Allowed 'General case' 0 CA--C 1.484 -1.593 0 CA-C-O 122.953 1.358 . . . . 0.0 111.151 -177.834 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -77.44 31.52 1.63 Allowed Glycine 1 C--N 1.244 -4.546 0 CA-C-N 113.401 -1.727 . . . . 0.0 113.079 179.797 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -113.9 128.6 56.47 Favored 'General case' 0 C--N 1.319 -0.748 0 O-C-N 122.236 -0.567 . . . . 0.0 111.059 178.952 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 26.4 mmmt -107.66 172.72 6.67 Favored 'General case' 0 C--N 1.315 -0.91 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 -179.988 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.539 ' HD2' ' N ' ' A' ' 18' ' ' GLU . 3.9 tmmm? -61.64 150.15 37.25 Favored 'General case' 0 C--O 1.238 0.498 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 176.882 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.539 ' N ' ' HD2' ' A' ' 17' ' ' LYS . 35.3 mt-10 -136.78 -119.56 0.15 Allowed 'General case' 0 C--N 1.317 -0.812 0 CA-C-O 120.932 0.396 . . . . 0.0 111.738 -176.008 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.411 ' H ' ' HD1' ' A' ' 21' ' ' TYR . . . 100.23 117.73 4.11 Favored Glycine 0 N--CA 1.447 -0.589 0 N-CA-C 109.673 -1.371 . . . . 0.0 109.673 -176.186 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 22.0 mm-40 76.05 54.8 0.05 Allowed 'General case' 0 C--N 1.346 0.452 0 N-CA-C 108.083 -1.08 . . . . 0.0 108.083 -175.802 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.446 ' HB3' ' HG2' ' A' ' 39' ' ' LYS . 37.7 p90 -119.85 176.88 5.19 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.009 -0.996 . . . . 0.0 112.507 -175.187 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.554 ' HB ' ' HA ' ' A' ' 84' ' ' GLU . 19.9 pt -120.01 172.06 7.59 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.024 0 CA-C-N 114.851 -1.068 . . . . 0.0 110.566 178.833 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.476 ' HD3' ' N ' ' A' ' 23' ' ' LYS . 0.0 OUTLIER -121.51 143.44 49.27 Favored 'General case' 0 C--N 1.308 -1.201 0 N-CA-C 108.706 -0.85 . . . . 0.0 108.706 -179.489 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.4 mp -138.0 166.62 23.64 Favored 'General case' 0 C--N 1.306 -1.294 0 CA-C-O 121.256 0.551 . . . . 0.0 111.195 177.606 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 4.8 tmmm? -134.0 144.08 48.52 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.518 -179.917 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.609 ' O ' ' HA ' ' A' ' 33' ' ' GLU . 0.9 OUTLIER -115.41 141.54 32.01 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.159 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.707 -179.932 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.47 HD13 ' HG2' ' A' ' 33' ' ' GLU . 35.4 mm -111.26 99.57 8.97 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.728 0 N-CA-C 108.234 -1.024 . . . . 0.0 108.234 175.827 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' GLY . . . . . 0.671 ' HA3' ' OG ' ' A' ' 32' ' ' SER . . . -71.63 172.46 45.63 Favored Glycine 0 N--CA 1.426 -2.014 0 C-N-CA 119.626 -1.274 . . . . 0.0 114.007 179.722 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.416 ' HG3' ' H ' ' A' ' 29' ' ' GLN . 0.0 OUTLIER -66.04 -18.26 65.23 Favored 'General case' 0 C--N 1.307 -1.245 0 CA-C-N 114.607 -0.797 . . . . 0.0 110.99 179.539 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -100.19 10.5 41.16 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.465 -0.788 . . . . 0.0 109.375 178.589 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 50.2 m 71.61 23.31 3.81 Favored 'General case' 0 C--N 1.342 0.275 0 CA-C-O 121.913 0.864 . . . . 0.0 109.113 -175.244 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.671 ' OG ' ' HA3' ' A' ' 28' ' ' GLY . 2.2 p -70.77 92.52 0.89 Allowed 'General case' 0 N--CA 1.42 -1.933 0 CA-C-N 114.983 -1.008 . . . . 0.0 111.403 -179.339 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.609 ' HA ' ' O ' ' A' ' 26' ' ' VAL . 31.4 mt-10 -81.52 102.08 10.35 Favored 'General case' 0 CA--C 1.505 -0.759 0 CA-C-O 121.211 0.529 . . . . 0.0 110.579 178.71 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.426 HG21 ' HA ' ' A' ' 51' ' ' TYR . 29.5 mm -99.73 138.97 22.45 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.718 0 N-CA-C 109.283 -0.636 . . . . 0.0 109.283 179.317 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 12.0 m170 -116.43 132.9 56.55 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 178.991 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.537 ' HZ ' HG23 ' A' ' 26' ' ' VAL . 1.0 OUTLIER -147.26 167.89 23.12 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-O 121.179 0.514 . . . . 0.0 111.555 -177.456 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 91.7 mttt -124.11 125.12 43.94 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.902 -0.59 . . . . 0.0 109.805 -178.963 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.518 ' HA ' ' OE2' ' A' ' 18' ' ' GLU . 24.1 m -144.72 152.77 14.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 121.048 0.451 . . . . 0.0 110.443 -179.852 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.446 ' HG2' ' HB3' ' A' ' 21' ' ' TYR . 36.5 mtpt -77.65 174.93 10.39 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-O 121.665 0.745 . . . . 0.0 111.401 177.436 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -87.02 -32.67 19.89 Favored 'General case' 0 C--N 1.31 -1.122 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.371 179.24 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 9.8 t -94.68 14.63 20.52 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.324 -177.293 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 6.4 t -105.42 167.36 9.8 Favored 'General case' 0 C--N 1.316 -0.865 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 179.903 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' HIS . . . . . 0.444 ' O ' ' HG2' ' A' ' 46' ' ' LYS . 46.4 m170 -81.9 142.41 32.51 Favored 'General case' 0 C--N 1.312 -1.022 0 CA-C-O 121.675 0.75 . . . . 0.0 111.84 -179.309 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.652 ' O ' ' HG3' ' A' ' 48' ' ' LYS . 0.2 OUTLIER -64.88 -17.68 64.52 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 114.998 -1.001 . . . . 0.0 109.893 179.296 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.739 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -51.9 -47.81 64.44 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.967 -179.043 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.444 ' HG2' ' O ' ' A' ' 43' ' ' HIS . 22.5 ptmt -58.97 -34.29 71.63 Favored 'General case' 0 C--O 1.207 -1.147 0 CA-C-O 121.077 0.465 . . . . 0.0 110.385 -179.274 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.554 ' HB3' HD13 ' A' ' 44' ' ' LEU . 8.2 tt -70.6 -47.98 57.44 Favored 'General case' 0 C--N 1.301 -1.531 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.124 -179.997 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.652 ' HG3' ' O ' ' A' ' 44' ' ' LEU . 20.8 mtpt -59.98 -49.93 75.73 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.509 -178.041 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.739 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 10.4 pt-20 -67.67 -33.89 75.83 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.441 -179.25 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.613 ' O ' ' HG2' ' A' ' 54' ' ' ARG . 7.5 m -66.39 -45.66 79.27 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.845 -179.659 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.462 ' CE2' ' HA ' ' A' ' 48' ' ' LYS . 2.1 p90 -76.35 -32.69 58.79 Favored 'General case' 0 N--CA 1.445 -0.677 0 C-N-CA 119.667 -0.813 . . . . 0.0 110.672 -177.775 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 52' ' ' CYS . . . . . 0.529 ' SG ' ' HG2' ' A' ' 59' ' ' MET . 69.2 m -61.98 -44.75 96.09 Favored 'General case' 0 C--O 1.238 0.466 0 CA-C-O 121.0 0.428 . . . . 0.0 110.793 179.083 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 53' ' ' GLN . . . . . 0.406 ' OE1' ' HA ' ' A' ' 12' ' ' ASP . 11.6 pt20 -67.99 -33.39 74.53 Favored 'General case' 0 N--CA 1.447 -0.601 0 C-N-CA 120.66 -0.416 . . . . 0.0 110.533 -179.922 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.613 ' HG2' ' O ' ' A' ' 50' ' ' SER . 17.8 mmt85 -57.67 -38.04 74.44 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-O 121.313 0.578 . . . . 0.0 110.832 177.531 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 33.7 mt-30 -81.29 -21.31 39.4 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.954 179.914 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 82.86 29.99 33.31 Favored Glycine 0 N--CA 1.446 -0.688 0 C-N-CA 120.834 -0.698 . . . . 0.0 112.325 179.224 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 35.0 m -132.17 147.63 66.55 Favored Pre-proline 0 C--N 1.324 -0.504 0 O-C-N 122.508 -0.407 . . . . 0.0 110.786 -179.042 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' PRO . . . . . 0.597 ' HG2' ' OG ' ' A' ' 61' ' ' SER . 18.8 Cg_endo -63.35 150.35 88.79 Favored 'Trans proline' 0 N--CA 1.456 -0.683 0 C-N-CA 122.33 2.02 . . . . 0.0 111.955 177.601 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.529 ' HG2' ' SG ' ' A' ' 52' ' ' CYS . 69.8 mtp -70.01 -9.16 54.33 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.77 -176.338 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 60' ' ' ASN . . . . . 0.403 ' OD1' ' HB2' ' A' ' 58' ' ' PRO . 1.9 p-10 -92.19 -8.52 45.26 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 121.23 0.538 . . . . 0.0 110.886 -179.607 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.597 ' OG ' ' HG2' ' A' ' 58' ' ' PRO . 67.3 m -84.66 -23.36 29.49 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 121.002 0.429 . . . . 0.0 111.836 179.516 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.457 HD11 ' SG ' ' A' ' 52' ' ' CYS . 1.2 pp -125.57 169.14 12.76 Favored 'General case' 0 C--N 1.307 -1.247 0 N-CA-C 113.313 0.856 . . . . 0.0 113.313 -175.091 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.466 ' O ' ' HA ' ' A' ' 90' ' ' VAL . 52.5 mtm180 -116.16 112.42 21.65 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.176 -0.92 . . . . 0.0 110.722 -178.156 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.41 ' HB3' ' OH ' ' A' ' 51' ' ' TYR . 0.1 OUTLIER -96.91 115.12 26.88 Favored 'General case' 0 C--N 1.31 -1.131 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.522 178.466 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.459 ' C ' HD22 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -143.54 162.12 36.68 Favored 'General case' 0 N--CA 1.443 -0.792 0 CA-C-O 121.745 0.783 . . . . 0.0 111.834 -179.65 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 92.5 t80 -145.79 136.95 24.75 Favored 'General case' 0 C--N 1.309 -1.168 0 N-CA-C 108.785 -0.82 . . . . 0.0 108.785 178.564 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.453 ' HG2' HE21 ' A' ' 69' ' ' GLN . 7.1 pt-20 48.54 29.04 1.94 Allowed 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 124.391 1.076 . . . . 0.0 112.231 -178.417 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 83.57 23.17 54.49 Favored Glycine 0 N--CA 1.447 -0.589 0 C-N-CA 120.935 -0.65 . . . . 0.0 113.26 -179.646 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' GLN . . . . . 0.453 HE21 ' HG2' ' A' ' 67' ' ' GLU . 3.0 pt20 -130.47 137.41 49.77 Favored 'General case' 0 C--N 1.32 -0.711 0 O-C-N 122.212 -0.581 . . . . 0.0 109.462 179.826 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.422 ' HD2' ' H ' ' A' ' 70' ' ' ARG . 0.5 OUTLIER -73.07 146.62 45.69 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-O 121.704 0.764 . . . . 0.0 110.172 178.154 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.454 HG21 HD12 ' A' ' 44' ' ' LEU . 22.6 mm -92.63 119.56 40.45 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.855 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.308 -178.391 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -94.88 161.03 14.32 Favored 'General case' 0 N--CA 1.434 -1.232 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 178.841 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' ASP . . . . . 0.413 ' HB3' ' HB3' ' A' ' 45' ' ' LYS . 66.3 m-20 -67.87 -21.18 65.18 Favored 'General case' 0 C--N 1.314 -0.964 0 CA-C-O 121.303 0.573 . . . . 0.0 111.506 -177.918 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 6.1 m-80 -100.44 6.78 44.44 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-O 121.268 0.556 . . . . 0.0 110.1 -179.437 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' HIS . . . . . 0.582 ' O ' ' HB2' ' A' ' 44' ' ' LEU . 2.2 m170 -83.27 145.84 28.88 Favored 'General case' 0 CA--C 1.5 -0.955 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 178.342 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.417 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 68.8 p -118.24 152.91 51.29 Favored Pre-proline 0 C--N 1.301 -1.53 0 C-N-CA 120.824 -0.351 . . . . 0.0 111.476 179.647 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_exo -57.3 -41.03 77.52 Favored 'Trans proline' 0 C--N 1.349 0.584 0 C-N-CA 122.597 2.198 . . . . 0.0 111.431 178.508 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' LYS . . . . . 0.54 ' HG3' ' N ' ' A' ' 79' ' ' GLU . 48.1 pttt -64.58 -40.92 96.41 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.877 -178.918 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.54 ' N ' ' HG3' ' A' ' 78' ' ' LYS . 55.6 mm-40 -73.55 -35.73 65.55 Favored 'General case' 0 N--CA 1.439 -0.99 0 CA-C-O 120.951 0.405 . . . . 0.0 111.463 -177.592 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.455 HD21 ' CG ' ' A' ' 75' ' ' HIS . 5.5 mt -80.69 -0.93 40.44 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.119 0.485 . . . . 0.0 111.253 -179.35 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 78.26 37.78 27.35 Favored Glycine 0 CA--C 1.51 -0.256 0 C-N-CA 120.872 -0.68 . . . . 0.0 112.963 177.174 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 61.0 mtt -100.18 165.26 11.58 Favored 'General case' 0 C--N 1.311 -1.082 0 N-CA-C 109.844 -0.428 . . . . 0.0 109.844 179.35 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -148.2 -171.32 3.81 Favored 'General case' 0 C--N 1.311 -1.084 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 178.151 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.554 ' HA ' ' HB ' ' A' ' 22' ' ' ILE . 15.8 pt-20 -71.19 138.39 49.5 Favored 'General case' 0 N--CA 1.443 -0.778 0 C-N-CA 120.223 -0.591 . . . . 0.0 110.928 -179.89 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 79.7 -2.29 2.1 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 124.801 1.24 . . . . 0.0 111.433 178.861 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -59.33 162.5 4.65 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-O 121.395 0.617 . . . . 0.0 111.284 179.109 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 7.1 p -129.48 143.38 41.32 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.948 0 CA-C-O 121.285 0.564 . . . . 0.0 111.33 -177.001 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 3.7 mp -114.47 153.9 15.91 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 179.642 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 11.0 tp10 -107.41 138.56 43.39 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 120.802 0.334 . . . . 0.0 110.102 -177.226 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 90' ' ' VAL . . . . . 0.596 ' HB ' ' HA2' ' A' ' 28' ' ' GLY . 97.1 t -130.62 134.05 62.62 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.974 0 CA-C-O 121.47 0.653 . . . . 0.0 110.922 178.863 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 89.0 m-85 -119.27 -177.36 3.33 Favored 'General case' 0 C--N 1.306 -1.284 0 CA-C-N 115.886 -0.597 . . . . 0.0 109.465 179.799 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 92' ' ' GLN . . . . . 0.474 ' HG3' ' H ' ' A' ' 94' ' ' GLN . 8.1 tp60 -108.31 148.26 30.3 Favored 'General case' 0 C--N 1.307 -1.263 0 O-C-N 121.934 -0.478 . . . . 0.0 110.38 -179.281 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 93' ' ' GLU . . . . . 0.419 ' OE2' ' HG2' ' A' ' 63' ' ' ARG . 10.5 pt-20 -137.35 20.07 2.94 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.702 0.763 . . . . 0.0 110.322 174.658 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 94' ' ' GLN . . . . . 0.474 ' H ' ' HG3' ' A' ' 92' ' ' GLN . 24.8 mt-30 -70.39 -149.07 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.745 0 CA-C-N 115.406 -0.816 . . . . 0.0 110.663 176.825 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 11.1 t -155.21 157.02 36.68 Favored 'General case' 0 C--N 1.316 -0.864 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 -179.115 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -169.14 -152.2 7.67 Favored Glycine 0 N--CA 1.445 -0.718 0 C-N-CA 120.773 -0.727 . . . . 0.0 111.973 -179.08 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.944 0 CA-C-O 118.944 -0.92 . . . . 0.0 111.697 -179.359 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.9 tpt . . . . . 0 N--CA 1.486 1.34 0 CA-C-O 121.476 0.655 . . . . 0.0 110.762 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 15.9 m -131.99 10.34 4.59 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-O 122.356 1.074 . . . . 0.0 108.433 179.499 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -99.03 10.98 40.34 Favored 'General case' 0 C--N 1.308 -1.213 0 CA-C-N 114.507 -1.224 . . . . 0.0 109.906 -174.258 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 3.2 pt20 -78.25 -25.12 46.69 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 115.539 -0.755 . . . . 0.0 111.092 -177.726 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -97.64 150.26 21.36 Favored 'General case' 0 N--CA 1.444 -0.732 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 179.517 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -85.35 121.13 27.64 Favored 'General case' 0 C--N 1.312 -1.059 0 CA-C-O 121.05 0.452 . . . . 0.0 110.325 178.138 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 15.4 ptmt -158.7 131.3 4.41 Favored Pre-proline 0 C--N 1.313 -1.011 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.579 179.891 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -85.31 -28.49 0.83 Allowed 'Trans proline' 0 N--CA 1.453 -0.877 0 C-N-CA 122.465 2.11 . . . . 0.0 112.319 179.1 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 2.3 p -99.36 115.66 29.72 Favored 'General case' 0 N--CA 1.44 -0.969 0 CA-C-O 121.058 0.456 . . . . 0.0 111.833 -177.884 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 61.0 p -46.56 155.24 0.25 Allowed 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 115.681 -0.69 . . . . 0.0 111.659 174.726 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -60.74 107.88 0.76 Allowed 'General case' 0 C--O 1.238 0.476 0 CA-C-O 121.794 0.807 . . . . 0.0 111.498 -178.639 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -147.02 153.95 40.63 Favored 'General case' 0 C--N 1.307 -1.257 0 CA-C-N 115.049 -0.978 . . . . 0.0 109.578 -178.256 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.3 pp -166.85 -178.13 4.14 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.805 0.336 . . . . 0.0 111.266 -176.962 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 158.44 72.11 0.02 OUTLIER Glycine 0 N--CA 1.449 -0.477 0 C-N-CA 120.859 -0.686 . . . . 0.0 112.678 179.884 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -118.57 29.01 7.98 Favored 'General case' 0 C--N 1.312 -1.053 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 178.23 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 28.3 mmtp -99.87 169.26 9.35 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.939 -177.011 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 4.2 mtpp -83.2 -162.73 0.64 Allowed 'General case' 0 C--O 1.237 0.404 0 CA-C-O 120.97 0.414 . . . . 0.0 111.41 179.027 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -163.73 -179.33 6.3 Favored 'General case' 0 N--CA 1.432 -1.333 0 N-CA-C 108.895 -0.78 . . . . 0.0 108.895 -174.401 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 64.5 114.6 0.01 OUTLIER Glycine 0 CA--C 1.528 0.863 0 N-CA-C 115.482 0.953 . . . . 0.0 115.482 175.481 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 4.4 mp0 66.33 37.37 4.87 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 121.361 0.6 . . . . 0.0 111.181 175.193 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 40.0 p90 -107.31 173.97 6.09 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-O 121.385 0.612 . . . . 0.0 110.857 179.777 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.518 ' HB ' ' HA ' ' A' ' 84' ' ' GLU . 27.7 pt -123.45 172.18 11.26 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.205 0 CA-C-O 121.471 0.653 . . . . 0.0 110.131 179.038 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 41.1 mtmt -120.95 142.5 49.69 Favored 'General case' 0 C--N 1.296 -1.745 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 179.899 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.6 mp -135.76 160.83 37.32 Favored 'General case' 0 C--N 1.301 -1.539 0 CA-C-O 121.278 0.561 . . . . 0.0 110.755 176.708 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.429 ' O ' ' HA ' ' A' ' 87' ' ' VAL . 5.1 tmmm? -130.17 142.09 50.61 Favored 'General case' 0 C--N 1.309 -1.156 0 CA-C-O 121.37 0.605 . . . . 0.0 110.315 -178.728 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.519 HG23 ' HZ ' ' A' ' 36' ' ' PHE . 0.9 OUTLIER -112.87 142.82 24.03 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.544 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.353 -179.142 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 44.4 mm -106.97 115.61 48.86 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.138 0 N-CA-C 107.463 -1.31 . . . . 0.0 107.463 174.737 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -78.13 178.31 52.66 Favored Glycine 0 N--CA 1.423 -2.202 0 C-N-CA 120.796 -0.716 . . . . 0.0 113.257 -175.054 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.66 ' H ' ' CD ' ' A' ' 29' ' ' GLN . 0.0 OUTLIER -72.72 -27.63 62.17 Favored 'General case' 0 C--N 1.3 -1.581 0 CA-C-O 122.141 0.972 . . . . 0.0 108.442 -179.02 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -102.73 16.28 26.95 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 114.705 -1.134 . . . . 0.0 108.343 178.375 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 21.3 m 73.46 15.86 4.13 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 115.267 -0.879 . . . . 0.0 111.402 179.003 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 21.6 t -68.04 110.41 3.92 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.05 179.304 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.512 ' HA ' ' O ' ' A' ' 26' ' ' VAL . 4.3 mp0 -86.65 108.48 18.65 Favored 'General case' 0 N--CA 1.445 -0.714 0 CA-C-O 121.3 0.571 . . . . 0.0 110.828 179.9 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 28.7 mm -98.59 141.28 16.61 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.212 0 N-CA-C 109.365 -0.606 . . . . 0.0 109.365 179.582 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 11.4 m170 -120.02 129.31 54.2 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 -179.898 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.519 ' HZ ' HG23 ' A' ' 26' ' ' VAL . 1.7 p90 -147.17 162.56 38.62 Favored 'General case' 0 C--N 1.313 -0.984 0 CA-C-O 121.351 0.596 . . . . 0.0 111.625 -177.676 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 19.2 ptpt -118.69 127.61 53.73 Favored 'General case' 0 N--CA 1.445 -0.704 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.853 179.41 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.423 HG21 HD12 ' A' ' 47' ' ' LEU . 34.6 m -142.17 162.34 19.46 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 178.098 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.583 ' O ' HG22 ' A' ' 42' ' ' THR . 70.9 tttt -94.46 166.56 12.0 Favored 'General case' 0 C--N 1.305 -1.33 0 O-C-N 121.587 -0.695 . . . . 0.0 110.649 -179.426 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -76.1 -35.06 59.48 Favored 'General case' 0 C--N 1.328 -0.362 0 O-C-N 121.914 -0.491 . . . . 0.0 111.923 -177.436 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 15.1 t -90.05 16.91 7.52 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 120.996 0.426 . . . . 0.0 111.606 -177.961 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' THR . . . . . 0.583 HG22 ' O ' ' A' ' 39' ' ' LYS . 2.0 t -106.86 170.63 7.83 Favored 'General case' 0 C--N 1.321 -0.67 0 O-C-N 121.938 -0.476 . . . . 0.0 110.174 -178.624 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 8.2 m-70 -85.41 147.35 26.54 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.557 0.694 . . . . 0.0 111.522 -179.75 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.58 HD13 ' HB3' ' A' ' 47' ' ' LEU . 0.2 OUTLIER -73.77 -13.26 60.92 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.309 -179.345 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.734 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -55.75 -43.37 76.6 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.986 -178.966 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 12.0 ptmt -68.34 -29.15 67.81 Favored 'General case' 0 C--O 1.213 -0.861 0 CA-C-O 121.127 0.489 . . . . 0.0 110.596 -178.929 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.58 ' HB3' HD13 ' A' ' 44' ' ' LEU . 9.1 tt -73.23 -49.03 30.1 Favored 'General case' 0 C--N 1.305 -1.357 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.153 -179.866 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.535 ' HA ' ' CD2' ' A' ' 51' ' ' TYR . 7.7 ptmm? -63.65 -41.63 98.2 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.726 -177.563 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.734 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 8.4 pt-20 -69.71 -33.76 72.95 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 121.0 0.428 . . . . 0.0 110.426 176.992 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 4.7 m -67.83 -41.76 82.49 Favored 'General case' 0 C--O 1.236 0.354 0 N-CA-C 112.512 0.56 . . . . 0.0 112.512 -178.312 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.535 ' CD2' ' HA ' ' A' ' 48' ' ' LYS . 2.7 p90 -76.78 -32.38 57.65 Favored 'General case' 0 N--CA 1.444 -0.734 0 C-N-CA 119.436 -0.905 . . . . 0.0 110.229 -179.096 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 52' ' ' CYS . . . . . 0.567 ' SG ' HD11 ' A' ' 62' ' ' LEU . 98.6 m -62.34 -45.08 94.8 Favored 'General case' 0 CA--C 1.51 -0.559 0 CA-C-O 120.967 0.413 . . . . 0.0 110.646 178.857 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 10.6 pt20 -66.36 -34.67 78.48 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.159 -179.727 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.433 ' NE ' ' HA ' ' A' ' 54' ' ' ARG . 3.9 mmp_? -59.23 -39.56 83.11 Favored 'General case' 0 CA--C 1.514 -0.432 0 CA-C-O 121.023 0.44 . . . . 0.0 111.329 177.707 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 32.4 mt-30 -77.46 -21.28 53.17 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-O 121.137 0.494 . . . . 0.0 110.715 179.371 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 82.75 30.85 31.22 Favored Glycine 0 N--CA 1.444 -0.813 0 C-N-CA 120.937 -0.649 . . . . 0.0 112.217 179.25 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 35.6 m -133.65 148.31 68.06 Favored Pre-proline 0 C--N 1.326 -0.439 0 O-C-N 122.42 -0.459 . . . . 0.0 110.803 -179.045 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' PRO . . . . . 0.57 ' HG2' ' OG ' ' A' ' 61' ' ' SER . 18.0 Cg_endo -62.45 153.43 71.05 Favored 'Trans proline' 0 N--CA 1.461 -0.422 0 C-N-CA 122.585 2.19 . . . . 0.0 111.866 177.205 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.469 ' HG2' ' SG ' ' A' ' 52' ' ' CYS . 74.1 mtp -72.69 -8.72 56.76 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.134 0.493 . . . . 0.0 111.529 -176.356 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.9 p-10 -91.63 -8.75 46.32 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-O 121.268 0.556 . . . . 0.0 110.561 179.551 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.57 ' OG ' ' HG2' ' A' ' 58' ' ' PRO . 75.6 m -87.25 -18.03 31.2 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-O 121.095 0.474 . . . . 0.0 111.862 -179.742 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.567 HD11 ' SG ' ' A' ' 52' ' ' CYS . 1.3 pp -131.19 169.69 15.59 Favored 'General case' 0 C--N 1.31 -1.114 0 N-CA-C 113.067 0.765 . . . . 0.0 113.067 -176.999 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.435 ' O ' ' HA ' ' A' ' 90' ' ' VAL . 35.8 mtm180 -119.72 121.15 38.56 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.416 -177.748 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.415 ' HB3' ' OH ' ' A' ' 51' ' ' TYR . 0.2 OUTLIER -105.1 117.96 35.33 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-O 121.206 0.527 . . . . 0.0 111.462 179.475 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.445 ' C ' HD22 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -147.85 164.42 33.74 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 121.208 0.528 . . . . 0.0 110.471 179.606 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 77.9 t80 -144.69 135.84 25.14 Favored 'General case' 0 C--N 1.313 -0.994 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 178.134 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.477 ' HG2' HE21 ' A' ' 69' ' ' GLN . 7.3 pt-20 50.88 26.37 2.61 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 124.117 0.967 . . . . 0.0 112.327 -179.899 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 85.04 23.27 49.73 Favored Glycine 0 N--CA 1.445 -0.726 0 C-N-CA 120.871 -0.68 . . . . 0.0 112.902 -179.38 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' GLN . . . . . 0.477 HE21 ' HG2' ' A' ' 67' ' ' GLU . 2.8 pt20 -129.92 134.39 47.45 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 178.953 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 10.8 ptt180 -65.56 148.68 51.34 Favored 'General case' 0 C--N 1.31 -1.136 0 CA-C-O 121.586 0.708 . . . . 0.0 111.113 177.824 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.474 HG21 HD12 ' A' ' 44' ' ' LEU . 21.0 mm -98.92 115.56 39.73 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.301 0 N-CA-C 109.629 -0.508 . . . . 0.0 109.629 177.724 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -96.34 165.99 11.93 Favored 'General case' 0 N--CA 1.437 -1.091 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 -179.237 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' ASP . . . . . 0.428 ' CA ' ' HB3' ' A' ' 45' ' ' LYS . 37.1 m-20 -69.32 -25.44 64.22 Favored 'General case' 0 C--N 1.31 -1.124 0 CA-C-O 121.518 0.675 . . . . 0.0 110.982 -178.268 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 8.5 m-80 -96.5 4.66 51.93 Favored 'General case' 0 C--N 1.311 -1.076 0 CA-C-O 121.491 0.662 . . . . 0.0 109.708 -178.026 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' HIS . . . . . 0.546 ' O ' ' HB2' ' A' ' 44' ' ' LEU . 4.5 m170 -83.77 144.75 29.11 Favored 'General case' 0 CA--C 1.503 -0.855 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 178.849 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.523 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 77.6 p -117.85 155.29 51.06 Favored Pre-proline 0 C--N 1.302 -1.499 0 N-CA-C 110.276 -0.268 . . . . 0.0 110.276 178.516 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -67.49 -30.57 35.63 Favored 'Trans proline' 0 N--CA 1.454 -0.822 0 C-N-CA 121.95 1.767 . . . . 0.0 111.043 -179.896 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' LYS . . . . . 0.466 ' HG3' ' N ' ' A' ' 79' ' ' GLU . 33.2 pttt -70.73 -38.47 73.57 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.952 0.406 . . . . 0.0 110.551 179.59 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.466 ' N ' ' HG3' ' A' ' 78' ' ' LYS . 5.0 mm-40 -74.14 -37.64 64.0 Favored 'General case' 0 N--CA 1.447 -0.623 0 CA-C-O 121.015 0.436 . . . . 0.0 111.269 -179.572 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.523 ' HG ' ' O ' ' A' ' 76' ' ' THR . 5.9 mt -77.29 -5.04 47.96 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.278 0.561 . . . . 0.0 110.872 -179.862 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 78.34 42.96 13.7 Favored Glycine 0 C--O 1.227 -0.34 0 C-N-CA 121.129 -0.558 . . . . 0.0 113.217 176.733 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 61.4 mtt -101.65 165.68 11.1 Favored 'General case' 0 C--N 1.315 -0.932 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 179.51 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -142.6 -170.72 3.27 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 110.073 -0.343 . . . . 0.0 110.073 177.104 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.518 ' HA ' ' HB ' ' A' ' 22' ' ' ILE . 14.4 pt-20 -68.7 135.94 52.11 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.97 0.414 . . . . 0.0 111.003 -179.421 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 79.07 4.41 2.33 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 124.361 1.064 . . . . 0.0 111.158 177.574 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 17.6 t0 -60.64 159.26 11.02 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-O 121.422 0.629 . . . . 0.0 110.982 178.515 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.429 ' HA ' ' O ' ' A' ' 25' ' ' LYS . 7.4 p -127.05 141.48 46.14 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.243 0 CA-C-O 121.386 0.612 . . . . 0.0 111.417 -177.387 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 3.6 mp -111.33 155.91 12.61 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.743 0 CA-C-N 116.203 -0.453 . . . . 0.0 109.82 -179.379 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 6.3 tp10 -105.34 135.3 46.97 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.929 0.395 . . . . 0.0 110.227 -177.25 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 90' ' ' VAL . . . . . 0.435 ' HA ' ' O ' ' A' ' 63' ' ' ARG . 60.4 t -128.87 134.75 63.72 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.912 0 CA-C-O 121.119 0.485 . . . . 0.0 110.809 178.148 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 87.9 m-85 -119.05 173.9 6.63 Favored 'General case' 0 C--N 1.32 -0.713 0 N-CA-C 108.947 -0.761 . . . . 0.0 108.947 178.115 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 7.1 tp60 -102.44 146.85 27.5 Favored 'General case' 0 C--N 1.314 -0.947 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 178.633 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 23.0 pt-20 -139.12 19.91 2.61 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.165 0.507 . . . . 0.0 111.191 176.267 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -57.68 -166.12 0.0 OUTLIER 'General case' 0 CA--C 1.543 0.683 0 CA-C-O 121.645 0.736 . . . . 0.0 112.57 177.231 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 9.0 t -138.0 137.6 38.05 Favored 'General case' 0 N--CA 1.44 -0.954 0 O-C-N 121.554 -0.716 . . . . 0.0 110.377 -175.253 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -107.41 46.93 1.1 Allowed Glycine 0 N--CA 1.445 -0.767 0 N-CA-C 111.46 -0.656 . . . . 0.0 111.46 178.516 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.435 -1.375 0 CA-C-O 119.024 -0.875 . . . . 0.0 110.982 -179.149 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.475 0.788 0 CA-C-O 120.978 0.418 . . . . 0.0 111.833 . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 6.6 m -82.4 -79.92 0.17 Allowed 'General case' 0 N--CA 1.444 -0.746 0 CA-C-O 120.872 0.368 . . . . 0.0 111.675 -178.575 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 26.9 t70 175.26 129.2 0.03 OUTLIER 'General case' 0 CA--C 1.497 -1.078 0 N-CA-C 106.447 -1.686 . . . . 0.0 106.447 -178.032 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 6.8 pt20 -147.59 -37.24 0.2 Allowed 'General case' 0 C--N 1.286 -2.189 0 CA-C-O 121.286 0.565 . . . . 0.0 111.225 -174.589 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -118.75 -164.15 1.01 Allowed 'General case' 0 C--N 1.316 -0.866 0 N-CA-C 109.584 -0.524 . . . . 0.0 109.584 179.145 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -147.08 130.07 16.32 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-O 121.171 0.51 . . . . 0.0 111.266 -179.133 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 46.1 mmtm -131.03 138.05 32.11 Favored Pre-proline 0 C--N 1.311 -1.09 0 CA-C-N 115.848 -0.615 . . . . 0.0 109.493 176.944 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -80.07 102.04 1.41 Allowed 'Trans proline' 0 N--CA 1.444 -1.4 0 C-N-CA 122.564 2.176 . . . . 0.0 112.692 -177.362 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 38.3 m -87.45 143.02 27.43 Favored 'General case' 0 C--N 1.312 -1.044 0 N-CA-C 108.659 -0.867 . . . . 0.0 108.659 177.818 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 12.2 t -97.23 162.81 13.18 Favored 'General case' 0 C--N 1.314 -0.974 0 O-C-N 121.849 -0.532 . . . . 0.0 110.88 -177.197 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -151.78 151.2 31.05 Favored 'General case' 0 C--N 1.315 -0.897 0 N-CA-C 109.122 -0.695 . . . . 0.0 109.122 -179.782 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -69.61 91.99 0.62 Allowed 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.275 0.559 . . . . 0.0 110.63 178.982 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 88.2 mt -98.07 158.48 15.52 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-O 121.199 0.524 . . . . 0.0 110.246 -179.98 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 105.14 23.14 7.84 Favored Glycine 0 N--CA 1.438 -1.189 0 C-N-CA 120.61 -0.805 . . . . 0.0 111.308 -179.543 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -102.97 34.46 2.86 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 122.445 1.117 . . . . 0.0 108.925 -179.01 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 6.9 ptmm? -159.62 179.98 8.4 Favored 'General case' 0 C--N 1.31 -1.113 0 CA-C-N 114.624 -1.171 . . . . 0.0 109.106 -175.872 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.418 ' HE2' ' HB2' ' A' ' 17' ' ' LYS . 0.0 OUTLIER -134.9 150.44 50.43 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 121.459 0.647 . . . . 0.0 111.015 179.607 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.406 ' HB3' ' CE2' ' A' ' 21' ' ' TYR . 40.0 mt-10 -120.67 -174.96 2.92 Favored 'General case' 0 C--N 1.307 -1.247 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.92 177.395 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.469 ' H ' ' HD2' ' A' ' 21' ' ' TYR . . . 120.52 124.95 3.2 Favored Glycine 0 N--CA 1.447 -0.631 0 C-N-CA 120.908 -0.663 . . . . 0.0 112.192 -177.893 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 42.8 mm-40 62.37 53.77 2.7 Favored 'General case' 0 CA--C 1.515 -0.382 0 CA-C-O 121.782 0.801 . . . . 0.0 111.56 178.851 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.519 ' CE1' ' HD3' ' A' ' 37' ' ' LYS . 44.5 p90 -127.5 171.49 11.54 Favored 'General case' 0 C--N 1.301 -1.541 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.232 179.904 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 24.5 pt -119.98 171.04 8.85 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.212 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 176.291 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 1.8 mppt? -118.44 142.84 47.16 Favored 'General case' 0 C--N 1.296 -1.74 0 N-CA-C 109.017 -0.735 . . . . 0.0 109.017 -179.508 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.5 mp -135.3 162.83 31.46 Favored 'General case' 0 C--N 1.301 -1.508 0 CA-C-O 121.197 0.523 . . . . 0.0 110.572 176.67 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.428 ' O ' ' HA ' ' A' ' 87' ' ' VAL . 5.3 tmmm? -132.5 142.55 49.26 Favored 'General case' 0 N--CA 1.434 -1.274 0 CA-C-O 121.436 0.636 . . . . 0.0 110.775 -178.775 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.515 HG11 ' CD1' ' A' ' 51' ' ' TYR . 0.9 OUTLIER -115.98 141.89 31.57 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.324 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.036 -179.954 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.43 ' O ' ' HB ' ' A' ' 90' ' ' VAL . 48.3 mm -104.6 118.27 51.62 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.109 0 N-CA-C 107.425 -1.324 . . . . 0.0 107.425 174.626 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' GLY . . . . . 0.472 ' HA2' ' HB ' ' A' ' 90' ' ' VAL . . . -91.53 162.22 27.86 Favored Glycine 0 N--CA 1.423 -2.215 0 C-N-CA 120.145 -1.026 . . . . 0.0 111.32 -177.064 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.83 -24.45 62.01 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-O 121.531 0.681 . . . . 0.0 111.351 177.701 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 36.4 t70 -89.1 9.1 26.65 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-O 121.401 0.62 . . . . 0.0 110.177 178.598 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 8.6 t 70.06 16.7 7.48 Favored 'General case' 0 C--N 1.342 0.279 0 CA-C-O 122.177 0.989 . . . . 0.0 109.301 -177.458 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 5.0 t -77.13 111.56 12.86 Favored 'General case' 0 N--CA 1.444 -0.754 0 CA-C-N 114.997 -1.001 . . . . 0.0 110.195 -179.821 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.419 ' HA ' ' O ' ' A' ' 26' ' ' VAL . 41.3 mt-10 -87.15 112.08 21.59 Favored 'General case' 0 CA--C 1.507 -0.705 0 N-CA-C 109.803 -0.443 . . . . 0.0 109.803 177.861 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.416 HG21 ' HA ' ' A' ' 51' ' ' TYR . 32.1 mm -101.6 136.86 31.54 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.659 0 N-CA-C 109.489 -0.56 . . . . 0.0 109.489 179.681 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 35' ' ' HIS . . . . . 0.407 ' NE2' ' HG3' ' A' ' 25' ' ' LYS . 11.7 m170 -117.28 134.71 54.49 Favored 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 179.397 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.485 ' HZ ' HG23 ' A' ' 26' ' ' VAL . 1.0 OUTLIER -147.13 159.47 43.58 Favored 'General case' 0 C--N 1.309 -1.184 0 CA-C-O 121.22 0.533 . . . . 0.0 111.332 -177.765 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.519 ' HD3' ' CE1' ' A' ' 21' ' ' TYR . 93.1 mttt -116.41 117.21 29.32 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.743 -178.712 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 32.6 m -137.74 158.39 33.83 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 N-CA-C 109.884 -0.413 . . . . 0.0 109.884 179.787 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 24.2 mtpp -81.85 175.92 10.02 Favored 'General case' 0 CA--C 1.503 -0.837 0 CA-C-O 121.497 0.665 . . . . 0.0 111.205 178.382 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -83.05 -32.39 26.86 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-N 115.712 -0.676 . . . . 0.0 111.118 178.843 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 14.8 t -97.13 15.21 23.25 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.03 0.443 . . . . 0.0 112.002 -177.351 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 4.2 t -98.71 163.99 12.41 Favored 'General case' 0 C--N 1.316 -0.852 0 O-C-N 121.87 -0.518 . . . . 0.0 110.052 -178.908 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 27.6 m170 -77.34 142.68 39.24 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.458 0.647 . . . . 0.0 111.421 179.114 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.605 ' O ' ' HG3' ' A' ' 48' ' ' LYS . 0.2 OUTLIER -70.81 -15.96 62.7 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 115.391 -0.822 . . . . 0.0 109.41 -179.878 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.659 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -55.22 -45.43 75.96 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.868 -0.605 . . . . 0.0 112.576 -177.506 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 21.9 ptmt -66.46 -28.99 69.02 Favored 'General case' 0 C--O 1.22 -0.494 0 CA-C-O 121.283 0.563 . . . . 0.0 110.407 -178.699 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.576 ' HB3' HD13 ' A' ' 44' ' ' LEU . 8.1 tt -70.16 -47.72 60.41 Favored 'General case' 0 C--N 1.312 -1.052 0 CA-C-N 115.721 -0.672 . . . . 0.0 109.668 178.726 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.605 ' HG3' ' O ' ' A' ' 44' ' ' LEU . 20.9 mtpt -57.31 -48.12 79.77 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-O 121.512 0.673 . . . . 0.0 110.434 -179.329 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.659 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 6.3 pt-20 -71.61 -32.63 68.21 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.859 -178.386 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.443 ' O ' ' HG2' ' A' ' 53' ' ' GLN . 28.5 t -63.87 -46.44 84.92 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-O 121.173 0.511 . . . . 0.0 110.944 -179.687 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.515 ' CD1' HG11 ' A' ' 26' ' ' VAL . 1.9 p90 -76.46 -32.55 58.46 Favored 'General case' 0 N--CA 1.44 -0.931 0 C-N-CA 119.976 -0.689 . . . . 0.0 110.564 -177.783 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 52' ' ' CYS . . . . . 0.537 ' SG ' HD11 ' A' ' 62' ' ' LEU . 74.7 m -63.63 -43.37 97.03 Favored 'General case' 0 CA--C 1.511 -0.537 0 CA-C-O 121.159 0.504 . . . . 0.0 110.704 179.226 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 53' ' ' GLN . . . . . 0.443 ' HG2' ' O ' ' A' ' 50' ' ' SER . 13.7 pt20 -67.5 -34.77 77.82 Favored 'General case' 0 N--CA 1.443 -0.786 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.271 -179.875 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.512 ' NE ' ' HA ' ' A' ' 54' ' ' ARG . 4.0 mmp_? -58.08 -38.53 76.55 Favored 'General case' 0 C--N 1.347 0.47 0 CA-C-O 121.075 0.464 . . . . 0.0 111.444 177.496 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 30.2 mt-30 -79.91 -21.13 44.3 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 121.218 0.533 . . . . 0.0 110.956 179.519 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 83.64 29.31 32.81 Favored Glycine 0 N--CA 1.448 -0.553 0 C-N-CA 121.005 -0.617 . . . . 0.0 112.24 178.313 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 28.8 m -130.62 151.59 78.98 Favored Pre-proline 0 C--N 1.323 -0.56 0 O-C-N 122.238 -0.566 . . . . 0.0 111.074 -177.824 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' PRO . . . . . 0.556 ' HG2' ' OG ' ' A' ' 61' ' ' SER . 19.2 Cg_endo -64.5 155.11 68.16 Favored 'Trans proline' 0 N--CA 1.455 -0.773 0 C-N-CA 122.301 2.001 . . . . 0.0 111.481 176.405 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.404 ' HG2' ' SG ' ' A' ' 52' ' ' CYS . 82.4 mtp -74.69 -8.77 57.41 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-O 121.146 0.498 . . . . 0.0 111.458 -176.101 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 29.9 p30 -91.58 -10.43 40.56 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 121.328 0.585 . . . . 0.0 110.749 -179.445 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.556 ' OG ' ' HG2' ' A' ' 58' ' ' PRO . 71.4 m -83.47 -24.8 31.64 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 121.175 0.512 . . . . 0.0 111.649 -179.106 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.537 HD11 ' SG ' ' A' ' 52' ' ' CYS . 1.4 pp -124.99 170.14 11.43 Favored 'General case' 0 C--N 1.302 -1.473 0 N-CA-C 112.685 0.624 . . . . 0.0 112.685 -175.629 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.532 ' O ' ' HA ' ' A' ' 90' ' ' VAL . 42.2 mtm180 -119.14 120.02 35.89 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.811 -0.632 . . . . 0.0 110.66 -178.223 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -102.61 114.76 29.25 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-O 121.124 0.488 . . . . 0.0 110.993 178.264 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.446 ' C ' HD22 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -143.72 162.91 34.77 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-O 121.39 0.614 . . . . 0.0 111.059 -179.854 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 85.9 t80 -144.61 134.15 23.35 Favored 'General case' 0 C--N 1.31 -1.137 0 CA-C-N 116.01 -0.541 . . . . 0.0 109.614 179.168 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.465 ' HG2' HE21 ' A' ' 69' ' ' GLN . 7.0 pt-20 49.31 26.85 1.69 Allowed 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 124.282 1.033 . . . . 0.0 112.562 179.964 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 87.25 22.81 42.99 Favored Glycine 0 N--CA 1.446 -0.653 0 C-N-CA 121.049 -0.596 . . . . 0.0 113.471 -179.683 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' GLN . . . . . 0.465 HE21 ' HG2' ' A' ' 67' ' ' GLU . 3.4 pt20 -130.06 138.2 50.62 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 179.198 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -72.34 146.75 46.89 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-O 121.28 0.562 . . . . 0.0 110.031 178.065 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.482 HG21 HD12 ' A' ' 44' ' ' LEU . 23.6 mm -94.94 122.27 46.24 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.255 0 CA-C-O 121.174 0.511 . . . . 0.0 110.546 -179.016 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -96.67 160.75 14.21 Favored 'General case' 0 N--CA 1.44 -0.949 0 N-CA-C 109.468 -0.567 . . . . 0.0 109.468 179.561 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' ASP . . . . . 0.452 ' CA ' ' HB3' ' A' ' 45' ' ' LYS . 11.6 p-10 -68.94 -21.9 64.17 Favored 'General case' 0 C--N 1.311 -1.08 0 CA-C-O 121.377 0.608 . . . . 0.0 111.04 -179.323 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 4.9 m-80 -96.8 1.86 51.23 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-O 121.209 0.528 . . . . 0.0 109.63 -179.721 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' HIS . . . . . 0.568 ' O ' ' HB2' ' A' ' 44' ' ' LEU . 2.8 m170 -81.29 146.32 30.46 Favored 'General case' 0 CA--C 1.501 -0.915 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 -179.234 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.48 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 72.7 p -118.48 153.83 52.08 Favored Pre-proline 0 C--N 1.302 -1.465 0 C-N-CA 121.038 -0.265 . . . . 0.0 110.699 178.383 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 22.1 Cg_endo -62.1 -37.92 60.21 Favored 'Trans proline' 0 N--CA 1.455 -0.783 0 C-N-CA 122.197 1.931 . . . . 0.0 111.395 -179.387 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' LYS . . . . . 0.536 ' HG3' ' N ' ' A' ' 79' ' ' GLU . 36.2 pttt -66.11 -41.52 90.46 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.917 0.389 . . . . 0.0 110.797 -179.652 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.536 ' N ' ' HG3' ' A' ' 78' ' ' LYS . 49.7 mm-40 -70.33 -35.9 73.92 Favored 'General case' 0 CA--C 1.515 -0.398 0 CA-C-O 121.023 0.44 . . . . 0.0 111.305 -178.63 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.51 HD21 ' CG ' ' A' ' 75' ' ' HIS . 5.2 mt -78.15 -8.02 57.77 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 120.514 -0.474 . . . . 0.0 110.712 179.843 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 84.07 38.98 9.61 Favored Glycine 0 C--N 1.321 -0.265 0 C-N-CA 120.965 -0.636 . . . . 0.0 112.777 177.905 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 61.6 mtt -100.87 162.34 12.97 Favored 'General case' 0 C--N 1.314 -0.946 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 179.193 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' GLU . . . . . 0.452 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 4.9 pt-20 -143.4 -171.83 3.58 Favored 'General case' 0 C--N 1.306 -1.303 0 N-CA-C 109.914 -0.402 . . . . 0.0 109.914 179.953 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -69.85 136.59 50.89 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.103 0.478 . . . . 0.0 111.235 -178.777 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 75.55 5.21 4.04 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.712 1.205 . . . . 0.0 111.285 179.306 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 86' ' ' ASP . . . . . 0.452 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 1.9 t0 -62.78 162.48 10.85 Favored 'General case' 0 C--O 1.238 0.495 0 CA-C-O 121.347 0.594 . . . . 0.0 111.065 177.719 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.428 ' HA ' ' O ' ' A' ' 25' ' ' LYS . 11.4 p -128.51 144.07 39.09 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.911 0 CA-C-O 121.383 0.611 . . . . 0.0 111.734 -176.82 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 3.6 mp -115.5 153.66 17.02 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.758 0 N-CA-C 108.728 -0.842 . . . . 0.0 108.728 178.518 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -107.85 139.44 42.44 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 121.195 0.521 . . . . 0.0 110.915 -176.836 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 90' ' ' VAL . . . . . 0.532 ' HA ' ' O ' ' A' ' 63' ' ' ARG . 63.3 t -128.77 133.47 66.25 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.023 0 CA-C-O 121.412 0.625 . . . . 0.0 110.949 179.844 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 86.7 m-85 -118.63 179.67 4.06 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-N 115.972 -0.558 . . . . 0.0 109.79 179.183 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 7.5 tp60 -109.47 131.84 54.69 Favored 'General case' 0 C--N 1.316 -0.871 0 O-C-N 122.267 -0.271 . . . . 0.0 110.763 179.207 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 93' ' ' GLU . . . . . 0.418 ' OE1' ' HG2' ' A' ' 63' ' ' ARG . 7.4 pt-20 -126.06 19.27 7.71 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-O 120.753 0.311 . . . . 0.0 110.691 177.899 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 97.7 mt-30 -54.31 -169.18 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.131 0 N-CA-C 113.128 0.788 . . . . 0.0 113.128 178.422 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 8.3 t -149.16 151.42 34.31 Favored 'General case' 0 C--N 1.315 -0.902 0 O-C-N 121.501 -0.749 . . . . 0.0 110.968 -174.928 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -146.88 44.84 0.8 Allowed Glycine 0 N--CA 1.441 -0.99 0 N-CA-C 111.389 -0.685 . . . . 0.0 111.389 -179.646 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.444 -0.814 0 CA-C-O 119.14 -0.811 . . . . 0.0 111.265 -179.763 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.63 ' HA ' ' OD2' ' A' ' 73' ' ' ASP . 79.1 mtp . . . . . 0 N--CA 1.478 0.952 0 CA-C-O 121.34 0.59 . . . . 0.0 111.13 . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 43.1 m -103.63 3.52 34.55 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-O 121.837 0.827 . . . . 0.0 110.199 -177.966 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -86.81 41.21 0.95 Allowed 'General case' 0 C--N 1.305 -1.341 0 CA-C-N 115.291 -0.868 . . . . 0.0 109.719 -178.259 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 5.7 pt20 -164.9 152.16 11.15 Favored 'General case' 0 N--CA 1.445 -0.712 0 CA-C-N 115.77 -0.65 . . . . 0.0 109.737 -176.426 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -170.29 -178.75 2.85 Favored 'General case' 0 C--N 1.317 -0.841 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 179.387 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -84.63 124.92 32.0 Favored 'General case' 0 N--CA 1.438 -1.045 0 N-CA-C 108.683 -0.858 . . . . 0.0 108.683 175.525 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 21.3 ptmt -114.96 150.04 43.49 Favored Pre-proline 0 C--N 1.301 -1.531 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.234 -176.178 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -60.3 144.97 99.5 Favored 'Trans proline' 0 N--CA 1.453 -0.897 0 C-N-CA 122.304 2.003 . . . . 0.0 111.351 -179.982 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 23.8 m 65.02 54.88 1.2 Allowed 'General case' 0 C--O 1.236 0.372 0 CA-C-O 121.608 0.718 . . . . 0.0 109.626 -177.723 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 4.7 m -71.58 136.16 47.3 Favored 'General case' 0 N--CA 1.443 -0.806 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.146 -178.76 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -137.61 96.93 3.33 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 121.201 0.524 . . . . 0.0 110.495 179.51 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -126.18 126.97 44.97 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.133 179.228 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 44.5 mt -96.75 142.5 28.69 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-O 121.549 0.69 . . . . 0.0 111.273 -176.916 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -116.81 60.59 0.43 Allowed Glycine 0 N--CA 1.439 -1.158 0 N-CA-C 111.349 -0.7 . . . . 0.0 111.349 179.242 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 42.9 m-20 -93.59 5.82 50.34 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-O 122.002 0.906 . . . . 0.0 110.588 -178.762 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.551 ' N ' ' HD2' ' A' ' 16' ' ' LYS . 0.2 OUTLIER -106.63 136.47 46.36 Favored 'General case' 0 C--N 1.303 -1.447 0 CA-C-N 115.154 -0.93 . . . . 0.0 108.892 178.619 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 22.3 mmtm -96.05 -168.57 1.78 Allowed 'General case' 0 C--N 1.31 -1.15 0 CA-C-O 121.499 0.666 . . . . 0.0 112.615 -175.984 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.559 ' HB2' ' CE1' ' A' ' 21' ' ' TYR . 10.0 pt-20 -90.16 -166.84 1.68 Allowed 'General case' 0 N--CA 1.445 -0.721 0 CA-C-N 115.481 -0.782 . . . . 0.0 111.151 -176.988 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.492 ' H ' ' HD1' ' A' ' 21' ' ' TYR . . . 117.17 130.06 4.34 Favored Glycine 0 N--CA 1.438 -1.189 0 N-CA-C 111.543 -0.623 . . . . 0.0 111.543 -177.375 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.411 ' HB2' ' O ' ' A' ' 19' ' ' GLY . 1.6 mp0 70.56 34.11 2.22 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 122.819 0.448 . . . . 0.0 110.981 178.934 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.559 ' CE1' ' HB2' ' A' ' 18' ' ' GLU . 44.4 p90 -121.62 164.03 17.98 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 121.561 0.696 . . . . 0.0 111.719 -177.818 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.499 ' HB ' ' HA ' ' A' ' 84' ' ' GLU . 25.9 pt -119.99 172.37 7.16 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.214 0 CA-C-N 115.114 -0.948 . . . . 0.0 109.79 176.697 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.507 ' HE3' ' HG3' ' A' ' 85' ' ' GLU . 0.0 OUTLIER -117.43 149.03 41.24 Favored 'General case' 0 C--N 1.293 -1.872 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 -179.156 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -142.04 158.41 43.79 Favored 'General case' 0 C--N 1.3 -1.581 0 CA-C-O 121.406 0.622 . . . . 0.0 111.477 175.201 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 5.3 tmmm? -128.73 141.97 51.15 Favored 'General case' 0 N--CA 1.436 -1.158 0 CA-C-N 115.604 -0.725 . . . . 0.0 110.225 179.945 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.542 ' O ' ' HA ' ' A' ' 33' ' ' GLU . 0.9 OUTLIER -112.92 142.35 25.59 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.442 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.293 -179.372 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.464 ' O ' ' HB ' ' A' ' 90' ' ' VAL . 44.6 mm -103.92 115.22 45.45 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.359 0 N-CA-C 106.83 -1.544 . . . . 0.0 106.83 173.562 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 28' ' ' GLY . . . . . 0.439 ' HA2' ' HB ' ' A' ' 90' ' ' VAL . . . -86.26 161.64 34.41 Favored Glycine 0 N--CA 1.422 -2.256 0 C-N-CA 120.022 -1.085 . . . . 0.0 111.185 -175.971 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.17 -24.08 62.77 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-O 121.417 0.627 . . . . 0.0 111.081 176.556 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -96.9 20.1 11.63 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 121.504 0.669 . . . . 0.0 109.658 178.774 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 43.2 m 64.28 17.61 10.83 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-O 121.84 0.829 . . . . 0.0 110.53 -179.101 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 10.6 t -76.8 108.78 10.06 Favored 'General case' 0 N--CA 1.444 -0.734 0 CA-C-N 115.152 -0.931 . . . . 0.0 110.222 -179.372 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.542 ' HA ' ' O ' ' A' ' 26' ' ' VAL . 41.9 mt-10 -87.15 109.79 19.69 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 121.363 0.602 . . . . 0.0 109.943 178.38 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 33.5 mm -100.9 139.11 23.02 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.431 0 CA-C-N 116.037 -0.529 . . . . 0.0 109.596 -178.756 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 12.2 m170 -117.34 132.4 56.6 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 109.395 -0.595 . . . . 0.0 109.395 179.851 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.518 ' HZ ' HG23 ' A' ' 26' ' ' VAL . 1.3 p90 -147.61 163.9 35.16 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-O 121.216 0.532 . . . . 0.0 111.603 -178.668 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.473 ' HD3' ' CE2' ' A' ' 21' ' ' TYR . 88.1 mttt -119.66 119.47 33.8 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.66 -179.123 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.444 HG21 HD12 ' A' ' 47' ' ' LEU . 35.7 m -138.81 157.93 29.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-O 120.911 0.386 . . . . 0.0 110.276 178.904 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.434 ' HA ' ' HA ' ' A' ' 21' ' ' TYR . 47.5 mtpt -83.12 178.14 8.25 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-O 121.45 0.643 . . . . 0.0 111.426 179.073 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -87.26 -31.17 20.4 Favored 'General case' 0 C--N 1.313 -1.01 0 CA-C-O 121.371 0.605 . . . . 0.0 110.144 178.04 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 9.0 t -98.78 19.71 14.36 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.312 -177.268 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 10.0 t -105.54 176.01 5.31 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 178.678 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 53.0 m170 -91.76 147.34 23.06 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-O 121.432 0.634 . . . . 0.0 111.387 -179.426 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.613 ' HB2' ' O ' ' A' ' 75' ' ' HIS . 0.2 OUTLIER -74.58 -12.61 60.5 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 115.53 -0.759 . . . . 0.0 109.226 179.113 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.76 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -57.15 -45.11 83.88 Favored 'General case' 0 N--CA 1.442 -0.825 0 CA-C-N 115.563 -0.744 . . . . 0.0 111.899 -178.55 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.425 ' HG3' ' N ' ' A' ' 47' ' ' LEU . 19.4 ptpt -65.85 -32.1 73.43 Favored 'General case' 0 CA--C 1.508 -0.651 0 CA-C-O 121.695 0.759 . . . . 0.0 109.883 -178.888 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.536 ' HB3' HD13 ' A' ' 44' ' ' LEU . 8.2 tt -71.05 -51.55 24.65 Favored 'General case' 0 N--CA 1.428 -1.553 0 CA-C-N 115.197 -0.911 . . . . 0.0 110.738 -176.724 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.463 ' HA ' ' CD2' ' A' ' 51' ' ' TYR . 6.4 ptmm? -61.19 -41.01 96.04 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.721 -178.017 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.76 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 8.8 pt-20 -72.46 -30.92 65.0 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-O 121.029 0.443 . . . . 0.0 110.703 178.012 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.579 ' O ' ' HG2' ' A' ' 54' ' ' ARG . 32.7 t -68.71 -44.73 73.31 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.945 0.402 . . . . 0.0 111.677 -178.632 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.468 ' CD1' HG11 ' A' ' 26' ' ' VAL . 2.3 p90 -75.06 -32.82 61.61 Favored 'General case' 0 N--CA 1.446 -0.657 0 C-N-CA 119.512 -0.875 . . . . 0.0 110.176 -178.09 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 52' ' ' CYS . . . . . 0.524 ' SG ' HD11 ' A' ' 62' ' ' LEU . 83.5 m -59.8 -43.94 94.2 Favored 'General case' 0 C--O 1.238 0.454 0 CA-C-O 120.938 0.399 . . . . 0.0 110.703 177.985 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 11.9 pt20 -69.94 -33.69 72.47 Favored 'General case' 0 N--CA 1.447 -0.622 0 C-N-CA 120.769 -0.373 . . . . 0.0 110.617 -179.213 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.579 ' HG2' ' O ' ' A' ' 50' ' ' SER . 9.3 mmp_? -54.78 -40.99 69.99 Favored 'General case' 0 C--N 1.351 0.634 0 CA-C-O 121.403 0.62 . . . . 0.0 110.607 176.192 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 29.4 mt-30 -78.45 -21.48 49.05 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.747 179.6 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 81.74 27.48 46.4 Favored Glycine 0 N--CA 1.443 -0.887 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.223 179.276 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 33.9 m -127.18 148.1 64.62 Favored Pre-proline 0 C--N 1.321 -0.666 0 O-C-N 122.505 -0.409 . . . . 0.0 110.283 -179.145 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' PRO . . . . . 0.471 ' HG2' ' OG ' ' A' ' 61' ' ' SER . 26.0 Cg_endo -64.87 150.52 88.01 Favored 'Trans proline' 0 N--CA 1.457 -0.647 0 C-N-CA 122.278 1.985 . . . . 0.0 111.999 178.632 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.415 ' HG2' ' SG ' ' A' ' 52' ' ' CYS . 66.2 mtp -69.06 -9.11 50.97 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.231 0.538 . . . . 0.0 111.721 -176.905 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 28.8 p30 -88.82 -12.88 40.72 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-O 121.214 0.53 . . . . 0.0 111.33 -178.751 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.471 ' OG ' ' HG2' ' A' ' 58' ' ' PRO . 55.6 m -88.06 -19.08 27.59 Favored 'General case' 0 C--N 1.316 -0.878 0 N-CA-C 112.654 0.613 . . . . 0.0 112.654 -177.738 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.524 HD11 ' SG ' ' A' ' 52' ' ' CYS . 1.5 pp -132.4 159.96 37.74 Favored 'General case' 0 C--N 1.315 -0.934 0 N-CA-C 113.413 0.894 . . . . 0.0 113.413 -177.386 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.484 ' O ' ' HA ' ' A' ' 90' ' ' VAL . 50.0 mtm-85 -107.86 124.87 50.73 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 114.903 -1.044 . . . . 0.0 111.741 -177.997 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -106.09 117.26 33.56 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.545 178.329 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.472 ' C ' HD22 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -143.01 160.85 39.57 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-O 121.362 0.601 . . . . 0.0 111.161 179.951 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 90.7 t80 -141.35 134.26 28.96 Favored 'General case' 0 C--N 1.31 -1.118 0 N-CA-C 109.033 -0.729 . . . . 0.0 109.033 178.775 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.478 ' HG2' HE21 ' A' ' 69' ' ' GLN . 6.4 pt-20 50.04 26.75 2.19 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 124.124 0.97 . . . . 0.0 112.33 -179.16 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 85.02 25.03 42.22 Favored Glycine 0 N--CA 1.447 -0.627 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.948 -178.833 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' GLN . . . . . 0.478 HE21 ' HG2' ' A' ' 67' ' ' GLU . 3.3 pt20 -130.86 136.71 48.9 Favored 'General case' 0 C--N 1.322 -0.619 0 O-C-N 122.074 -0.663 . . . . 0.0 109.888 179.279 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.435 ' HD3' ' N ' ' A' ' 70' ' ' ARG . 0.0 OUTLIER -66.72 146.88 53.98 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-O 121.336 0.588 . . . . 0.0 110.557 178.067 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.483 HG21 HD12 ' A' ' 44' ' ' LEU . 20.9 mm -101.45 118.05 47.64 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.133 0 CA-C-O 120.89 0.376 . . . . 0.0 110.264 -179.535 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -99.65 167.34 10.63 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-O 120.882 0.373 . . . . 0.0 110.365 -179.517 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' ASP . . . . . 0.63 ' OD2' ' HA ' ' A' ' 1' ' ' MET . 7.8 p-10 -67.92 -22.1 65.09 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-O 121.194 0.521 . . . . 0.0 111.391 -179.618 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 8.0 m-80 -98.56 1.09 46.15 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-O 121.338 0.589 . . . . 0.0 110.076 -178.324 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' HIS . . . . . 0.613 ' O ' ' HB2' ' A' ' 44' ' ' LEU . 2.1 m170 -80.8 142.71 33.46 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 -179.512 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.47 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 81.0 p -116.96 153.25 49.44 Favored Pre-proline 0 C--N 1.306 -1.302 0 CA-C-N 116.79 -0.186 . . . . 0.0 111.29 -179.949 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_exo -58.2 -39.68 82.89 Favored 'Trans proline' 0 C--N 1.347 0.484 0 C-N-CA 122.492 2.128 . . . . 0.0 111.586 178.809 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' LYS . . . . . 0.518 ' HG3' ' N ' ' A' ' 79' ' ' GLU . 32.7 pttt -67.39 -39.61 85.62 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.082 -178.379 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.518 ' N ' ' HG3' ' A' ' 78' ' ' LYS . 45.9 mm-40 -73.31 -35.66 66.11 Favored 'General case' 0 CA--C 1.511 -0.553 0 CA-C-O 121.166 0.508 . . . . 0.0 110.936 -179.206 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.486 HD21 ' CG ' ' A' ' 75' ' ' HIS . 5.4 mt -81.1 -3.93 53.6 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.074 0.464 . . . . 0.0 110.96 -179.456 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 75.45 48.1 11.32 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.972 -0.632 . . . . 0.0 112.813 177.738 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 63.5 mtt -105.64 161.13 14.65 Favored 'General case' 0 C--N 1.315 -0.929 0 N-CA-C 110.023 -0.362 . . . . 0.0 110.023 178.83 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 14.2 pt-20 -143.04 -173.03 3.8 Favored 'General case' 0 C--N 1.317 -0.841 0 N-CA-C 109.917 -0.401 . . . . 0.0 109.917 179.134 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.499 ' HA ' ' HB ' ' A' ' 22' ' ' ILE . 11.6 pt-20 -68.33 126.46 29.66 Favored 'General case' 0 N--CA 1.447 -0.584 0 CA-C-O 121.466 0.65 . . . . 0.0 111.68 -179.188 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 85' ' ' GLU . . . . . 0.507 ' HG3' ' HE3' ' A' ' 23' ' ' LYS . 33.5 mt-10 77.54 8.39 2.66 Favored 'General case' 0 C--N 1.322 -0.625 0 C-N-CA 124.723 1.209 . . . . 0.0 112.738 177.19 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -63.42 167.15 5.69 Favored 'General case' 0 C--O 1.239 0.539 0 CA-C-O 121.082 0.468 . . . . 0.0 110.302 174.754 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 15.0 p -125.9 143.93 37.73 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.036 0 CA-C-O 121.516 0.674 . . . . 0.0 111.752 -176.153 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 88' ' ' ILE . . . . . 0.425 ' HB ' HG22 ' A' ' 26' ' ' VAL . 2.3 mt -111.86 152.96 13.63 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 N-CA-C 108.836 -0.801 . . . . 0.0 108.836 177.646 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.404 ' O ' HD13 ' A' ' 65' ' ' LEU . 9.5 tp10 -106.64 137.44 44.65 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-O 120.924 0.392 . . . . 0.0 110.58 -177.38 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 90' ' ' VAL . . . . . 0.484 ' HA ' ' O ' ' A' ' 63' ' ' ARG . 90.2 t -129.02 133.4 66.08 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-O 121.317 0.58 . . . . 0.0 111.454 178.667 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 82.1 m-85 -118.92 178.41 4.5 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.375 179.429 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 9.5 tp60 -105.15 135.95 45.54 Favored 'General case' 0 C--N 1.31 -1.124 0 O-C-N 122.241 -0.287 . . . . 0.0 110.623 -179.281 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -127.84 21.68 6.38 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.262 0.553 . . . . 0.0 110.403 176.358 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 98.1 mt-30 -55.33 -178.35 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.554 0 CA-C-N 115.745 -0.661 . . . . 0.0 111.816 176.778 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 7.1 t -85.7 133.18 34.03 Favored 'General case' 0 C--N 1.305 -1.346 0 CA-C-O 121.477 0.656 . . . . 0.0 111.27 -173.674 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -104.35 51.3 0.81 Allowed Glycine 0 N--CA 1.44 -1.043 0 C-N-CA 120.983 -0.627 . . . . 0.0 111.64 179.181 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.003 0 CA-C-O 118.645 -1.086 . . . . 0.0 111.768 -179.787 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.2 mpt? . . . . . 0 N--CA 1.48 1.071 0 CA-C-O 121.311 0.577 . . . . 0.0 110.601 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 16.9 p -95.12 7.33 46.48 Favored 'General case' 0 C--N 1.312 -1.024 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.819 -177.969 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 35.7 t70 66.0 80.43 0.22 Allowed 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 121.982 0.896 . . . . 0.0 109.544 -177.153 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' GLN . . . . . 0.436 ' H ' ' HG2' ' A' ' 4' ' ' GLN . 7.3 pt20 -93.99 145.52 24.59 Favored 'General case' 0 C--N 1.303 -1.443 0 CA-C-N 115.32 -0.854 . . . . 0.0 111.035 -177.113 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -82.52 -176.28 6.16 Favored 'General case' 0 C--N 1.309 -1.173 0 CA-C-O 121.368 0.604 . . . . 0.0 111.646 -177.803 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -115.57 143.83 44.76 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.837 -0.619 . . . . 0.0 109.91 -179.353 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -137.94 157.97 72.19 Favored Pre-proline 0 N--CA 1.437 -1.085 0 N-CA-C 109.919 -0.4 . . . . 0.0 109.919 -178.051 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -57.98 149.65 69.26 Favored 'Trans proline' 0 C--O 1.234 0.322 0 C-N-CA 122.718 2.279 . . . . 0.0 112.048 179.534 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 10.4 p -97.31 4.42 50.84 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-O 121.529 0.68 . . . . 0.0 111.118 -178.63 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 12.7 t -169.15 179.14 4.11 Favored 'General case' 0 C--N 1.317 -0.848 0 CA-C-N 115.886 -0.597 . . . . 0.0 109.554 178.296 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.6 tm-20 -137.79 109.38 7.01 Favored 'General case' 0 C--N 1.315 -0.902 0 N-CA-C 109.602 -0.518 . . . . 0.0 109.602 -179.464 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -145.92 164.83 30.77 Favored 'General case' 0 C--N 1.317 -0.843 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 -178.342 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 1.9 pp -158.84 158.94 34.44 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.185 0.516 . . . . 0.0 111.608 -179.767 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -142.3 49.22 0.75 Allowed Glycine 0 N--CA 1.446 -0.655 0 C-N-CA 121.094 -0.574 . . . . 0.0 112.046 178.644 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -60.06 145.14 47.6 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.213 0.53 . . . . 0.0 111.225 179.863 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 73.7 mmtt -99.27 151.52 20.94 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-O 120.933 0.397 . . . . 0.0 110.45 -178.875 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 21.1 ptmt -81.18 151.72 28.07 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 121.243 0.544 . . . . 0.0 110.823 -178.756 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -90.77 -175.24 4.32 Favored 'General case' 0 C--N 1.31 -1.127 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.726 177.644 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -150.85 -109.6 0.46 Allowed Glycine 0 N--CA 1.44 -1.045 0 C-N-CA 120.46 -0.876 . . . . 0.0 112.538 -179.861 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 22.6 mt-10 -114.44 6.79 16.08 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 121.201 0.524 . . . . 0.0 110.242 -178.354 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.459 ' CE1' ' HD3' ' A' ' 37' ' ' LYS . 35.0 p90 -89.39 166.11 13.93 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-O 121.591 0.71 . . . . 0.0 112.539 -174.458 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.4 ' HB ' ' HA ' ' A' ' 84' ' ' GLU . 24.0 pt -118.92 172.27 6.25 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.917 0 CA-C-N 115.128 -0.942 . . . . 0.0 109.395 177.284 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 45.3 mtmt -115.75 142.54 46.61 Favored 'General case' 0 C--N 1.294 -1.827 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 -179.509 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.4 mp -136.21 162.59 32.55 Favored 'General case' 0 C--N 1.302 -1.473 0 CA-C-O 121.098 0.475 . . . . 0.0 110.445 175.257 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.45 ' HE2' ' HB3' ' A' ' 25' ' ' LYS . 5.3 tmmm? -133.62 143.59 48.72 Favored 'General case' 0 C--N 1.308 -1.211 0 CA-C-O 121.403 0.621 . . . . 0.0 110.592 -178.786 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.511 HG23 ' HZ ' ' A' ' 36' ' ' PHE . 0.9 OUTLIER -115.0 143.33 24.98 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.454 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.046 -179.896 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.421 ' O ' ' HB ' ' A' ' 90' ' ' VAL . 45.4 mm -107.61 116.57 51.42 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.022 0 N-CA-C 107.683 -1.228 . . . . 0.0 107.683 175.392 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' GLY . . . . . 0.453 ' HA2' ' HB ' ' A' ' 90' ' ' VAL . . . -84.65 175.44 50.68 Favored Glycine 0 N--CA 1.419 -2.488 0 C-N-CA 120.158 -1.02 . . . . 0.0 111.834 -177.312 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.57 -22.18 63.55 Favored 'General case' 0 C--N 1.302 -1.476 0 CA-C-O 121.626 0.727 . . . . 0.0 110.324 179.906 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -100.57 13.73 33.71 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.693 -0.685 . . . . 0.0 109.219 178.523 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 19.3 m 71.49 15.59 6.11 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 115.376 -0.829 . . . . 0.0 111.319 179.265 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 10.9 t -72.35 114.59 10.63 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 109.697 -0.482 . . . . 0.0 109.697 179.199 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.445 ' HA ' ' O ' ' A' ' 26' ' ' VAL . 34.5 mt-10 -87.55 108.62 19.14 Favored 'General case' 0 CA--C 1.509 -0.61 0 CA-C-O 121.164 0.507 . . . . 0.0 110.42 179.187 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.437 HG21 ' HA ' ' A' ' 51' ' ' TYR . 38.9 mm -97.88 137.69 24.76 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.589 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 179.206 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 12.4 m170 -115.97 136.56 52.92 Favored 'General case' 0 C--N 1.315 -0.918 0 N-CA-C 109.3 -0.63 . . . . 0.0 109.3 -179.045 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.511 ' HZ ' HG23 ' A' ' 26' ' ' VAL . 0.5 OUTLIER -147.28 155.66 42.24 Favored 'General case' 0 C--N 1.308 -1.196 0 CA-C-O 121.309 0.576 . . . . 0.0 111.275 -178.501 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.459 ' HD3' ' CE1' ' A' ' 21' ' ' TYR . 93.4 mttt -113.67 113.37 24.92 Favored 'General case' 0 C--N 1.31 -1.13 0 CA-C-N 115.723 -0.672 . . . . 0.0 109.999 -179.177 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.416 HG21 HD12 ' A' ' 47' ' ' LEU . 28.2 m -134.91 158.18 41.28 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.768 0 CA-C-O 120.87 0.367 . . . . 0.0 110.069 -179.792 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.533 ' O ' HG22 ' A' ' 42' ' ' THR . 80.8 tttt -90.33 165.13 14.05 Favored 'General case' 0 C--N 1.311 -1.066 0 O-C-N 121.822 -0.549 . . . . 0.0 110.683 -179.021 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -70.14 -37.02 75.16 Favored 'General case' 0 N--CA 1.463 0.224 0 O-C-N 121.969 -0.457 . . . . 0.0 111.854 -177.771 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 14.5 t -97.13 19.09 13.51 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-O 120.939 0.4 . . . . 0.0 111.93 -176.471 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' THR . . . . . 0.533 HG22 ' O ' ' A' ' 39' ' ' LYS . 3.4 t -100.24 167.64 10.3 Favored 'General case' 0 C--N 1.323 -0.561 0 O-C-N 121.797 -0.564 . . . . 0.0 109.72 178.855 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 37.3 m170 -82.16 141.77 32.78 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 121.576 0.703 . . . . 0.0 111.459 179.903 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.645 HD13 ' HB3' ' A' ' 47' ' ' LEU . 0.2 OUTLIER -70.84 -13.88 62.2 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.459 -0.791 . . . . 0.0 109.731 -179.741 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.728 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -54.59 -43.65 72.34 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 115.787 -0.642 . . . . 0.0 112.009 -179.31 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.434 ' N ' ' HD3' ' A' ' 45' ' ' LYS . 21.9 ptmt -69.23 -28.4 66.31 Favored 'General case' 0 C--O 1.201 -1.451 0 CA-C-O 120.911 0.386 . . . . 0.0 110.462 -179.158 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.645 ' HB3' HD13 ' A' ' 44' ' ' LEU . 8.4 tt -74.36 -49.34 23.14 Favored 'General case' 0 C--N 1.302 -1.459 0 CA-C-O 120.994 0.426 . . . . 0.0 110.631 -178.855 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.453 ' HA ' ' CD2' ' A' ' 51' ' ' TYR . 6.8 ptmm? -62.6 -43.17 99.47 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.328 -0.397 . . . . 0.0 111.404 -177.555 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.728 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 8.1 pt-20 -70.8 -33.47 70.76 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-O 121.021 0.439 . . . . 0.0 110.626 178.139 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.673 ' O ' ' HG2' ' A' ' 54' ' ' ARG . 10.5 m -67.81 -41.87 82.42 Favored 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 -178.122 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.505 ' CD1' HG11 ' A' ' 26' ' ' VAL . 3.4 p90 -76.68 -33.09 58.27 Favored 'General case' 0 C--N 1.32 -0.707 0 C-N-CA 119.129 -1.029 . . . . 0.0 110.392 -178.532 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 52' ' ' CYS . . . . . 0.593 ' SG ' HD11 ' A' ' 62' ' ' LEU . 90.6 m -62.42 -44.89 95.34 Favored 'General case' 0 CA--C 1.509 -0.625 0 CA-C-O 121.296 0.57 . . . . 0.0 110.465 179.419 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 53' ' ' GLN . . . . . 0.438 ' HG2' ' O ' ' A' ' 50' ' ' SER . 13.8 pt20 -67.23 -33.83 76.19 Favored 'General case' 0 N--CA 1.44 -0.953 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.743 -179.392 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.673 ' HG2' ' O ' ' A' ' 50' ' ' SER . 40.4 mmt180 -56.59 -44.4 81.04 Favored 'General case' 0 C--N 1.351 0.638 0 CA-C-O 121.368 0.604 . . . . 0.0 110.434 177.002 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 37.1 mt-30 -73.38 -20.82 60.66 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.736 -0.666 . . . . 0.0 111.462 -179.555 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 79.66 33.37 34.5 Favored Glycine 0 N--CA 1.448 -0.547 0 C-N-CA 120.675 -0.774 . . . . 0.0 111.765 -179.758 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 29.1 m -132.93 151.28 77.72 Favored Pre-proline 0 C--O 1.24 0.565 0 O-C-N 122.532 -0.393 . . . . 0.0 110.518 -179.298 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' PRO . . . . . 0.463 ' HG2' ' OG ' ' A' ' 61' ' ' SER . 40.9 Cg_endo -69.62 148.93 67.08 Favored 'Trans proline' 0 N--CA 1.459 -0.555 0 C-N-CA 122.506 2.138 . . . . 0.0 112.307 179.065 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.526 ' HG2' ' SG ' ' A' ' 52' ' ' CYS . 72.8 mtp -71.22 -11.28 60.84 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.602 -0.726 . . . . 0.0 111.637 -177.382 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 24.7 p30 -88.02 -12.2 45.09 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-O 121.311 0.577 . . . . 0.0 111.461 -179.191 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.463 ' OG ' ' HG2' ' A' ' 58' ' ' PRO . 66.4 m -90.49 -20.85 22.23 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-O 120.928 0.394 . . . . 0.0 111.951 -179.585 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.593 HD11 ' SG ' ' A' ' 52' ' ' CYS . 2.0 pp -123.32 164.99 17.75 Favored 'General case' 0 C--N 1.313 -0.986 0 N-CA-C 113.031 0.752 . . . . 0.0 113.031 -177.796 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.532 ' O ' ' HA ' ' A' ' 90' ' ' VAL . 5.8 mtp180 -114.47 123.13 48.64 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.538 -0.755 . . . . 0.0 110.585 -178.691 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.461 ' HB3' ' OH ' ' A' ' 51' ' ' TYR . 0.2 OUTLIER -104.27 113.48 27.06 Favored 'General case' 0 C--N 1.307 -1.278 0 CA-C-O 120.986 0.422 . . . . 0.0 110.145 176.53 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.446 ' C ' HD22 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -142.79 165.13 28.21 Favored 'General case' 0 N--CA 1.438 -1.068 0 CA-C-O 121.634 0.73 . . . . 0.0 111.88 -179.144 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 92.3 t80 -145.44 134.76 23.0 Favored 'General case' 0 C--N 1.305 -1.361 0 N-CA-C 108.542 -0.91 . . . . 0.0 108.542 178.537 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.448 ' HG2' HE21 ' A' ' 69' ' ' GLN . 5.3 pt-20 50.24 26.7 2.3 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 124.359 1.064 . . . . 0.0 112.204 -177.927 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 86.79 17.5 59.72 Favored Glycine 0 CA--C 1.519 0.287 0 C-N-CA 120.781 -0.723 . . . . 0.0 113.314 -178.803 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' GLN . . . . . 0.448 HE21 ' HG2' ' A' ' 67' ' ' GLU . 2.9 pt20 -124.39 134.65 53.06 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 -179.74 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -70.25 146.7 50.47 Favored 'General case' 0 C--N 1.312 -1.032 0 CA-C-O 121.376 0.608 . . . . 0.0 110.301 178.017 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.501 HG21 HD12 ' A' ' 44' ' ' LEU . 22.7 mm -94.36 122.76 46.11 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.55 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.283 -178.557 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -98.79 166.75 11.16 Favored 'General case' 0 N--CA 1.439 -0.978 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 -179.499 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -67.55 -26.0 66.09 Favored 'General case' 0 C--N 1.313 -1.001 0 CA-C-O 121.265 0.555 . . . . 0.0 111.259 -178.421 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 8.1 m-80 -97.23 4.99 50.79 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-O 121.327 0.584 . . . . 0.0 110.097 -177.799 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' HIS . . . . . 0.603 ' O ' ' HB2' ' A' ' 44' ' ' LEU . 2.5 m170 -83.68 145.94 28.51 Favored 'General case' 0 CA--C 1.507 -0.71 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 179.232 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.42 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 43.7 p -122.81 158.76 56.12 Favored Pre-proline 0 C--N 1.31 -1.119 0 C-N-CA 121.012 -0.275 . . . . 0.0 110.742 179.003 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_exo -60.81 -40.54 53.09 Favored 'Trans proline' 0 N--CA 1.457 -0.627 0 C-N-CA 122.538 2.159 . . . . 0.0 111.604 179.054 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' LYS . . . . . 0.521 ' HG3' ' N ' ' A' ' 79' ' ' GLU . 20.7 pttt -68.99 -36.75 78.18 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.947 0.404 . . . . 0.0 110.992 -177.935 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.521 ' N ' ' HG3' ' A' ' 78' ' ' LYS . 52.5 mm-40 -69.84 -40.56 75.74 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-O 120.921 0.391 . . . . 0.0 110.636 -179.243 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.42 ' HG ' ' O ' ' A' ' 76' ' ' THR . 5.4 mt -79.74 -6.71 57.78 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.25 0.548 . . . . 0.0 110.864 -178.985 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 80.45 45.14 8.17 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.967 -0.635 . . . . 0.0 113.01 177.794 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 59.5 mtt -102.7 163.33 12.28 Favored 'General case' 0 C--N 1.317 -0.806 0 N-CA-C 109.755 -0.461 . . . . 0.0 109.755 178.388 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -136.93 -172.45 3.19 Favored 'General case' 0 C--N 1.312 -1.045 0 CA-C-O 120.884 0.373 . . . . 0.0 110.01 179.113 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.4 ' HA ' ' HB ' ' A' ' 22' ' ' ILE . 12.6 pt-20 -70.43 141.47 52.1 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 177.738 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 73.78 1.93 4.07 Favored 'General case' 0 CA--C 1.552 1.05 0 C-N-CA 123.826 0.851 . . . . 0.0 111.283 179.868 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -63.91 161.77 15.03 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-O 121.269 0.557 . . . . 0.0 110.97 179.123 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.421 ' HA ' ' O ' ' A' ' 25' ' ' LYS . 8.6 p -127.64 142.88 42.43 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.079 0 CA-C-O 121.418 0.627 . . . . 0.0 111.505 -176.302 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 3.7 mp -112.57 152.93 14.27 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.855 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 178.667 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.407 ' O ' HD13 ' A' ' 65' ' ' LEU . 7.2 tp10 -105.43 137.49 43.17 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-O 120.969 0.414 . . . . 0.0 110.484 -175.785 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 90' ' ' VAL . . . . . 0.532 ' HA ' ' O ' ' A' ' 63' ' ' ARG . 78.4 t -128.75 135.7 61.64 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.887 0 CA-C-O 121.259 0.552 . . . . 0.0 110.793 179.16 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 91.8 m-85 -122.71 177.84 5.28 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.201 179.155 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 9.6 tp60 -108.44 121.32 44.7 Favored 'General case' 0 C--N 1.312 -1.051 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 179.553 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 93' ' ' GLU . . . . . 0.466 ' HB3' ' CG ' ' A' ' 63' ' ' ARG . 9.3 pt-20 -110.26 19.74 18.56 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-O 121.022 0.439 . . . . 0.0 111.068 179.991 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 21.8 mt-30 -61.92 -166.52 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.742 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.332 175.812 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 10.1 t -149.66 133.09 16.59 Favored 'General case' 0 C--N 1.313 -1.009 0 O-C-N 120.963 -1.086 . . . . 0.0 111.615 -177.291 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -89.96 -17.32 54.21 Favored Glycine 0 N--CA 1.439 -1.142 0 N-CA-C 110.843 -0.903 . . . . 0.0 110.843 176.899 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.434 -1.436 0 CA-C-O 118.499 -1.167 . . . . 0.0 111.319 179.084 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 58.3 ttp . . . . . 0 N--CA 1.477 0.911 0 CA-C-O 120.474 0.178 . . . . 0.0 110.755 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 33.4 t 75.82 -18.26 0.47 Allowed 'General case' 0 CA--C 1.548 0.899 0 N-CA-C 113.802 1.038 . . . . 0.0 113.802 175.926 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -114.14 -6.57 13.06 Favored 'General case' 0 C--N 1.323 -0.57 0 O-C-N 121.468 -0.77 . . . . 0.0 111.742 -177.968 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 41.8 mt-30 -81.18 111.96 18.08 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.313 0.578 . . . . 0.0 111.563 -178.318 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -143.64 -170.04 3.21 Favored 'General case' 0 C--N 1.31 -1.145 0 CA-C-N 116.092 -0.504 . . . . 0.0 109.76 178.018 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -138.05 175.11 9.87 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-O 120.974 0.416 . . . . 0.0 111.045 -177.925 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -159.01 151.26 17.55 Favored Pre-proline 0 C--N 1.318 -0.773 0 CA-C-N 116.07 -0.514 . . . . 0.0 109.81 178.069 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 29.9 Cg_endo -63.97 144.95 89.28 Favored 'Trans proline' 0 N--CA 1.461 -0.412 0 C-N-CA 122.387 2.058 . . . . 0.0 111.849 179.806 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 19.8 p -126.96 -11.25 5.97 Favored 'General case' 0 C--N 1.31 -1.129 0 CA-C-O 121.358 0.599 . . . . 0.0 110.566 -179.886 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 17.0 m -154.32 130.97 10.7 Favored 'General case' 0 N--CA 1.445 -0.675 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 179.254 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -69.9 126.9 31.08 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 121.13 0.491 . . . . 0.0 109.685 177.922 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -144.05 86.67 1.86 Allowed 'General case' 0 C--N 1.313 -1.007 0 CA-C-O 121.414 0.626 . . . . 0.0 109.859 -179.501 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.407 ' HG ' ' H ' ' A' ' 13' ' ' LEU . 0.9 OUTLIER -71.67 156.0 39.86 Favored 'General case' 0 N--CA 1.429 -1.48 0 CA-C-N 115.56 -0.746 . . . . 0.0 110.931 179.736 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -161.76 68.31 0.24 Allowed Glycine 0 N--CA 1.431 -1.643 0 C-N-CA 120.452 -0.88 . . . . 0.0 112.344 -178.877 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 24.1 m-20 -136.12 33.58 2.85 Favored 'General case' 0 CA--C 1.506 -0.745 0 CA-C-O 121.876 0.846 . . . . 0.0 109.666 179.914 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 5.5 mtpm? -130.83 -172.38 2.8 Favored 'General case' 0 C--N 1.311 -1.096 0 CA-C-N 115.298 -0.865 . . . . 0.0 109.699 -178.248 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 20.6 ptmt -81.23 -177.85 6.65 Favored 'General case' 0 C--N 1.315 -0.923 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 174.851 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.482 ' OE2' ' HD3' ' A' ' 37' ' ' LYS . 7.4 pt-20 -169.11 162.47 10.85 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.198 0.523 . . . . 0.0 111.996 -175.593 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -173.13 170.6 43.75 Favored Glycine 0 N--CA 1.439 -1.107 0 N-CA-C 111.038 -0.825 . . . . 0.0 111.038 179.352 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 64.5 24.39 13.09 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-O 121.164 0.507 . . . . 0.0 111.547 178.603 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 54.9 p90 -109.37 175.69 5.36 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-O 120.932 0.396 . . . . 0.0 110.494 -179.387 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.418 HD13 ' HG2' ' A' ' 40' ' ' MET . 23.0 pt -125.85 171.18 14.88 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.903 0 CA-C-O 121.39 0.614 . . . . 0.0 110.446 177.905 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.414 ' HE3' ' HB2' ' A' ' 23' ' ' LYS . 40.8 mtmt -119.11 142.07 48.23 Favored 'General case' 0 C--N 1.304 -1.406 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 -179.367 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.5 mp -136.04 164.11 28.77 Favored 'General case' 0 C--N 1.304 -1.411 0 CA-C-O 121.268 0.556 . . . . 0.0 110.811 176.097 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.42 ' HE2' ' HB3' ' A' ' 25' ' ' LYS . 5.6 tmmm? -136.45 145.06 44.79 Favored 'General case' 0 C--N 1.311 -1.107 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.448 -179.271 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.55 ' O ' ' HA ' ' A' ' 33' ' ' GLU . 0.9 OUTLIER -115.73 142.44 28.93 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.291 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.968 -179.768 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.434 ' CD1' ' HG2' ' A' ' 33' ' ' GLU . 45.4 mm -109.17 98.15 6.66 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.874 0 N-CA-C 108.498 -0.927 . . . . 0.0 108.498 175.884 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' GLY . . . . . 0.545 ' HA2' ' HB ' ' A' ' 90' ' ' VAL . . . -67.12 166.04 41.66 Favored Glycine 0 N--CA 1.436 -1.339 0 C-N-CA 120.45 -0.881 . . . . 0.0 112.764 178.321 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.43 -16.9 40.47 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 121.129 0.49 . . . . 0.0 112.311 179.209 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -102.76 18.1 22.25 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 121.487 0.66 . . . . 0.0 109.69 178.754 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 7.3 m 69.72 17.21 7.79 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.376 -179.134 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 12.8 t -73.46 108.48 6.35 Favored 'General case' 0 N--CA 1.444 -0.766 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.698 -178.458 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.55 ' HA ' ' O ' ' A' ' 26' ' ' VAL . 40.6 mt-10 -87.09 104.29 16.19 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-O 121.111 0.481 . . . . 0.0 110.479 178.287 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 40.2 mm -97.21 136.86 26.55 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.426 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 178.103 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 12.8 m170 -114.78 134.48 55.08 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 -178.148 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.524 ' HZ ' HG23 ' A' ' 26' ' ' VAL . 1.1 p90 -147.15 158.37 43.92 Favored 'General case' 0 C--N 1.309 -1.193 0 CA-C-O 121.397 0.618 . . . . 0.0 111.061 -178.919 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.482 ' HD3' ' OE2' ' A' ' 18' ' ' GLU . 7.3 ptpt -120.1 120.74 37.13 Favored 'General case' 0 C--N 1.307 -1.26 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.289 -178.913 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 33.4 m -139.87 162.0 25.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-O 121.352 0.596 . . . . 0.0 110.962 -178.514 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.58 ' O ' HG22 ' A' ' 42' ' ' THR . 19.1 mmmt -80.8 156.03 26.35 Favored 'General case' 0 C--N 1.312 -1.025 0 CA-C-O 121.027 0.442 . . . . 0.0 110.851 177.488 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 40' ' ' MET . . . . . 0.443 ' O ' ' HG2' ' A' ' 78' ' ' LYS . 0.0 OUTLIER -70.55 -35.51 73.15 Favored 'General case' 0 CA--C 1.506 -0.746 0 CA-C-O 121.404 0.621 . . . . 0.0 109.903 177.521 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 12.9 t -91.98 18.48 7.85 Favored 'General case' 0 N--CA 1.438 -1.035 0 CA-C-N 115.724 -0.671 . . . . 0.0 112.284 -176.396 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' THR . . . . . 0.58 HG22 ' O ' ' A' ' 39' ' ' LYS . 3.7 t -105.51 169.93 8.18 Favored 'General case' 0 C--N 1.323 -0.579 0 O-C-N 121.876 -0.515 . . . . 0.0 110.157 -179.705 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 4.6 m-70 -81.65 141.65 33.46 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 121.561 0.696 . . . . 0.0 111.487 179.79 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.6 HD13 ' HB3' ' A' ' 47' ' ' LEU . 0.2 OUTLIER -70.96 -12.14 61.37 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 115.303 -0.862 . . . . 0.0 109.596 179.702 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.813 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -55.65 -50.24 70.75 Favored 'General case' 0 N--CA 1.441 -0.884 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.802 -179.186 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.521 ' O ' ' HB2' ' A' ' 50' ' ' SER . 20.7 ptmt -63.31 -29.14 70.51 Favored 'General case' 0 C--O 1.218 -0.576 0 CA-C-O 121.318 0.58 . . . . 0.0 110.688 -177.928 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.6 ' HB3' HD13 ' A' ' 44' ' ' LEU . 8.4 tt -72.63 -50.86 22.36 Favored 'General case' 0 C--N 1.307 -1.265 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.766 -179.072 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.482 ' HA ' ' CD2' ' A' ' 51' ' ' TYR . 7.2 ptmm? -62.97 -41.28 99.49 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.923 0.392 . . . . 0.0 111.764 -177.537 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.813 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 7.0 pt-20 -72.25 -30.06 64.51 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-O 121.104 0.478 . . . . 0.0 110.528 177.828 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.684 ' O ' ' HG2' ' A' ' 54' ' ' ARG . 15.7 t -68.58 -45.69 71.37 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.414 -179.151 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.482 ' CD2' ' HA ' ' A' ' 48' ' ' LYS . 2.7 p90 -74.74 -32.93 62.25 Favored 'General case' 0 N--CA 1.448 -0.538 0 C-N-CA 119.772 -0.771 . . . . 0.0 110.48 -177.266 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 52' ' ' CYS . . . . . 0.497 ' SG ' HD11 ' A' ' 62' ' ' LEU . 98.6 m -60.93 -44.27 97.47 Favored 'General case' 0 C--O 1.239 0.541 0 CA-C-O 120.879 0.371 . . . . 0.0 110.822 179.048 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 10.6 pt20 -70.52 -31.57 68.7 Favored 'General case' 0 N--CA 1.444 -0.742 0 C-N-CA 120.368 -0.533 . . . . 0.0 110.966 -179.274 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.684 ' HG2' ' O ' ' A' ' 50' ' ' SER . 34.0 mmt180 -57.41 -36.3 71.15 Favored 'General case' 0 C--N 1.351 0.64 0 CA-C-O 121.237 0.541 . . . . 0.0 110.496 176.616 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 31.2 mt-30 -83.61 -20.82 33.01 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.844 179.797 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 80.88 33.09 30.92 Favored Glycine 0 N--CA 1.446 -0.666 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.47 178.933 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 35.1 m -132.33 148.65 70.53 Favored Pre-proline 0 C--N 1.322 -0.594 0 O-C-N 122.481 -0.423 . . . . 0.0 110.46 -179.8 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' PRO . . . . . 0.474 ' HG2' ' OG ' ' A' ' 61' ' ' SER . 28.8 Cg_endo -65.18 149.29 88.99 Favored 'Trans proline' 0 N--CA 1.458 -0.582 0 C-N-CA 122.31 2.007 . . . . 0.0 111.705 178.136 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.485 ' HG2' ' SG ' ' A' ' 52' ' ' CYS . 66.8 mtp -71.55 -9.32 58.04 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.524 -176.312 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 33.2 p30 -87.75 -10.25 51.61 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-O 121.404 0.621 . . . . 0.0 111.029 -178.959 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.474 ' OG ' ' HG2' ' A' ' 58' ' ' PRO . 74.3 m -90.11 -24.66 21.04 Favored 'General case' 0 N--CA 1.434 -1.245 0 CA-C-N 115.936 -0.575 . . . . 0.0 112.1 -177.579 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.497 HD11 ' SG ' ' A' ' 52' ' ' CYS . 1.5 pp -123.53 167.41 13.94 Favored 'General case' 0 C--N 1.307 -1.276 0 N-CA-C 112.538 0.57 . . . . 0.0 112.538 -177.483 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.483 ' O ' ' HA ' ' A' ' 90' ' ' VAL . 74.2 mtm180 -119.18 119.27 33.65 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.095 -176.949 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -100.9 116.08 31.92 Favored 'General case' 0 C--N 1.31 -1.113 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.847 178.587 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.449 ' C ' HD22 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -144.29 164.2 31.45 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.342 0.591 . . . . 0.0 110.918 -179.925 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 87.7 t80 -145.92 134.09 21.63 Favored 'General case' 0 C--N 1.309 -1.187 0 N-CA-C 109.219 -0.66 . . . . 0.0 109.219 178.388 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.425 ' HG2' HE21 ' A' ' 69' ' ' GLN . 7.9 pt-20 49.69 27.13 2.07 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 124.291 1.036 . . . . 0.0 112.563 -179.825 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 90.15 16.91 55.01 Favored Glycine 0 CA--C 1.521 0.411 0 C-N-CA 121.033 -0.603 . . . . 0.0 113.391 179.255 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' GLN . . . . . 0.425 HE21 ' HG2' ' A' ' 67' ' ' GLU . 2.7 pt20 -127.97 133.92 49.24 Favored 'General case' 0 C--N 1.317 -0.842 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 -179.986 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -72.36 146.85 46.79 Favored 'General case' 0 C--N 1.309 -1.193 0 CA-C-O 121.588 0.709 . . . . 0.0 110.705 178.807 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.472 HG21 HD12 ' A' ' 44' ' ' LEU . 20.7 mm -93.81 117.28 37.02 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.482 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.3 -178.611 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.409 ' O ' ' HB2' ' A' ' 75' ' ' HIS . . . -97.73 162.78 13.11 Favored 'General case' 0 N--CA 1.436 -1.141 0 N-CA-C 109.872 -0.418 . . . . 0.0 109.872 -179.761 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 73' ' ' ASP . . . . . 0.485 ' O ' ' HB3' ' A' ' 45' ' ' LYS . 7.4 p-10 -65.82 -22.46 66.56 Favored 'General case' 0 C--N 1.312 -1.039 0 CA-C-O 121.168 0.509 . . . . 0.0 111.7 -179.347 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 10.7 m-80 -96.03 2.86 53.65 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-O 121.382 0.61 . . . . 0.0 110.135 179.53 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' HIS . . . . . 0.595 ' O ' ' HB2' ' A' ' 44' ' ' LEU . 3.4 m170 -83.83 146.56 28.04 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 109.597 -0.519 . . . . 0.0 109.597 178.565 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.52 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 72.4 p -122.54 156.18 61.56 Favored Pre-proline 0 C--N 1.31 -1.147 0 O-C-N 122.307 -0.246 . . . . 0.0 111.062 178.555 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 25.0 Cg_exo -62.07 -37.45 64.01 Favored 'Trans proline' 0 C--N 1.351 0.676 0 C-N-CA 122.319 2.013 . . . . 0.0 110.999 179.243 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' LYS . . . . . 0.443 ' HG2' ' O ' ' A' ' 40' ' ' MET . 14.6 ptmt -67.26 -40.84 86.28 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.577 -179.165 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 47.4 mm-40 -75.33 -35.45 61.19 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 120.936 0.398 . . . . 0.0 111.355 -178.356 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.52 ' HG ' ' O ' ' A' ' 76' ' ' THR . 5.9 mt -79.27 -4.0 48.63 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-O 121.074 0.464 . . . . 0.0 110.688 179.762 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 74.04 47.85 17.51 Favored Glycine 0 N--CA 1.445 -0.759 0 C-N-CA 120.815 -0.707 . . . . 0.0 112.622 178.229 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 64.4 mtt -103.6 165.5 10.99 Favored 'General case' 0 C--N 1.313 -0.982 0 N-CA-C 109.516 -0.55 . . . . 0.0 109.516 178.204 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 83' ' ' GLU . . . . . 0.475 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 12.9 pt-20 -139.62 -172.88 3.47 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-O 120.842 0.354 . . . . 0.0 110.465 178.838 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -72.7 137.84 46.23 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-O 121.234 0.54 . . . . 0.0 111.152 -179.216 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 26.0 tt0 77.34 3.43 3.16 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.791 1.237 . . . . 0.0 111.052 179.495 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 86' ' ' ASP . . . . . 0.475 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 0.5 OUTLIER -60.62 162.45 6.5 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 121.366 0.603 . . . . 0.0 111.212 178.135 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 13.5 p -128.18 146.63 33.4 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.176 0 CA-C-O 121.207 0.527 . . . . 0.0 110.675 -177.677 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 3.8 mp -114.75 152.16 16.41 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.99 0 N-CA-C 108.844 -0.799 . . . . 0.0 108.844 178.536 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -104.9 138.77 40.63 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 109.931 -0.396 . . . . 0.0 109.931 -176.52 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 90' ' ' VAL . . . . . 0.545 ' HB ' ' HA2' ' A' ' 28' ' ' GLY . 85.5 t -128.91 134.72 63.75 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.834 0 CA-C-O 121.439 0.638 . . . . 0.0 111.302 179.312 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 75.1 m-85 -118.22 -179.73 3.86 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.93 -0.577 . . . . 0.0 109.578 179.08 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 8.5 tp60 -107.13 142.4 36.88 Favored 'General case' 0 C--N 1.313 -0.992 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 177.364 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 93' ' ' GLU . . . . . 0.466 ' OE2' ' HG2' ' A' ' 63' ' ' ARG . 11.1 pt-20 -131.29 18.61 4.89 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.325 0.583 . . . . 0.0 111.117 176.497 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 25.8 mt-30 -66.77 -153.85 0.01 OUTLIER 'General case' 0 CA--C 1.542 0.653 0 CA-C-N 115.703 -0.681 . . . . 0.0 111.316 177.031 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 3.5 t -97.66 131.98 43.72 Favored 'General case' 0 C--N 1.31 -1.128 0 CA-C-O 121.463 0.649 . . . . 0.0 110.237 -177.614 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -90.89 48.53 3.02 Favored Glycine 0 N--CA 1.441 -1.016 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.301 -179.039 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.435 -1.429 0 CA-C-O 118.406 -1.219 . . . . 0.0 111.173 -179.779 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . 0.427 ' HB ' ' HA ' ' A' ' 84' ' ' GLU . 18.3 pt . . . . . 0 N--CA 1.444 -0.729 0 CA-C-O 121.32 0.581 . . . . 0.0 110.356 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.56 ' HG2' ' HG2' ' A' ' 37' ' ' LYS . 50.9 mtmt -111.1 146.31 37.03 Favored 'General case' 0 C--N 1.305 -1.335 0 N-CA-C 109.726 -0.472 . . . . 0.0 109.726 179.756 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.9 mp -139.4 159.44 42.15 Favored 'General case' 0 C--N 1.295 -1.774 0 CA-C-O 121.095 0.474 . . . . 0.0 110.381 173.233 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.45 ' HE2' ' HB3' ' A' ' 25' ' ' LYS . 5.0 tmmm? -129.9 142.67 50.62 Favored 'General case' 0 N--CA 1.437 -1.083 0 CA-C-O 121.325 0.583 . . . . 0.0 110.426 -179.349 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.616 ' O ' ' HA ' ' A' ' 33' ' ' GLU . 0.9 OUTLIER -114.6 142.53 27.01 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.384 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.592 -179.163 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.473 HD13 ' HG2' ' A' ' 33' ' ' GLU . 47.4 mm -105.79 113.83 43.62 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.987 0 N-CA-C 107.243 -1.391 . . . . 0.0 107.243 174.691 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . 0.488 ' HA2' ' HB ' ' A' ' 90' ' ' VAL . . . -83.39 171.64 50.06 Favored Glycine 0 N--CA 1.425 -2.089 0 C-N-CA 119.998 -1.096 . . . . 0.0 111.804 -176.622 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.86 -23.61 65.28 Favored 'General case' 0 C--N 1.305 -1.363 0 CA-C-O 121.438 0.637 . . . . 0.0 111.03 178.108 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -103.34 15.32 29.42 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-O 121.578 0.704 . . . . 0.0 109.642 178.931 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 32.4 m 73.91 23.34 2.26 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-O 122.635 1.207 . . . . 0.0 108.192 -178.907 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.1 m -66.6 95.58 0.34 Allowed 'General case' 0 N--CA 1.428 -1.548 0 CA-C-N 113.285 -1.78 . . . . 0.0 111.106 -179.17 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.616 ' HA ' ' O ' ' A' ' 26' ' ' VAL . 38.6 mt-10 -83.71 106.89 15.78 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 121.533 0.682 . . . . 0.0 111.127 179.424 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.437 HG21 ' HA ' ' A' ' 51' ' ' TYR . 40.1 mm -103.62 140.42 21.83 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.431 0 CA-C-N 115.7 -0.682 . . . . 0.0 109.57 179.393 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 13.0 m170 -115.97 132.48 56.64 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 -179.625 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.557 ' HZ ' HG23 ' A' ' 26' ' ' VAL . 1.0 OUTLIER -147.24 159.33 43.77 Favored 'General case' 0 C--N 1.312 -1.031 0 CA-C-O 121.445 0.64 . . . . 0.0 112.003 -178.904 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.56 ' HG2' ' HG2' ' A' ' 23' ' ' LYS . 28.6 mtmt -120.92 119.11 31.65 Favored 'General case' 0 C--N 1.312 -1.053 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.363 -179.109 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 20.5 m -138.38 159.48 31.9 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-O 121.172 0.51 . . . . 0.0 110.947 -178.516 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.524 ' O ' HG22 ' A' ' 42' ' ' THR . 0.9 OUTLIER -74.85 154.56 38.2 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-O 121.058 0.456 . . . . 0.0 111.193 178.625 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -69.85 -37.31 76.11 Favored 'General case' 0 CA--C 1.507 -0.691 0 CA-C-O 121.22 0.533 . . . . 0.0 110.458 178.49 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 11.8 t -99.8 25.59 7.1 Favored 'General case' 0 N--CA 1.436 -1.169 0 CA-C-O 121.375 0.607 . . . . 0.0 112.424 -175.462 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . 0.524 HG22 ' O ' ' A' ' 39' ' ' LYS . 6.1 t -108.17 168.26 9.43 Favored 'General case' 0 C--N 1.32 -0.713 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 176.995 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 14.8 m170 -78.26 140.35 38.87 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 121.734 0.778 . . . . 0.0 111.885 -179.125 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.65 ' HB2' ' O ' ' A' ' 75' ' ' HIS . 0.2 OUTLIER -64.98 -18.44 65.28 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.051 -0.977 . . . . 0.0 109.813 -179.911 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.722 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -51.25 -45.84 62.14 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.734 -179.212 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.446 ' HA ' ' CG ' ' A' ' 49' ' ' GLU . 21.4 ptmt -66.47 -31.82 72.81 Favored 'General case' 0 C--O 1.22 -0.498 0 CA-C-O 121.427 0.632 . . . . 0.0 110.933 -177.647 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.559 ' HB3' HD13 ' A' ' 44' ' ' LEU . 8.1 tt -67.97 -47.84 67.5 Favored 'General case' 0 C--N 1.308 -1.202 0 CA-C-O 121.6 0.714 . . . . 0.0 109.259 178.025 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.504 ' HA ' ' CE2' ' A' ' 51' ' ' TYR . 40.5 mtpt -60.63 -45.2 94.93 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.066 -0.97 . . . . 0.0 111.535 -178.763 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.722 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 3.7 pt-20 -71.03 -33.85 70.72 Favored 'General case' 0 C--N 1.312 -1.05 0 CA-C-O 120.958 0.408 . . . . 0.0 110.376 178.639 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . 0.594 ' O ' ' HG2' ' A' ' 54' ' ' ARG . 21.9 t -64.19 -44.91 90.53 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-O 120.881 0.372 . . . . 0.0 111.257 -178.744 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.504 ' CE2' ' HA ' ' A' ' 48' ' ' LYS . 3.6 p90 -75.73 -32.39 60.0 Favored 'General case' 0 N--CA 1.443 -0.81 0 C-N-CA 119.639 -0.824 . . . . 0.0 110.659 -178.618 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . 0.614 ' SG ' ' HG2' ' A' ' 59' ' ' MET . 69.3 m -62.77 -43.55 98.5 Favored 'General case' 0 C--O 1.238 0.451 0 CA-C-O 120.868 0.366 . . . . 0.0 110.822 178.667 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . 0.404 ' HG2' ' O ' ' A' ' 49' ' ' GLU . 6.6 pt20 -66.49 -36.06 81.79 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 120.649 -0.421 . . . . 0.0 110.284 178.997 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.594 ' HG2' ' O ' ' A' ' 50' ' ' SER . 29.7 mmt180 -53.76 -45.77 70.73 Favored 'General case' 0 C--N 1.351 0.668 0 CA-C-O 121.233 0.54 . . . . 0.0 110.594 176.667 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.41 ' NE2' ' HA ' ' A' ' 52' ' ' CYS . 2.2 mt-30 -76.73 -23.43 53.05 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.881 -179.609 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 83.27 29.34 33.83 Favored Glycine 0 N--CA 1.445 -0.716 0 C-N-CA 120.565 -0.826 . . . . 0.0 112.086 178.464 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 26.6 m -128.49 153.45 79.3 Favored Pre-proline 0 C--N 1.327 -0.393 0 O-C-N 122.659 -0.318 . . . . 0.0 110.326 -178.725 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -69.01 149.14 71.31 Favored 'Trans proline' 0 C--O 1.239 0.571 0 C-N-CA 122.334 2.022 . . . . 0.0 112.188 178.226 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.614 ' HG2' ' SG ' ' A' ' 52' ' ' CYS . 75.3 mtp -71.46 -9.23 57.85 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.791 -0.64 . . . . 0.0 112.112 -176.06 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 21.0 p30 -89.72 -13.41 36.91 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-O 121.115 0.483 . . . . 0.0 111.529 -178.64 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 67.6 m -88.36 -16.1 33.88 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-O 121.164 0.507 . . . . 0.0 112.162 -179.204 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.547 HD11 ' SG ' ' A' ' 52' ' ' CYS . 1.5 pp -126.66 168.47 14.31 Favored 'General case' 0 C--N 1.309 -1.172 0 N-CA-C 112.817 0.673 . . . . 0.0 112.817 -178.457 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.555 ' O ' ' HA ' ' A' ' 90' ' ' VAL . 14.4 mtp180 -121.14 127.09 51.24 Favored 'General case' 0 CA--C 1.506 -0.73 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.658 -177.814 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -106.91 113.9 27.67 Favored 'General case' 0 C--N 1.305 -1.338 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.643 178.147 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.462 ' C ' HD22 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -141.23 162.12 36.24 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.361 0.6 . . . . 0.0 111.056 179.541 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 86.1 t80 -142.89 135.16 27.36 Favored 'General case' 0 C--N 1.311 -1.068 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 178.964 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.494 ' HG2' HE21 ' A' ' 69' ' ' GLN . 6.2 pt-20 48.96 29.32 2.32 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 124.23 1.012 . . . . 0.0 112.405 -179.729 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 81.77 27.65 45.63 Favored Glycine 0 N--CA 1.445 -0.709 0 C-N-CA 120.72 -0.752 . . . . 0.0 113.131 -179.273 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . 0.494 HE21 ' HG2' ' A' ' 67' ' ' GLU . 3.5 pt20 -132.61 136.47 46.54 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 109.217 -0.661 . . . . 0.0 109.217 178.018 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.91 145.74 49.98 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-O 121.638 0.732 . . . . 0.0 110.672 178.292 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.448 HG12 ' HA ' ' A' ' 65' ' ' LEU . 16.8 mm -99.74 121.27 50.21 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.592 0 CA-C-O 121.161 0.505 . . . . 0.0 109.989 -179.632 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -95.86 164.58 12.68 Favored 'General case' 0 C--N 1.309 -1.153 0 N-CA-C 109.946 -0.391 . . . . 0.0 109.946 -179.382 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -65.49 -21.75 66.66 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-O 121.287 0.565 . . . . 0.0 110.584 179.411 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 6.5 m-80 -97.93 2.31 48.94 Favored 'General case' 0 CA--C 1.508 -0.653 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.162 -179.61 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . 0.65 ' O ' ' HB2' ' A' ' 44' ' ' LEU . 1.6 m170 -82.33 146.18 29.54 Favored 'General case' 0 CA--C 1.505 -0.786 0 C-N-CA 119.96 -0.696 . . . . 0.0 109.305 -179.832 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.497 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 82.1 p -120.7 155.53 56.97 Favored Pre-proline 0 C--N 1.308 -1.198 0 C-N-CA 120.961 -0.296 . . . . 0.0 111.27 179.514 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_exo -61.85 -38.71 57.23 Favored 'Trans proline' 0 C--N 1.348 0.516 0 C-N-CA 122.459 2.106 . . . . 0.0 111.161 179.335 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . 0.521 ' HG3' ' N ' ' A' ' 79' ' ' GLU . 47.0 pttt -67.22 -39.58 86.3 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.801 -178.835 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . 0.521 ' N ' ' HG3' ' A' ' 78' ' ' LYS . 4.3 mm-40 -75.26 -33.57 61.3 Favored 'General case' 0 N--CA 1.44 -0.974 0 CA-C-O 120.947 0.404 . . . . 0.0 111.614 -177.31 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.497 ' HG ' ' O ' ' A' ' 76' ' ' THR . 6.5 mt -82.8 -1.32 51.43 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.214 0.53 . . . . 0.0 110.78 179.573 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 76.3 46.43 12.61 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 121.133 -0.556 . . . . 0.0 113.114 177.248 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 60.7 mtt -107.04 167.72 9.7 Favored 'General case' 0 C--N 1.313 -1.021 0 N-CA-C 109.627 -0.509 . . . . 0.0 109.627 178.569 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -148.42 -171.3 3.81 Favored 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 109.938 -0.393 . . . . 0.0 109.938 178.168 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.427 ' HA ' ' HB ' ' A' ' 22' ' ' ILE . 7.0 pt-20 -66.29 135.31 54.23 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.531 0.681 . . . . 0.0 111.659 -178.48 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 74.63 6.74 4.48 Favored 'General case' 0 C--N 1.324 -0.539 0 C-N-CA 124.816 1.246 . . . . 0.0 112.558 178.746 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -62.27 162.54 9.64 Favored 'General case' 0 C--O 1.238 0.491 0 CA-C-O 121.093 0.473 . . . . 0.0 110.081 175.87 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . 0.438 ' HA ' ' O ' ' A' ' 25' ' ' LYS . 7.3 p -127.56 142.19 44.3 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.264 0 CA-C-O 121.537 0.684 . . . . 0.0 111.925 -176.392 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 3.7 mp -114.4 153.62 15.89 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 179.699 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -104.67 135.53 45.9 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 121.046 0.451 . . . . 0.0 109.994 -176.401 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . 0.555 ' HA ' ' O ' ' A' ' 63' ' ' ARG . 96.7 t -128.57 134.74 64.03 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.904 0 CA-C-O 121.268 0.556 . . . . 0.0 110.825 179.039 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 80.7 m-85 -121.24 179.07 4.53 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-N 116.213 -0.449 . . . . 0.0 109.858 179.43 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 8.7 tp60 -108.22 128.23 54.53 Favored 'General case' 0 C--N 1.313 -1.005 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 179.54 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' GLU . . . . . 0.403 ' HB3' ' CD ' ' A' ' 63' ' ' ARG . 9.8 pt-20 . . . . . 0 C--N 1.326 -0.433 0 CA-C-O 121.316 0.579 . . . . 0.0 111.037 178.209 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . 0.457 ' HB ' ' HA ' ' A' ' 84' ' ' GLU . 22.3 pt . . . . . 0 N--CA 1.444 -0.768 0 CA-C-O 121.569 0.699 . . . . 0.0 110.25 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 14.2 mtmt -117.63 146.69 43.49 Favored 'General case' 0 C--N 1.298 -1.636 0 N-CA-C 109.058 -0.719 . . . . 0.0 109.058 -179.071 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.6 mp -141.35 161.48 37.79 Favored 'General case' 0 C--N 1.303 -1.434 0 CA-C-O 121.337 0.589 . . . . 0.0 111.473 174.957 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.415 ' HE2' ' HB3' ' A' ' 25' ' ' LYS . 5.5 tmmm? -133.34 142.88 48.65 Favored 'General case' 0 N--CA 1.436 -1.16 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.463 -178.993 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.498 HG23 ' HZ ' ' A' ' 36' ' ' PHE . 0.9 OUTLIER -114.46 141.72 29.83 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.341 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.247 -179.701 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.436 ' O ' ' HB ' ' A' ' 90' ' ' VAL . 45.5 mm -105.11 117.74 51.31 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.971 0 N-CA-C 107.685 -1.228 . . . . 0.0 107.685 175.652 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . 0.415 ' HA2' ' HB ' ' A' ' 90' ' ' VAL . . . -87.56 168.1 37.75 Favored Glycine 0 N--CA 1.421 -2.359 0 C-N-CA 120.372 -0.918 . . . . 0.0 111.845 -177.316 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.04 -22.59 66.96 Favored 'General case' 0 C--N 1.305 -1.348 0 CA-C-O 121.592 0.711 . . . . 0.0 110.704 178.832 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -97.99 12.18 35.07 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.663 -0.699 . . . . 0.0 109.555 179.672 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 15.1 m 71.54 16.56 5.86 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.337 -178.961 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 9.6 t -76.09 115.94 16.3 Favored 'General case' 0 N--CA 1.444 -0.737 0 CA-C-N 115.551 -0.749 . . . . 0.0 110.234 -179.731 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.478 ' HA ' ' O ' ' A' ' 26' ' ' VAL . 40.9 mt-10 -89.15 112.68 23.74 Favored 'General case' 0 CA--C 1.509 -0.598 0 CA-C-O 120.942 0.401 . . . . 0.0 110.415 178.678 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 30.6 mm -99.48 135.53 34.45 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.515 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 177.193 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 11.9 m170 -116.13 132.74 56.57 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 109.549 -0.537 . . . . 0.0 109.549 -178.52 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.498 ' HZ ' HG23 ' A' ' 26' ' ' VAL . 1.4 p90 -147.22 166.77 26.0 Favored 'General case' 0 C--N 1.314 -0.972 0 CA-C-O 121.424 0.63 . . . . 0.0 111.6 -178.164 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 89.9 mttt -125.17 121.34 33.91 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.835 -178.79 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 28.1 m -139.15 156.97 28.08 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 CA-C-O 120.949 0.404 . . . . 0.0 110.165 179.455 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.528 ' O ' HG22 ' A' ' 42' ' ' THR . 80.4 tttt -84.21 167.25 16.85 Favored 'General case' 0 C--N 1.311 -1.072 0 O-C-N 121.98 -0.45 . . . . 0.0 110.654 179.832 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -73.39 -36.28 66.02 Favored 'General case' 0 N--CA 1.464 0.269 0 N-CA-C 112.907 0.706 . . . . 0.0 112.907 -176.931 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 11.3 t -96.18 15.72 20.16 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 112.02 0.378 . . . . 0.0 112.02 -177.182 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . 0.528 HG22 ' O ' ' A' ' 39' ' ' LYS . 5.3 t -93.58 171.62 8.78 Favored 'General case' 0 C--N 1.319 -0.742 0 O-C-N 121.627 -0.67 . . . . 0.0 109.917 -179.604 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . 0.405 ' O ' ' HG2' ' A' ' 46' ' ' LYS . 51.6 m170 -88.39 141.23 28.71 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 121.381 0.61 . . . . 0.0 111.188 -179.535 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.631 ' HB2' ' O ' ' A' ' 75' ' ' HIS . 0.2 OUTLIER -69.49 -15.22 63.22 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.571 -0.74 . . . . 0.0 110.033 -179.815 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.778 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -54.75 -44.98 74.1 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-N 115.756 -0.656 . . . . 0.0 111.934 -179.225 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.459 ' N ' ' HD3' ' A' ' 45' ' ' LYS . 21.4 ptmt -69.49 -29.12 66.7 Favored 'General case' 0 C--O 1.218 -0.602 0 CA-C-O 121.286 0.565 . . . . 0.0 110.482 -178.233 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.579 ' HB3' HD13 ' A' ' 44' ' ' LEU . 8.0 tt -72.55 -49.83 29.89 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.498 -179.653 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.501 ' HG2' ' O ' ' A' ' 44' ' ' LEU . 8.3 ptmm? -61.76 -41.76 98.1 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.418 -178.306 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.778 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 8.2 pt-20 -72.16 -30.49 65.05 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-O 121.021 0.439 . . . . 0.0 110.716 177.841 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . 0.594 ' O ' ' HG2' ' A' ' 53' ' ' GLN . 29.3 t -68.57 -43.7 76.01 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.431 -0.35 . . . . 0.0 111.5 -178.75 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.462 ' CD1' HG11 ' A' ' 26' ' ' VAL . 2.5 p90 -75.66 -32.46 60.19 Favored 'General case' 0 N--CA 1.446 -0.658 0 C-N-CA 119.531 -0.868 . . . . 0.0 110.206 -178.619 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . 0.512 ' SG ' HD11 ' A' ' 62' ' ' LEU . 98.9 m -65.14 -42.75 93.55 Favored 'General case' 0 CA--C 1.504 -0.807 0 CA-C-O 121.236 0.541 . . . . 0.0 110.601 179.765 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . 0.594 ' HG2' ' O ' ' A' ' 50' ' ' SER . 25.4 pt20 -67.37 -35.89 80.25 Favored 'General case' 0 N--CA 1.434 -1.271 0 CA-C-N 115.97 -0.559 . . . . 0.0 109.596 -179.728 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.41 ' HA ' ' NE ' ' A' ' 54' ' ' ARG . 1.0 OUTLIER -56.91 -39.35 74.28 Favored 'General case' 0 C--N 1.355 0.832 0 CA-C-O 121.315 0.578 . . . . 0.0 111.279 178.831 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.44 ' NE2' ' HA ' ' A' ' 52' ' ' CYS . 3.5 mt-30 -77.7 -20.91 52.81 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.888 179.964 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 80.86 33.63 29.57 Favored Glycine 0 N--CA 1.447 -0.615 0 C-N-CA 120.787 -0.721 . . . . 0.0 111.88 179.899 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 31.2 m -133.8 150.67 75.27 Favored Pre-proline 0 C--O 1.238 0.488 0 O-C-N 122.606 -0.349 . . . . 0.0 110.743 -178.685 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . 0.546 ' HG2' ' OG ' ' A' ' 61' ' ' SER . 29.9 Cg_endo -65.37 149.57 88.03 Favored 'Trans proline' 0 N--CA 1.455 -0.739 0 C-N-CA 122.558 2.172 . . . . 0.0 111.479 176.829 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.483 ' HG2' ' SG ' ' A' ' 52' ' ' CYS . 68.5 mtp -73.5 -8.38 55.69 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 121.246 0.546 . . . . 0.0 111.52 -176.686 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . 0.423 ' OD1' ' HB2' ' A' ' 58' ' ' PRO . 2.0 p-10 -90.82 -10.19 43.67 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-O 121.272 0.558 . . . . 0.0 111.046 -179.124 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.546 ' OG ' ' HG2' ' A' ' 58' ' ' PRO . 67.1 m -87.59 -19.22 28.12 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 121.08 0.467 . . . . 0.0 111.59 179.766 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.512 HD11 ' SG ' ' A' ' 52' ' ' CYS . 1.8 pp -127.66 170.31 12.83 Favored 'General case' 0 C--N 1.317 -0.829 0 N-CA-C 112.948 0.721 . . . . 0.0 112.948 -177.949 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.443 ' O ' ' HA ' ' A' ' 90' ' ' VAL . 44.2 mtm180 -120.18 119.4 33.14 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.606 -0.724 . . . . 0.0 110.824 -176.686 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.449 ' HB3' ' OH ' ' A' ' 51' ' ' TYR . 0.2 OUTLIER -102.33 116.11 31.96 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-O 121.085 0.469 . . . . 0.0 111.034 178.458 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.467 ' C ' HD22 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -143.3 162.52 35.45 Favored 'General case' 0 N--CA 1.444 -0.755 0 CA-C-O 121.395 0.616 . . . . 0.0 111.285 179.412 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.417 ' CB ' HD11 ' A' ' 71' ' ' ILE . 90.2 t80 -143.64 134.48 25.29 Favored 'General case' 0 C--N 1.306 -1.287 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 179.432 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.445 ' HG2' HE21 ' A' ' 69' ' ' GLN . 6.4 pt-20 49.34 27.34 1.9 Allowed 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 124.006 0.923 . . . . 0.0 112.354 -179.071 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 87.19 19.94 54.02 Favored Glycine 0 N--CA 1.449 -0.463 0 C-N-CA 121.079 -0.582 . . . . 0.0 113.687 -179.541 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . 0.445 HE21 ' HG2' ' A' ' 67' ' ' GLU . 3.3 pt20 -128.68 137.3 51.55 Favored 'General case' 0 C--N 1.319 -0.737 0 O-C-N 122.058 -0.672 . . . . 0.0 109.486 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -68.8 146.64 52.72 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-O 121.292 0.567 . . . . 0.0 110.225 178.241 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.508 HG21 HD12 ' A' ' 44' ' ' LEU . 24.5 mm -93.15 119.09 40.3 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.54 0 CA-C-O 120.931 0.396 . . . . 0.0 110.161 -179.613 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -96.96 163.54 12.91 Favored 'General case' 0 N--CA 1.437 -1.095 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 -179.505 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . 0.463 ' CA ' ' HB3' ' A' ' 45' ' ' LYS . 13.8 m-20 -65.02 -28.17 69.31 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-O 121.563 0.697 . . . . 0.0 110.769 -178.901 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 6.2 m-80 -95.36 4.13 53.7 Favored 'General case' 0 C--N 1.313 -0.981 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.994 -176.443 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . 0.631 ' O ' ' HB2' ' A' ' 44' ' ' LEU . 1.7 m170 -80.29 141.69 35.25 Favored 'General case' 0 CA--C 1.509 -0.629 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 179.974 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.418 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 69.7 p -116.57 154.11 49.1 Favored Pre-proline 0 C--N 1.308 -1.236 0 C-N-CA 120.829 -0.348 . . . . 0.0 111.286 178.942 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -58.64 -40.6 72.02 Favored 'Trans proline' 0 C--N 1.349 0.594 0 C-N-CA 122.624 2.216 . . . . 0.0 111.602 179.264 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . 0.483 ' HG3' ' N ' ' A' ' 79' ' ' GLU . 17.3 pttt -68.66 -35.52 77.36 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.05 0.452 . . . . 0.0 111.114 -178.146 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . 0.483 ' N ' ' HG3' ' A' ' 78' ' ' LYS . 32.8 mm-40 -76.24 -32.74 59.04 Favored 'General case' 0 CA--C 1.508 -0.672 0 CA-C-O 120.854 0.359 . . . . 0.0 111.233 -179.29 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.469 HD21 ' CG ' ' A' ' 75' ' ' HIS . 5.5 mt -83.27 -2.76 56.43 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.417 0.627 . . . . 0.0 110.361 178.954 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 75.06 44.52 23.28 Favored Glycine 0 N--CA 1.449 -0.456 0 CA-C-N 115.852 -0.613 . . . . 0.0 112.552 177.696 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 63.0 mtt -101.65 162.02 13.21 Favored 'General case' 0 C--N 1.316 -0.874 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 178.745 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -139.85 -172.76 3.46 Favored 'General case' 0 C--N 1.309 -1.181 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 178.471 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.457 ' HA ' ' HB ' ' A' ' 22' ' ' ILE . 10.0 pt-20 -73.34 136.23 44.41 Favored 'General case' 0 N--CA 1.443 -0.813 0 C-N-CA 119.843 -0.743 . . . . 0.0 110.836 179.443 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . 0.405 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 42.9 mt-10 76.04 5.06 3.8 Favored 'General case' 0 C--N 1.321 -0.644 0 C-N-CA 124.612 1.165 . . . . 0.0 111.557 -179.114 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 1.8 t0 -63.22 163.84 9.69 Favored 'General case' 0 C--O 1.238 0.488 0 CA-C-O 121.007 0.432 . . . . 0.0 110.309 176.435 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 9.1 p -126.92 143.14 41.37 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.267 0 CA-C-O 121.421 0.629 . . . . 0.0 111.713 -175.934 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 3.4 mp -113.2 152.19 14.96 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.746 0 N-CA-C 108.611 -0.885 . . . . 0.0 108.611 178.134 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -105.42 137.24 43.55 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-O 121.182 0.515 . . . . 0.0 110.754 -175.89 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . 0.443 ' HA ' ' O ' ' A' ' 63' ' ' ARG . 58.3 t -130.02 134.97 62.01 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.843 0 CA-C-O 121.398 0.618 . . . . 0.0 110.74 178.68 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 95.7 m-85 -123.33 -178.79 4.09 Favored 'General case' 0 C--N 1.307 -1.276 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 178.645 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 8.0 tp60 -104.65 152.75 22.09 Favored 'General case' 0 C--N 1.305 -1.344 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 179.332 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 . . . . . 0 C--N 1.325 -0.463 0 CA-C-O 121.424 0.63 . . . . 0.0 110.329 175.207 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . 0.422 ' HB ' ' HA ' ' A' ' 84' ' ' GLU . 21.1 pt . . . . . 0 N--CA 1.445 -0.72 0 CA-C-O 121.261 0.553 . . . . 0.0 110.391 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -117.17 143.0 46.32 Favored 'General case' 0 C--N 1.303 -1.427 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 -179.68 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.4 mp -135.21 162.02 33.71 Favored 'General case' 0 C--N 1.309 -1.177 0 CA-C-O 121.202 0.525 . . . . 0.0 110.863 176.778 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.569 ' HG3' ' NE2' ' A' ' 35' ' ' HIS . 2.9 tmmt? -133.22 144.02 49.52 Favored 'General case' 0 N--CA 1.439 -1.002 0 CA-C-O 121.391 0.615 . . . . 0.0 111.186 -178.648 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.561 HG23 ' HZ ' ' A' ' 36' ' ' PHE . 1.0 OUTLIER -118.54 139.03 47.31 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.314 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.231 178.904 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.442 ' CD1' ' HG2' ' A' ' 33' ' ' GLU . 40.1 mm -107.19 99.13 7.95 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.01 0 N-CA-C 108.525 -0.917 . . . . 0.0 108.525 175.039 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . 0.59 ' HA2' ' HB ' ' A' ' 90' ' ' VAL . . . -69.8 161.9 52.68 Favored Glycine 0 N--CA 1.42 -2.396 0 C-N-CA 120.27 -0.966 . . . . 0.0 112.943 178.382 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.417 ' HG3' ' H ' ' A' ' 29' ' ' GLN . 0.0 OUTLIER -54.62 -28.55 47.54 Favored 'General case' 0 C--N 1.306 -1.293 0 C-N-CA 123.675 0.79 . . . . 0.0 112.01 176.914 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -88.49 14.88 8.82 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-O 121.249 0.547 . . . . 0.0 110.362 179.597 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 55.6 m 67.62 14.56 9.57 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-O 121.76 0.791 . . . . 0.0 110.353 -177.639 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 2.2 t -72.82 101.48 3.15 Favored 'General case' 0 N--CA 1.438 -1.07 0 CA-C-N 115.238 -0.892 . . . . 0.0 110.4 -179.664 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.442 ' HG2' ' CD1' ' A' ' 27' ' ' ILE . 23.9 mt-10 -79.7 103.61 9.72 Favored 'General case' 0 N--CA 1.444 -0.749 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 177.569 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.417 HG21 ' HA ' ' A' ' 51' ' ' TYR . 23.0 mm -97.33 130.97 45.21 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.587 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 -178.918 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . 0.569 ' NE2' ' HG3' ' A' ' 25' ' ' LYS . 12.1 m170 -115.95 123.77 48.87 Favored 'General case' 0 CA--C 1.505 -0.768 0 N-CA-C 109.646 -0.501 . . . . 0.0 109.646 -178.953 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.561 ' HZ ' HG23 ' A' ' 26' ' ' VAL . 1.3 p90 -138.15 147.28 43.73 Favored 'General case' 0 C--N 1.301 -1.534 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.763 -177.156 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 96.2 mttt -109.7 117.92 35.17 Favored 'General case' 0 C--N 1.311 -1.068 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.022 -179.333 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.412 HG21 HD12 ' A' ' 47' ' ' LEU . 24.6 m -137.17 167.04 24.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.351 -178.433 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.423 ' HG2' ' N ' ' A' ' 40' ' ' MET . 81.7 tttt -90.76 160.03 16.01 Favored 'General case' 0 C--N 1.318 -0.8 0 O-C-N 121.782 -0.574 . . . . 0.0 110.695 -179.769 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . 0.423 ' N ' ' HG2' ' A' ' 39' ' ' LYS . 0.0 OUTLIER -66.21 -37.85 86.56 Favored 'General case' 0 CA--C 1.517 -0.317 0 N-CA-C 112.594 0.591 . . . . 0.0 112.594 -177.466 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 11.0 t -98.84 17.87 18.44 Favored 'General case' 0 C--N 1.312 -1.032 0 CA-C-O 120.952 0.406 . . . . 0.0 111.741 -175.739 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 1.1 t -95.16 165.73 12.26 Favored 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 120.205 -0.598 . . . . 0.0 109.788 179.069 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 18.3 m170 -81.28 137.52 35.79 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-O 121.498 0.666 . . . . 0.0 112.029 -179.917 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.598 ' HB2' ' O ' ' A' ' 75' ' ' HIS . 0.4 OUTLIER -65.71 -14.39 61.19 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.034 -0.984 . . . . 0.0 110.968 179.784 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.748 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -51.01 -54.45 24.45 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.505 0.557 . . . . 0.0 112.505 -178.432 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.432 ' HD3' ' N ' ' A' ' 47' ' ' LEU . 0.1 OUTLIER -66.85 -25.27 66.34 Favored 'General case' 0 C--O 1.218 -0.573 0 CA-C-O 121.289 0.566 . . . . 0.0 111.491 -178.192 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.463 ' HB3' HD13 ' A' ' 44' ' ' LEU . 8.2 tt -73.51 -51.34 17.4 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.708 178.93 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.49 ' HG2' ' O ' ' A' ' 44' ' ' LEU . 8.7 ptmm? -62.39 -40.27 95.95 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.904 0.383 . . . . 0.0 111.522 -177.566 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.748 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 11.5 pt-20 -72.57 -31.29 65.12 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-O 120.909 0.385 . . . . 0.0 110.632 177.838 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . 0.408 ' HB2' ' O ' ' A' ' 46' ' ' LYS . 38.1 t -65.86 -44.33 85.73 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-O 120.932 0.396 . . . . 0.0 111.226 -179.292 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.54 ' CD1' HG11 ' A' ' 26' ' ' VAL . 1.2 p90 -76.49 -33.17 58.66 Favored 'General case' 0 N--CA 1.443 -0.78 0 C-N-CA 119.676 -0.81 . . . . 0.0 110.266 -177.78 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 84.5 m -61.81 -44.75 96.24 Favored 'General case' 0 CA--C 1.512 -0.513 0 CA-C-O 121.174 0.512 . . . . 0.0 110.57 179.727 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 12.9 pt20 -69.63 -32.5 71.23 Favored 'General case' 0 N--CA 1.444 -0.727 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.552 -179.022 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.557 ' HA ' ' NE ' ' A' ' 54' ' ' ARG . 6.9 mmp_? -59.61 -29.41 67.97 Favored 'General case' 0 C--N 1.344 0.337 0 CA-C-O 121.13 0.491 . . . . 0.0 111.465 177.319 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.436 HE21 ' HB2' ' A' ' 55' ' ' GLN . 3.4 mt-30 -89.36 -21.09 23.27 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-O 121.04 0.448 . . . . 0.0 111.046 179.57 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 84.8 28.58 31.48 Favored Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 120.855 -0.688 . . . . 0.0 112.272 179.476 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 27.3 m -133.05 153.37 80.88 Favored Pre-proline 0 C--N 1.324 -0.542 0 O-C-N 122.375 -0.486 . . . . 0.0 110.948 -178.656 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . 0.433 ' HB2' ' OD1' ' A' ' 60' ' ' ASN . 59.1 Cg_endo -77.6 164.57 28.14 Favored 'Trans proline' 0 N--CA 1.457 -0.63 0 C-N-CA 122.631 2.221 . . . . 0.0 112.417 177.864 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 42.0 mtt -69.75 -8.67 49.99 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-N 116.184 -0.462 . . . . 0.0 112.111 -177.415 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . 0.433 ' OD1' ' HB2' ' A' ' 58' ' ' PRO . 1.4 p-10 -92.7 -11.74 33.26 Favored 'General case' 0 C--N 1.312 -1.037 0 CA-C-O 121.319 0.581 . . . . 0.0 111.023 -177.649 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 50.0 m -88.43 -22.67 23.6 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-O 121.275 0.56 . . . . 0.0 111.314 -179.114 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -135.27 165.09 26.23 Favored 'General case' 0 C--N 1.307 -1.257 0 CA-C-O 121.372 0.606 . . . . 0.0 112.401 -176.954 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.568 ' O ' ' HA ' ' A' ' 90' ' ' VAL . 9.8 mtp180 -116.27 118.88 33.99 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.256 -178.123 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.501 ' HB3' ' OH ' ' A' ' 51' ' ' TYR . 0.2 OUTLIER -96.72 112.36 24.14 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-O 121.064 0.459 . . . . 0.0 110.671 177.515 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.455 ' C ' HD22 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -143.12 164.7 29.44 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-O 121.614 0.721 . . . . 0.0 111.928 -179.258 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 91.8 t80 -145.41 135.14 23.46 Favored 'General case' 0 C--N 1.31 -1.116 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 179.056 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.466 ' HG2' HE21 ' A' ' 69' ' ' GLN . 6.8 pt-20 49.19 27.81 1.95 Allowed 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 124.214 1.006 . . . . 0.0 112.292 -179.19 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 85.59 23.21 47.78 Favored Glycine 0 CA--C 1.523 0.591 0 C-N-CA 120.885 -0.674 . . . . 0.0 113.312 -178.817 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . 0.466 HE21 ' HG2' ' A' ' 67' ' ' GLU . 3.0 pt20 -131.75 134.27 45.68 Favored 'General case' 0 C--N 1.321 -0.655 0 O-C-N 122.191 -0.594 . . . . 0.0 109.452 179.341 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.499 ' CD ' ' H ' ' A' ' 70' ' ' ARG . 0.1 OUTLIER -73.58 145.03 45.78 Favored 'General case' 0 C--N 1.31 -1.131 0 CA-C-O 121.695 0.76 . . . . 0.0 110.497 178.113 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 23.0 mm -91.58 126.82 44.19 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.516 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.78 -176.671 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -102.15 165.49 11.12 Favored 'General case' 0 N--CA 1.44 -0.934 0 N-CA-C 109.891 -0.411 . . . . 0.0 109.891 179.906 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -69.22 -21.66 63.93 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-O 121.288 0.566 . . . . 0.0 111.562 -178.951 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 12.0 m-80 -98.26 1.45 47.23 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-O 121.369 0.604 . . . . 0.0 109.863 -179.803 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . 0.598 ' O ' ' HB2' ' A' ' 44' ' ' LEU . 5.2 m170 -79.85 142.32 35.36 Favored 'General case' 0 CA--C 1.505 -0.765 0 CA-C-N 116.14 -0.482 . . . . 0.0 109.948 179.933 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.447 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 66.7 p -118.51 154.5 52.36 Favored Pre-proline 0 C--N 1.304 -1.391 0 CA-C-N 116.751 -0.204 . . . . 0.0 110.637 178.514 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 24.9 Cg_exo -62.33 -37.51 60.51 Favored 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 122.429 2.086 . . . . 0.0 110.917 179.457 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . 0.544 ' HG3' ' N ' ' A' ' 79' ' ' GLU . 41.3 pttt -65.56 -43.22 90.51 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.794 -179.501 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . 0.544 ' N ' ' HG3' ' A' ' 78' ' ' LYS . 5.9 mm-40 -70.59 -40.32 73.33 Favored 'General case' 0 CA--C 1.509 -0.628 0 CA-C-O 120.902 0.382 . . . . 0.0 111.475 -177.919 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.447 ' HG ' ' O ' ' A' ' 76' ' ' THR . 5.2 mt -74.63 -10.47 59.57 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.328 0.585 . . . . 0.0 110.282 179.971 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 81.78 44.18 7.91 Favored Glycine 0 N--CA 1.45 -0.417 0 CA-C-N 115.887 -0.597 . . . . 0.0 113.246 176.698 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 57.2 mtt -100.99 166.31 10.88 Favored 'General case' 0 C--N 1.314 -0.94 0 N-CA-C 109.489 -0.559 . . . . 0.0 109.489 178.514 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . 0.445 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 12.8 pt-20 -135.31 -169.76 2.45 Favored 'General case' 0 C--N 1.311 -1.066 0 N-CA-C 109.662 -0.496 . . . . 0.0 109.662 177.162 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.422 ' HA ' ' HB ' ' A' ' 22' ' ' ILE . 11.3 pt-20 -73.64 143.29 46.35 Favored 'General case' 0 N--CA 1.445 -0.717 0 C-N-CA 120.306 -0.557 . . . . 0.0 110.156 179.183 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 70.25 8.91 6.84 Favored 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 123.437 0.695 . . . . 0.0 111.497 -179.935 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . 0.445 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 3.2 t0 -65.71 162.11 19.24 Favored 'General case' 0 C--O 1.24 0.562 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.155 175.893 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 11.6 p -127.54 142.81 42.59 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.443 0 CA-C-O 121.653 0.739 . . . . 0.0 111.48 -177.049 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . 0.48 ' HB ' HG22 ' A' ' 26' ' ' VAL . 3.6 mp -112.63 149.82 15.02 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.213 0 N-CA-C 107.885 -1.154 . . . . 0.0 107.885 178.288 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 20.3 tp10 -106.84 141.38 38.17 Favored 'General case' 0 C--N 1.308 -1.205 0 CA-C-O 120.958 0.409 . . . . 0.0 110.39 -175.144 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . 0.59 ' HB ' ' HA2' ' A' ' 28' ' ' GLY . 77.4 t -130.93 133.82 62.5 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.188 0 CA-C-O 120.986 0.422 . . . . 0.0 110.413 178.811 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 82.2 m-85 -117.86 173.29 6.84 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-O 120.753 0.311 . . . . 0.0 110.376 -178.566 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . 0.407 ' NE2' ' HG2' ' A' ' 29' ' ' GLN . 7.5 tp60 -103.41 133.39 48.55 Favored 'General case' 0 C--N 1.311 -1.074 0 CA-C-O 120.915 0.388 . . . . 0.0 110.966 -179.752 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 . . . . . 0 C--N 1.323 -0.579 0 CA-C-O 121.481 0.658 . . . . 0.0 110.201 176.137 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 22.4 pt . . . . . 0 N--CA 1.457 -0.124 0 CA-C-O 121.434 0.635 . . . . 0.0 110.607 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.421 ' HE3' ' HB2' ' A' ' 23' ' ' LYS . 31.5 mtmt -117.83 139.0 51.71 Favored 'General case' 0 C--N 1.308 -1.203 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.328 -178.106 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.4 mp -134.94 163.74 29.17 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-O 121.163 0.506 . . . . 0.0 110.816 176.704 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.478 ' NZ ' HD11 ' A' ' 27' ' ' ILE . 2.3 tmmt? -132.94 144.88 50.44 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-O 121.164 0.507 . . . . 0.0 110.344 179.878 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.615 HG23 ' HZ ' ' A' ' 36' ' ' PHE . 0.9 OUTLIER -114.83 142.3 28.16 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.286 0 CA-C-O 121.091 0.472 . . . . 0.0 111.351 179.121 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.478 HD11 ' NZ ' ' A' ' 25' ' ' LYS . 45.9 mm -104.89 112.69 39.55 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.213 0 N-CA-C 107.634 -1.247 . . . . 0.0 107.634 175.274 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -79.28 171.87 55.01 Favored Glycine 0 N--CA 1.424 -2.158 0 C-N-CA 120.447 -0.882 . . . . 0.0 112.565 -176.198 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.75 ' H ' ' NE2' ' A' ' 29' ' ' GLN . 0.0 OUTLIER -67.5 -23.01 65.42 Favored 'General case' 0 C--N 1.309 -1.183 0 CA-C-O 121.739 0.78 . . . . 0.0 109.573 179.082 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -97.83 12.42 34.01 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.315 -0.857 . . . . 0.0 109.362 177.465 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 49.5 m 70.24 15.81 7.42 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.809 -178.906 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 21.9 t -71.19 116.3 11.34 Favored 'General case' 0 N--CA 1.445 -0.677 0 CA-C-N 115.416 -0.811 . . . . 0.0 109.846 178.901 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.443 ' HA ' ' O ' ' A' ' 26' ' ' VAL . 32.4 mt-10 -89.4 108.69 19.78 Favored 'General case' 0 N--CA 1.445 -0.725 0 CA-C-O 121.226 0.536 . . . . 0.0 109.988 179.268 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 34.4 mm -97.79 138.79 21.59 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.371 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 179.4 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 13.3 m170 -116.95 129.6 56.15 Favored 'General case' 0 C--N 1.317 -0.829 0 N-CA-C 109.511 -0.551 . . . . 0.0 109.511 -178.387 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.615 ' HZ ' HG23 ' A' ' 26' ' ' VAL . 1.9 p90 -147.02 158.02 43.8 Favored 'General case' 0 C--N 1.307 -1.25 0 CA-C-O 121.477 0.656 . . . . 0.0 110.603 -179.158 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 47.1 mtmt -126.17 116.31 21.14 Favored 'General case' 0 C--N 1.301 -1.502 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.652 -178.593 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.426 HG21 HD12 ' A' ' 47' ' ' LEU . 17.6 m -132.81 163.85 36.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.525 -176.74 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.455 ' O ' HG22 ' A' ' 42' ' ' THR . 84.9 tttt -85.67 160.33 19.59 Favored 'General case' 0 C--N 1.316 -0.857 0 O-C-N 121.923 -0.486 . . . . 0.0 111.413 -178.279 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -70.39 -37.18 74.45 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.031 0.444 . . . . 0.0 112.154 -177.625 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 14.5 t -90.51 9.35 29.69 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.531 -177.79 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . 0.455 HG22 ' O ' ' A' ' 39' ' ' LYS . 1.2 t -92.06 167.73 11.87 Favored 'General case' 0 C--N 1.322 -0.591 0 C-N-CA 120.03 -0.668 . . . . 0.0 110.298 -178.482 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . 0.53 ' HB3' ' HG2' ' A' ' 45' ' ' LYS . 31.9 m170 -87.93 141.65 28.41 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-O 121.51 0.671 . . . . 0.0 111.589 -179.26 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.515 ' HB2' ' O ' ' A' ' 75' ' ' HIS . 0.6 OUTLIER -65.68 -19.26 65.83 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.554 -0.748 . . . . 0.0 111.515 179.944 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.53 ' HG2' ' HB3' ' A' ' 43' ' ' HIS . 7.5 ptpt -50.82 -49.24 59.08 Favored 'General case' 0 N--CA 1.463 0.188 0 N-CA-C 112.018 0.377 . . . . 0.0 112.018 -179.167 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.6 -29.67 69.06 Favored 'General case' 0 C--O 1.207 -1.162 0 CA-C-O 120.893 0.378 . . . . 0.0 111.239 -178.847 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.426 HD12 HG21 ' A' ' 38' ' ' VAL . 8.3 tt -70.71 -47.83 57.76 Favored 'General case' 0 C--N 1.311 -1.106 0 CA-C-O 121.3 0.571 . . . . 0.0 109.608 178.29 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.519 ' HD3' ' HA ' ' A' ' 45' ' ' LYS . 30.9 mtpt -58.82 -45.9 88.88 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.204 -179.718 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.87 -30.56 65.54 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 121.282 0.563 . . . . 0.0 110.713 -179.383 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 5.6 m -68.67 -44.43 74.09 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-N 115.984 -0.553 . . . . 0.0 112.089 -179.754 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.464 ' CE2' ' HA ' ' A' ' 48' ' ' LYS . 3.0 p90 -74.59 -33.55 62.66 Favored 'General case' 0 C--N 1.324 -0.541 0 C-N-CA 119.551 -0.86 . . . . 0.0 110.178 -178.936 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . 0.586 ' SG ' HD11 ' A' ' 62' ' ' LEU . 84.2 m -59.22 -46.87 87.31 Favored 'General case' 0 C--O 1.238 0.454 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.09 178.658 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 7.1 pt20 -68.06 -32.68 73.19 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 120.526 -0.469 . . . . 0.0 110.95 -179.217 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 1.6 mmp_? -59.42 -34.58 72.66 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-O 121.062 0.458 . . . . 0.0 111.662 177.669 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.405 ' NE2' ' HA ' ' A' ' 52' ' ' CYS . 3.2 mt-30 -81.81 -20.4 39.18 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-O 121.372 0.606 . . . . 0.0 110.286 179.034 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 82.2 28.9 39.04 Favored Glycine 0 N--CA 1.443 -0.872 0 CA-C-N 115.823 -0.626 . . . . 0.0 112.02 -179.994 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 33.9 m -131.45 145.95 59.83 Favored Pre-proline 0 C--N 1.326 -0.443 0 O-C-N 122.548 -0.384 . . . . 0.0 110.74 -179.313 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . 0.446 ' HG2' ' OG ' ' A' ' 61' ' ' SER . 28.0 Cg_endo -65.05 150.49 87.88 Favored 'Trans proline' 0 C--O 1.24 0.599 0 C-N-CA 122.513 2.142 . . . . 0.0 112.228 178.505 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.524 ' HG2' ' SG ' ' A' ' 52' ' ' CYS . 77.8 mtp -66.16 -13.66 60.57 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.851 -177.849 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 30.7 p30 -84.39 -12.78 53.85 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 121.507 0.67 . . . . 0.0 110.929 -178.456 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.446 ' OG ' ' HG2' ' A' ' 58' ' ' PRO . 70.6 m -87.79 -20.42 26.15 Favored 'General case' 0 C--N 1.309 -1.176 0 N-CA-C 112.407 0.521 . . . . 0.0 112.407 -178.072 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.586 HD11 ' SG ' ' A' ' 52' ' ' CYS . 1.4 pp -127.05 171.98 10.9 Favored 'General case' 0 C--N 1.309 -1.187 0 N-CA-C 113.487 0.921 . . . . 0.0 113.487 -176.327 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.468 ' O ' ' HA ' ' A' ' 90' ' ' VAL . 46.6 mtm180 -122.88 122.45 38.66 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.25 -0.886 . . . . 0.0 110.55 -177.358 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -105.5 118.63 37.07 Favored 'General case' 0 C--N 1.313 -1.007 0 CA-C-O 121.173 0.511 . . . . 0.0 111.248 179.561 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.464 ' HA ' HG12 ' A' ' 71' ' ' ILE . 0.0 OUTLIER -146.26 164.58 31.87 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 121.41 0.624 . . . . 0.0 111.034 179.613 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 88.1 t80 -142.88 134.92 27.12 Favored 'General case' 0 C--N 1.31 -1.143 0 N-CA-C 108.978 -0.749 . . . . 0.0 108.978 179.455 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.469 ' HG2' HE21 ' A' ' 69' ' ' GLN . 5.6 pt-20 49.95 26.94 2.19 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 123.96 0.904 . . . . 0.0 112.268 -178.968 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 85.1 21.5 55.02 Favored Glycine 0 CA--C 1.523 0.534 0 C-N-CA 120.99 -0.624 . . . . 0.0 113.57 -178.598 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . 0.469 HE21 ' HG2' ' A' ' 67' ' ' GLU . 3.2 pt20 -128.23 134.91 49.07 Favored 'General case' 0 C--N 1.322 -0.622 0 O-C-N 122.245 -0.562 . . . . 0.0 109.548 179.69 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -64.52 145.01 56.78 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-O 121.677 0.751 . . . . 0.0 111.09 177.473 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.464 HG12 ' HA ' ' A' ' 65' ' ' LEU . 22.3 mm -97.15 118.11 42.99 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.29 0 CA-C-O 121.142 0.496 . . . . 0.0 110.117 179.634 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -89.67 162.55 15.54 Favored 'General case' 0 N--CA 1.437 -1.116 0 N-CA-C 109.457 -0.572 . . . . 0.0 109.457 -179.83 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . 0.441 ' HB3' ' HB3' ' A' ' 45' ' ' LYS . 67.4 m-20 -65.47 -25.43 67.49 Favored 'General case' 0 C--N 1.313 -0.993 0 CA-C-O 121.609 0.719 . . . . 0.0 110.318 179.093 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 7.4 m-80 -97.46 9.21 42.99 Favored 'General case' 0 C--N 1.312 -1.041 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.178 -179.254 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . 0.515 ' O ' ' HB2' ' A' ' 44' ' ' LEU . 2.2 m170 -84.54 141.2 30.9 Favored 'General case' 0 CA--C 1.504 -0.798 0 N-CA-C 109.398 -0.593 . . . . 0.0 109.398 179.234 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.411 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 70.7 p -118.65 154.64 52.65 Favored Pre-proline 0 C--N 1.306 -1.324 0 C-N-CA 121.099 -0.24 . . . . 0.0 110.435 -179.891 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_exo -59.99 -39.47 70.34 Favored 'Trans proline' 0 N--CA 1.457 -0.637 0 C-N-CA 122.37 2.047 . . . . 0.0 111.459 179.861 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . 0.511 ' HG3' ' N ' ' A' ' 79' ' ' GLU . 37.6 pttt -68.96 -38.53 79.45 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 120.974 0.416 . . . . 0.0 111.163 -178.463 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . 0.511 ' N ' ' HG3' ' A' ' 78' ' ' LYS . 11.1 mm-40 -72.4 -34.07 67.61 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-O 120.994 0.426 . . . . 0.0 110.896 -178.266 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.437 HD21 ' CG ' ' A' ' 75' ' ' HIS . 5.8 mt -84.63 2.11 43.07 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.24 0.543 . . . . 0.0 111.021 179.624 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 73.84 41.2 42.5 Favored Glycine 0 C--O 1.237 0.335 0 C-N-CA 120.99 -0.624 . . . . 0.0 112.964 177.199 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 63.9 mtt -100.01 164.88 11.8 Favored 'General case' 0 C--N 1.313 -1.012 0 N-CA-C 109.233 -0.654 . . . . 0.0 109.233 178.857 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . 0.413 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 11.5 pt-20 -144.23 -170.4 3.35 Favored 'General case' 0 C--N 1.31 -1.12 0 N-CA-C 110.096 -0.335 . . . . 0.0 110.096 178.606 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -64.44 141.53 58.74 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 120.707 0.289 . . . . 0.0 110.372 178.926 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 73.42 1.2 3.9 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 123.558 0.743 . . . . 0.0 112.211 176.814 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . 0.413 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 1.5 t70 -61.89 160.87 11.35 Favored 'General case' 0 N--CA 1.476 0.871 0 CA-C-O 121.364 0.602 . . . . 0.0 111.521 -179.546 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . 0.411 ' HA ' ' O ' ' A' ' 25' ' ' LYS . 7.8 p -128.45 143.91 39.57 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.953 0 CA-C-O 121.429 0.633 . . . . 0.0 111.494 -177.09 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . 0.436 ' HB ' HG22 ' A' ' 26' ' ' VAL . 3.7 mp -113.2 151.92 15.0 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.802 0 N-CA-C 109.245 -0.65 . . . . 0.0 109.245 179.144 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . 0.424 ' O ' HD13 ' A' ' 65' ' ' LEU . 6.2 tp10 -104.69 137.06 43.07 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.947 0.403 . . . . 0.0 110.47 -176.531 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . 0.468 ' HA ' ' O ' ' A' ' 63' ' ' ARG . 95.2 t -128.54 132.45 67.9 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.852 0 CA-C-O 121.282 0.563 . . . . 0.0 111.482 179.088 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 77.1 m-85 -115.0 179.17 4.03 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 178.663 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 7.9 tp60 -106.65 144.61 33.06 Favored 'General case' 0 C--N 1.311 -1.096 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 178.614 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' GLU . . . . . 0.416 ' HB3' ' HG3' ' A' ' 63' ' ' ARG . 7.4 pt-20 . . . . . 0 C--N 1.324 -0.515 0 CA-C-O 121.103 0.478 . . . . 0.0 110.706 176.253 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . 0.408 ' HB ' ' HA ' ' A' ' 84' ' ' GLU . 18.5 pt . . . . . 0 N--CA 1.445 -0.722 0 CA-C-O 121.6 0.714 . . . . 0.0 110.427 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 31.5 mtmt -116.98 142.37 47.03 Favored 'General case' 0 C--N 1.299 -1.618 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 -179.04 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.0 mp -136.79 164.71 27.63 Favored 'General case' 0 C--N 1.308 -1.198 0 CA-C-O 121.187 0.518 . . . . 0.0 110.713 175.218 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.407 ' HE2' ' HB3' ' A' ' 25' ' ' LYS . 5.3 tmmm? -136.79 143.18 43.05 Favored 'General case' 0 C--N 1.313 -1.003 0 CA-C-O 121.254 0.55 . . . . 0.0 110.544 -178.982 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.558 HG23 ' HZ ' ' A' ' 36' ' ' PHE . 1.0 OUTLIER -114.62 142.16 28.42 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.251 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.651 -179.647 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.45 HD13 ' HG2' ' A' ' 33' ' ' GLU . 32.9 mm -111.05 97.59 5.94 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.007 0 N-CA-C 108.117 -1.068 . . . . 0.0 108.117 175.752 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . 0.592 ' HA2' ' HB ' ' A' ' 90' ' ' VAL . . . -65.86 167.74 33.76 Favored Glycine 0 N--CA 1.437 -1.286 0 C-N-CA 120.506 -0.854 . . . . 0.0 113.127 178.924 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.22 -18.8 28.8 Favored 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 112.586 0.587 . . . . 0.0 112.586 177.753 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -102.76 13.49 34.28 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-O 121.519 0.676 . . . . 0.0 109.932 179.861 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 49.7 m 73.68 21.38 2.81 Favored 'General case' 0 CA--C 1.509 -0.617 0 CA-C-O 122.629 1.204 . . . . 0.0 108.39 -178.508 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -67.68 96.14 0.53 Allowed 'General case' 0 N--CA 1.424 -1.745 0 CA-C-N 113.362 -1.744 . . . . 0.0 111.474 -178.641 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.483 ' HA ' ' O ' ' A' ' 26' ' ' VAL . 15.0 mt-10 -78.74 104.32 9.28 Favored 'General case' 0 CA--C 1.496 -1.107 0 CA-C-O 121.138 0.494 . . . . 0.0 110.69 177.447 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.532 HG21 ' HA ' ' A' ' 51' ' ' TYR . 33.1 mm -97.67 132.58 42.14 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.319 0 N-CA-C 108.159 -1.052 . . . . 0.0 108.159 175.457 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 12.4 m170 -116.92 121.95 42.91 Favored 'General case' 0 C--N 1.317 -0.823 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 -176.958 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.558 ' HZ ' HG23 ' A' ' 26' ' ' VAL . 1.5 p90 -137.93 162.26 34.5 Favored 'General case' 0 C--N 1.308 -1.225 0 CA-C-O 121.379 0.609 . . . . 0.0 111.292 -177.38 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 15.5 mtpt -124.38 115.84 21.61 Favored 'General case' 0 C--N 1.313 -0.979 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.646 -178.793 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 32.8 m -134.03 166.48 28.75 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.435 0 CA-C-O 121.073 0.463 . . . . 0.0 110.735 -178.296 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.515 ' O ' HG22 ' A' ' 42' ' ' THR . 84.2 tttt -89.65 167.85 12.59 Favored 'General case' 0 C--N 1.313 -1.021 0 O-C-N 122.035 -0.416 . . . . 0.0 110.538 -178.541 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -79.11 -37.12 39.48 Favored 'General case' 0 N--CA 1.464 0.26 0 N-CA-C 112.626 0.602 . . . . 0.0 112.626 -178.131 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 13.5 t -93.84 19.86 8.36 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-O 121.079 0.466 . . . . 0.0 111.688 -176.682 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . 0.515 HG22 ' O ' ' A' ' 39' ' ' LYS . 6.7 t -99.76 173.28 6.77 Favored 'General case' 0 C--N 1.32 -0.708 0 O-C-N 122.006 -0.434 . . . . 0.0 109.961 179.844 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 29.8 m170 -88.04 142.31 27.88 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-O 121.491 0.662 . . . . 0.0 111.354 179.116 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.599 ' O ' ' HG3' ' A' ' 48' ' ' LYS . 0.2 OUTLIER -69.92 -18.34 63.37 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.54 -0.755 . . . . 0.0 109.725 -179.19 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.676 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -53.89 -44.71 70.71 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-N 115.849 -0.614 . . . . 0.0 112.305 -177.932 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.484 ' N ' ' HD3' ' A' ' 45' ' ' LYS . 21.8 ptmt -67.41 -28.17 67.69 Favored 'General case' 0 CA--C 1.517 -0.29 0 CA-C-O 121.449 0.643 . . . . 0.0 110.538 -178.156 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.538 ' HB3' HD13 ' A' ' 44' ' ' LEU . 7.9 tt -72.08 -47.44 51.39 Favored 'General case' 0 C--N 1.313 -1.01 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.886 179.083 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.599 ' HG3' ' O ' ' A' ' 44' ' ' LEU . 29.5 mtpt -58.69 -48.3 81.59 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.419 -179.233 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.676 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 5.6 pt-20 -68.83 -31.9 71.21 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.709 -179.281 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . 0.401 ' O ' ' HG2' ' A' ' 54' ' ' ARG . 28.8 t -67.44 -46.11 74.07 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-O 121.028 0.442 . . . . 0.0 111.234 -178.998 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.532 ' HA ' HG21 ' A' ' 34' ' ' ILE . 2.0 p90 -75.83 -32.78 59.95 Favored 'General case' 0 N--CA 1.445 -0.683 0 C-N-CA 119.801 -0.76 . . . . 0.0 110.544 -177.217 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . 0.547 ' SG ' ' HG2' ' A' ' 59' ' ' MET . 86.8 m -62.58 -44.41 96.38 Favored 'General case' 0 C--O 1.238 0.489 0 CA-C-O 120.85 0.357 . . . . 0.0 110.792 179.163 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 11.8 pt20 -67.96 -32.97 73.77 Favored 'General case' 0 N--CA 1.447 -0.585 0 C-N-CA 120.668 -0.413 . . . . 0.0 110.527 -179.828 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.401 ' HG2' ' O ' ' A' ' 50' ' ' SER . 15.9 mmt180 -57.78 -45.07 86.49 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-O 121.292 0.568 . . . . 0.0 111.115 177.433 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.449 ' NE2' ' HA ' ' A' ' 52' ' ' CYS . 3.2 mt-30 -71.36 -20.62 62.14 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.629 179.441 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 79.98 30.51 42.52 Favored Glycine 0 N--CA 1.441 -1.03 0 C-N-CA 120.861 -0.685 . . . . 0.0 111.558 -179.774 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 25.9 m -129.21 152.79 80.01 Favored Pre-proline 0 C--N 1.323 -0.555 0 O-C-N 122.502 -0.411 . . . . 0.0 110.723 -178.592 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . 0.431 ' HG2' ' OG ' ' A' ' 61' ' ' SER . 43.2 Cg_endo -71.45 150.61 58.27 Favored 'Trans proline' 0 N--CA 1.455 -0.772 0 C-N-CA 122.347 2.031 . . . . 0.0 111.903 177.538 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.547 ' HG2' ' SG ' ' A' ' 52' ' ' CYS . 79.8 mtp -70.37 -9.93 57.63 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.451 -177.443 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 33.6 p30 -84.52 -16.4 42.46 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.241 0.543 . . . . 0.0 111.365 -179.244 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.431 ' OG ' ' HG2' ' A' ' 58' ' ' PRO . 69.2 m -89.72 -20.63 23.36 Favored 'General case' 0 C--N 1.311 -1.101 0 N-CA-C 112.877 0.695 . . . . 0.0 112.877 -175.367 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.475 HD11 ' SG ' ' A' ' 52' ' ' CYS . 1.4 pp -124.09 170.95 10.17 Favored 'General case' 0 C--N 1.306 -1.309 0 N-CA-C 112.945 0.72 . . . . 0.0 112.945 -177.446 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.479 ' O ' ' HA ' ' A' ' 90' ' ' VAL . 47.2 mtm180 -121.66 120.76 35.67 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.674 -0.693 . . . . 0.0 110.844 -177.099 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -102.64 115.33 30.36 Favored 'General case' 0 C--N 1.311 -1.105 0 CA-C-O 121.084 0.469 . . . . 0.0 111.024 179.166 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.462 ' C ' HD22 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -144.38 164.15 31.67 Favored 'General case' 0 N--CA 1.445 -0.688 0 CA-C-O 121.469 0.652 . . . . 0.0 111.238 -179.769 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 83.2 t80 -143.62 134.15 24.88 Favored 'General case' 0 C--N 1.309 -1.192 0 N-CA-C 109.565 -0.532 . . . . 0.0 109.565 179.192 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.417 ' HG2' HE21 ' A' ' 69' ' ' GLN . 6.9 pt-20 49.91 26.86 2.13 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 124.214 1.006 . . . . 0.0 112.75 -179.99 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 87.45 20.89 50.44 Favored Glycine 0 N--CA 1.447 -0.613 0 C-N-CA 120.949 -0.643 . . . . 0.0 113.211 -179.596 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . 0.417 HE21 ' HG2' ' A' ' 67' ' ' GLU . 2.9 pt20 -128.55 134.34 48.62 Favored 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 108.766 -0.827 . . . . 0.0 108.766 179.181 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.443 ' HE ' ' HB2' ' A' ' 70' ' ' ARG . 0.0 OUTLIER -72.44 144.95 47.94 Favored 'General case' 0 C--N 1.309 -1.157 0 O-C-N 121.66 -0.65 . . . . 0.0 110.706 179.349 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.417 HG21 HD12 ' A' ' 44' ' ' LEU . 22.3 mm -91.44 121.61 42.06 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.243 0 CA-C-O 121.321 0.582 . . . . 0.0 110.791 -178.276 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.423 ' O ' ' HB2' ' A' ' 75' ' ' HIS . . . -94.47 162.2 13.91 Favored 'General case' 0 N--CA 1.435 -1.18 0 N-CA-C 109.384 -0.598 . . . . 0.0 109.384 179.185 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 46.4 m-20 -69.42 -26.28 64.54 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-O 121.435 0.636 . . . . 0.0 110.558 -178.986 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 5.5 m-80 -93.19 4.72 53.52 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-O 121.311 0.577 . . . . 0.0 109.655 -178.763 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . 0.598 ' O ' ' HB2' ' A' ' 44' ' ' LEU . 8.4 m170 -83.13 146.22 28.78 Favored 'General case' 0 CA--C 1.496 -1.099 0 CA-C-N 116.222 -0.444 . . . . 0.0 109.906 -179.349 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 57.3 p -120.86 154.42 57.58 Favored Pre-proline 0 C--N 1.304 -1.412 0 C-N-CA 120.815 -0.354 . . . . 0.0 111.209 178.894 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -58.93 -39.72 78.38 Favored 'Trans proline' 0 C--N 1.348 0.508 0 C-N-CA 122.673 2.249 . . . . 0.0 111.758 179.334 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . 0.493 ' HG3' ' N ' ' A' ' 79' ' ' GLU . 29.0 pttt -68.92 -36.37 77.92 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.208 0.528 . . . . 0.0 110.792 -178.301 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . 0.493 ' N ' ' HG3' ' A' ' 78' ' ' LYS . 33.5 mm-40 -72.38 -41.16 66.64 Favored 'General case' 0 N--CA 1.444 -0.74 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.903 -179.124 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 5.5 mt -78.35 -3.51 43.43 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.084 0.468 . . . . 0.0 111.402 -179.011 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 78.14 45.0 10.63 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 121.001 -0.619 . . . . 0.0 112.858 177.153 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 61.0 mtt -105.05 164.98 11.4 Favored 'General case' 0 C--N 1.313 -1.019 0 N-CA-C 110.008 -0.367 . . . . 0.0 110.008 179.162 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -145.21 -169.64 3.25 Favored 'General case' 0 C--N 1.314 -0.97 0 N-CA-C 109.915 -0.402 . . . . 0.0 109.915 177.54 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.408 ' HA ' ' HB ' ' A' ' 22' ' ' ILE . 13.9 pt-20 -70.54 139.67 51.6 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 121.117 0.484 . . . . 0.0 110.98 -179.63 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 75.43 2.46 3.84 Favored 'General case' 0 C--O 1.239 0.531 0 C-N-CA 124.487 1.115 . . . . 0.0 111.266 179.969 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 7.9 t0 -62.34 157.54 19.57 Favored 'General case' 0 C--O 1.239 0.51 0 CA-C-O 121.37 0.605 . . . . 0.0 110.639 177.9 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 7.7 p -125.45 142.94 40.7 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.231 0 CA-C-O 121.457 0.646 . . . . 0.0 111.533 -176.485 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 3.6 mp -113.15 152.05 14.93 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.924 0 N-CA-C 108.809 -0.811 . . . . 0.0 108.809 178.704 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . 0.4 ' O ' HD13 ' A' ' 65' ' ' LEU . 13.8 tp10 -106.61 139.3 41.28 Favored 'General case' 0 C--N 1.314 -0.962 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 -176.4 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . 0.592 ' HB ' ' HA2' ' A' ' 28' ' ' GLY . 88.0 t -130.61 136.08 59.07 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.084 0 CA-C-O 121.358 0.599 . . . . 0.0 110.747 178.694 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 88.2 m-85 -120.39 -178.9 3.8 Favored 'General case' 0 C--N 1.311 -1.099 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 178.813 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 7.5 tp60 -105.76 148.96 26.89 Favored 'General case' 0 C--N 1.307 -1.247 0 N-CA-C 109.512 -0.551 . . . . 0.0 109.512 178.559 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 . . . . . 0 N--CA 1.469 0.52 0 CA-C-O 121.053 0.454 . . . . 0.0 111.076 175.975 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . 0.455 ' HB ' ' HA ' ' A' ' 84' ' ' GLU . 18.6 pt . . . . . 0 N--CA 1.436 -1.145 0 CA-C-O 121.305 0.574 . . . . 0.0 109.775 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 9.1 mtmt -118.27 140.57 49.61 Favored 'General case' 0 C--N 1.298 -1.667 0 N-CA-C 109.152 -0.684 . . . . 0.0 109.152 -178.387 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.5 mp -137.04 162.28 33.75 Favored 'General case' 0 C--N 1.305 -1.36 0 CA-C-O 121.354 0.597 . . . . 0.0 110.827 176.375 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.47 ' HG3' ' CD2' ' A' ' 35' ' ' HIS . 3.7 tmmt? -134.68 143.73 47.39 Favored 'General case' 0 C--N 1.308 -1.235 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.396 179.974 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.608 HG11 ' CD1' ' A' ' 51' ' ' TYR . 0.9 OUTLIER -114.29 141.13 31.71 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.538 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.3 178.576 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 32.0 mm -111.43 99.22 8.24 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.025 0 N-CA-C 108.403 -0.962 . . . . 0.0 108.403 175.414 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . 0.56 ' HA2' ' HB ' ' A' ' 90' ' ' VAL . . . -66.0 164.24 40.11 Favored Glycine 0 N--CA 1.424 -2.162 0 C-N-CA 120.63 -0.795 . . . . 0.0 113.625 179.124 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.41 ' HG3' ' H ' ' A' ' 29' ' ' GLN . 0.0 OUTLIER -62.06 -23.72 66.65 Favored 'General case' 0 C--N 1.308 -1.207 0 C-N-CA 123.785 0.834 . . . . 0.0 110.528 177.902 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -91.78 11.55 24.31 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.279 -0.873 . . . . 0.0 109.518 179.197 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 48.0 m 70.17 14.98 7.63 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-O 121.785 0.802 . . . . 0.0 110.319 -179.254 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 8.4 t -73.34 103.86 4.16 Favored 'General case' 0 N--CA 1.443 -0.801 0 CA-C-N 115.082 -0.963 . . . . 0.0 110.469 179.397 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.46 ' HA ' ' O ' ' A' ' 26' ' ' VAL . 1.3 mp0 -85.11 107.47 17.21 Favored 'General case' 0 CA--C 1.511 -0.543 0 CA-C-O 121.246 0.546 . . . . 0.0 109.981 178.834 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.423 HG21 ' HA ' ' A' ' 51' ' ' TYR . 29.8 mm -100.42 138.75 23.71 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.283 0 N-CA-C 109.72 -0.474 . . . . 0.0 109.72 -179.194 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . 0.47 ' CD2' ' HG3' ' A' ' 25' ' ' LYS . 11.6 m170 -118.38 131.38 56.3 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 -179.305 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.508 ' HZ ' HG23 ' A' ' 26' ' ' VAL . 1.1 p90 -146.91 151.08 36.46 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-O 121.207 0.527 . . . . 0.0 111.305 -177.38 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 41.9 mmtm -108.78 119.61 40.05 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 -179.558 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 35.6 m -137.37 161.04 35.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-O 121.397 0.618 . . . . 0.0 111.331 -179.167 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.481 ' O ' HG22 ' A' ' 42' ' ' THR . 10.5 mmmt -83.28 161.12 21.56 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.78 178.896 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -74.71 -36.27 62.71 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-O 121.001 0.429 . . . . 0.0 111.319 179.833 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 8.5 t -94.19 10.76 32.65 Favored 'General case' 0 N--CA 1.443 -0.803 0 CA-C-O 121.405 0.621 . . . . 0.0 111.766 -177.085 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . 0.481 HG22 ' O ' ' A' ' 39' ' ' LYS . 2.0 t -92.48 169.09 10.82 Favored 'General case' 0 C--N 1.323 -0.55 0 O-C-N 121.688 -0.633 . . . . 0.0 109.862 -178.857 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 27.9 m170 -82.77 141.89 32.0 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-O 121.483 0.659 . . . . 0.0 111.821 -179.795 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.645 ' O ' ' HG3' ' A' ' 48' ' ' LYS . 0.2 OUTLIER -70.48 -18.14 62.97 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 115.421 -0.808 . . . . 0.0 109.922 -179.662 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.669 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -52.32 -45.31 65.55 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.068 -0.514 . . . . 0.0 112.117 -178.467 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.42 ' N ' ' HD3' ' A' ' 45' ' ' LYS . 16.3 ptmt -65.63 -29.59 70.18 Favored 'General case' 0 C--O 1.218 -0.581 0 CA-C-O 121.42 0.629 . . . . 0.0 110.47 -178.066 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.599 ' HB3' HD13 ' A' ' 44' ' ' LEU . 7.9 tt -73.86 -45.7 49.42 Favored 'General case' 0 C--N 1.309 -1.188 0 CA-C-N 115.481 -0.781 . . . . 0.0 109.716 179.939 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.645 ' HG3' ' O ' ' A' ' 44' ' ' LEU . 26.9 mtpt -58.7 -50.17 74.86 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-O 121.38 0.609 . . . . 0.0 110.156 -179.15 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.669 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 8.3 pt-20 -68.33 -33.76 74.89 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.865 -178.294 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 31.3 t -65.46 -46.74 78.65 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-O 121.201 0.524 . . . . 0.0 111.341 -178.674 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.608 ' CD1' HG11 ' A' ' 26' ' ' VAL . 1.6 p90 -76.43 -33.14 58.79 Favored 'General case' 0 N--CA 1.441 -0.878 0 C-N-CA 120.061 -0.656 . . . . 0.0 110.541 -176.836 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . 0.502 ' SG ' HD11 ' A' ' 62' ' ' LEU . 88.1 m -62.36 -45.36 93.53 Favored 'General case' 0 CA--C 1.509 -0.609 0 CA-C-O 121.098 0.475 . . . . 0.0 110.674 -179.97 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 13.5 pt20 -69.49 -32.36 71.19 Favored 'General case' 0 N--CA 1.441 -0.908 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.545 -179.269 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 30.8 mmt180 -57.2 -40.48 77.52 Favored 'General case' 0 C--N 1.342 0.278 0 CA-C-O 121.25 0.548 . . . . 0.0 110.834 176.937 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 3.0 mt-30 -78.25 -21.04 50.5 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.874 179.616 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 80.73 34.03 28.94 Favored Glycine 0 N--CA 1.443 -0.883 0 C-N-CA 120.946 -0.645 . . . . 0.0 112.163 179.705 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 34.7 m -134.25 150.44 74.07 Favored Pre-proline 0 C--N 1.325 -0.469 0 O-C-N 122.567 -0.373 . . . . 0.0 110.553 -179.918 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . 0.49 ' HG2' ' OG ' ' A' ' 61' ' ' SER . 37.1 Cg_endo -66.8 150.18 83.37 Favored 'Trans proline' 0 C--O 1.239 0.56 0 C-N-CA 122.496 2.131 . . . . 0.0 112.354 179.243 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.469 ' HG2' ' SG ' ' A' ' 52' ' ' CYS . 78.2 mtp -70.39 -14.32 62.51 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.396 -177.163 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 2.0 p-10 -88.73 -9.16 52.91 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-O 121.031 0.443 . . . . 0.0 111.899 -178.547 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.49 ' OG ' ' HG2' ' A' ' 58' ' ' PRO . 73.1 m -94.2 -16.51 23.61 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 112.195 0.442 . . . . 0.0 112.195 179.67 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.502 HD11 ' SG ' ' A' ' 52' ' ' CYS . 1.3 pp -125.44 162.49 24.72 Favored 'General case' 0 C--N 1.315 -0.896 0 N-CA-C 113.056 0.762 . . . . 0.0 113.056 -178.796 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.555 ' HB2' ' HB2' ' A' ' 91' ' ' TYR . 3.2 mmp_? -109.19 118.4 36.64 Favored 'General case' 0 C--N 1.311 -1.07 0 CA-C-N 115.078 -0.965 . . . . 0.0 110.801 -177.876 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.432 ' HB3' ' OH ' ' A' ' 51' ' ' TYR . 0.2 OUTLIER -102.54 113.05 26.08 Favored 'General case' 0 C--N 1.304 -1.372 0 CA-C-O 121.102 0.477 . . . . 0.0 110.388 176.044 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.454 ' C ' HD22 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -142.67 163.6 32.38 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-O 121.555 0.693 . . . . 0.0 111.231 -179.226 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 89.7 t80 -143.41 134.48 25.64 Favored 'General case' 0 C--N 1.309 -1.173 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 179.323 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.457 ' HG2' HE21 ' A' ' 69' ' ' GLN . 8.4 pt-20 49.25 27.59 1.92 Allowed 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 124.04 0.936 . . . . 0.0 112.421 -179.51 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 85.64 22.28 50.88 Favored Glycine 0 CA--C 1.521 0.461 0 C-N-CA 121.069 -0.586 . . . . 0.0 113.167 -179.676 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . 0.457 HE21 ' HG2' ' A' ' 67' ' ' GLU . 2.9 pt20 -129.81 135.67 48.69 Favored 'General case' 0 C--N 1.323 -0.556 0 O-C-N 122.235 -0.567 . . . . 0.0 109.697 179.887 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -64.8 148.31 51.51 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-O 121.55 0.691 . . . . 0.0 110.988 177.764 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.459 HG21 HD12 ' A' ' 44' ' ' LEU . 22.6 mm -100.0 117.3 44.98 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.407 0 CA-C-O 121.101 0.476 . . . . 0.0 109.954 178.435 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.432 ' O ' ' HB2' ' A' ' 75' ' ' HIS . . . -93.79 163.77 13.39 Favored 'General case' 0 N--CA 1.436 -1.137 0 N-CA-C 109.755 -0.461 . . . . 0.0 109.755 -179.898 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 26.4 m-20 -69.82 -24.52 63.48 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-O 121.354 0.597 . . . . 0.0 111.064 -178.141 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 7.1 m-80 -95.38 5.56 51.31 Favored 'General case' 0 C--N 1.313 -1.001 0 CA-C-O 121.414 0.626 . . . . 0.0 109.42 -179.802 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . 0.56 ' O ' ' HB2' ' A' ' 44' ' ' LEU . 2.3 m170 -84.08 147.28 27.46 Favored 'General case' 0 CA--C 1.503 -0.853 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 -179.874 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.466 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 68.7 p -123.07 155.15 64.7 Favored Pre-proline 0 C--N 1.306 -1.316 0 CA-C-O 120.548 0.213 . . . . 0.0 110.949 179.255 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_exo -59.96 -38.62 77.43 Favored 'Trans proline' 0 N--CA 1.458 -0.581 0 C-N-CA 122.435 2.09 . . . . 0.0 111.277 178.724 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . 0.519 ' HG3' ' N ' ' A' ' 79' ' ' GLU . 33.7 pttt -67.09 -40.1 86.89 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.232 -178.663 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . 0.519 ' N ' ' HG3' ' A' ' 78' ' ' LYS . 65.7 mm-40 -72.88 -36.85 67.43 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-O 121.178 0.513 . . . . 0.0 110.937 -178.763 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.466 ' HG ' ' O ' ' A' ' 76' ' ' THR . 5.4 mt -79.64 -3.02 45.31 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.198 0.523 . . . . 0.0 110.895 -179.651 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 75.51 42.16 27.97 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 121.145 -0.55 . . . . 0.0 112.9 177.635 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 64.0 mtt -99.78 162.75 12.81 Favored 'General case' 0 C--N 1.312 -1.054 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 179.111 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . 0.525 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 11.3 pt-20 -142.42 -170.42 3.18 Favored 'General case' 0 C--N 1.31 -1.115 0 N-CA-C 109.975 -0.38 . . . . 0.0 109.975 177.641 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.455 ' HA ' ' HB ' ' A' ' 22' ' ' ILE . 11.3 pt-20 -70.65 143.84 51.29 Favored 'General case' 0 N--CA 1.441 -0.886 0 C-N-CA 120.121 -0.631 . . . . 0.0 110.644 -179.132 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 74.51 3.0 4.22 Favored 'General case' 0 C--N 1.322 -0.587 0 C-N-CA 124.078 0.951 . . . . 0.0 111.192 178.818 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . 0.525 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 1.8 t0 -63.11 158.48 19.64 Favored 'General case' 0 CA--C 1.513 -0.463 0 CA-C-O 121.325 0.584 . . . . 0.0 110.727 178.452 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 9.3 p -127.66 144.25 38.1 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.539 0 CA-C-O 121.351 0.595 . . . . 0.0 111.077 -177.496 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . 0.444 ' HB ' HG22 ' A' ' 26' ' ' VAL . 3.6 mp -112.24 149.91 14.66 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.066 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 178.129 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . 0.419 ' O ' HD13 ' A' ' 65' ' ' LEU . 8.9 tp10 -104.72 137.52 42.41 Favored 'General case' 0 C--N 1.312 -1.041 0 N-CA-C 109.611 -0.514 . . . . 0.0 109.611 -176.001 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . 0.56 ' HB ' ' HA2' ' A' ' 28' ' ' GLY . 65.3 t -126.12 131.9 71.13 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.895 0 CA-C-O 121.186 0.517 . . . . 0.0 111.08 178.81 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . 0.555 ' HB2' ' HB2' ' A' ' 63' ' ' ARG . 67.3 m-85 -114.18 176.15 5.16 Favored 'General case' 0 C--N 1.315 -0.909 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 179.644 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 10.4 tp60 -109.19 130.49 55.49 Favored 'General case' 0 C--N 1.304 -1.392 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 179.513 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 . . . . . 0 C--N 1.32 -0.709 0 CA-C-O 121.207 0.527 . . . . 0.0 110.45 178.038 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . 0.426 ' HB ' ' HA ' ' A' ' 84' ' ' GLU . 23.4 pt . . . . . 0 N--CA 1.447 -0.619 0 CA-C-O 121.212 0.529 . . . . 0.0 110.13 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.5 ' HD3' ' N ' ' A' ' 23' ' ' LYS . 0.0 OUTLIER -121.14 143.07 49.3 Favored 'General case' 0 C--N 1.305 -1.35 0 N-CA-C 108.815 -0.809 . . . . 0.0 108.815 -178.751 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.5 mp -136.28 159.34 42.06 Favored 'General case' 0 C--N 1.3 -1.559 0 CA-C-O 121.194 0.521 . . . . 0.0 110.982 176.662 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.42 ' O ' ' HA ' ' A' ' 87' ' ' VAL . 5.3 tmmm? -126.82 142.45 51.54 Favored 'General case' 0 N--CA 1.439 -0.999 0 CA-C-O 121.513 0.673 . . . . 0.0 110.458 -179.404 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.501 HG11 ' CD1' ' A' ' 51' ' ' TYR . 0.9 OUTLIER -117.57 142.23 32.72 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.458 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.975 -179.581 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.506 ' O ' ' HB ' ' A' ' 90' ' ' VAL . 48.5 mm -103.68 118.63 51.07 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.289 0 N-CA-C 107.164 -1.421 . . . . 0.0 107.164 174.318 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . 0.444 ' HA2' ' HB ' ' A' ' 90' ' ' VAL . . . -90.71 162.94 29.37 Favored Glycine 0 N--CA 1.419 -2.462 0 C-N-CA 120.049 -1.072 . . . . 0.0 111.717 -176.021 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.87 -25.32 64.97 Favored 'General case' 0 C--N 1.309 -1.153 0 CA-C-O 121.653 0.74 . . . . 0.0 110.72 176.356 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -82.0 1.44 35.57 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.199 177.451 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 9.7 m 73.52 13.18 4.53 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 122.216 1.008 . . . . 0.0 109.017 -175.413 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 2.9 t -76.91 116.46 17.59 Favored 'General case' 0 N--CA 1.44 -0.93 0 CA-C-N 114.46 -1.246 . . . . 0.0 110.475 -178.978 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.407 ' HG2' ' CD1' ' A' ' 27' ' ' ILE . 45.1 mt-10 -89.49 110.78 21.58 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.286 0.565 . . . . 0.0 109.857 177.638 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.416 HG21 ' HA ' ' A' ' 51' ' ' TYR . 39.1 mm -99.8 137.76 26.28 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.44 0 N-CA-C 109.724 -0.472 . . . . 0.0 109.724 -178.928 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 12.5 m170 -117.91 132.41 56.41 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 108.648 -0.871 . . . . 0.0 108.648 179.514 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.472 ' HZ ' HG23 ' A' ' 26' ' ' VAL . 1.3 p90 -145.39 168.0 21.56 Favored 'General case' 0 C--N 1.31 -1.11 0 CA-C-O 121.025 0.441 . . . . 0.0 111.026 -178.485 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 88.9 mttt -126.93 115.86 19.92 Favored 'General case' 0 N--CA 1.445 -0.677 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.542 -177.013 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 33.1 m -134.54 162.52 38.74 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 CA-C-O 120.964 0.411 . . . . 0.0 110.153 179.517 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.547 ' O ' HG22 ' A' ' 42' ' ' THR . 81.6 tttt -89.01 165.78 14.33 Favored 'General case' 0 C--N 1.31 -1.128 0 O-C-N 122.011 -0.431 . . . . 0.0 110.859 -179.155 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -73.45 -36.79 65.94 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 112.675 0.62 . . . . 0.0 112.675 -177.156 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 10.1 t -93.34 13.64 20.84 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 120.926 0.393 . . . . 0.0 111.814 -177.695 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . 0.547 HG22 ' O ' ' A' ' 39' ' ' LYS . 3.4 t -95.37 173.14 7.67 Favored 'General case' 0 C--N 1.321 -0.664 0 C-N-CA 120.11 -0.636 . . . . 0.0 110.366 -179.248 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 34.5 m170 -92.39 141.65 28.3 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-O 121.432 0.634 . . . . 0.0 111.699 -178.854 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.476 ' HB2' ' O ' ' A' ' 75' ' ' HIS . 0.8 OUTLIER -63.87 -18.27 64.01 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.437 -0.801 . . . . 0.0 111.279 179.31 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.461 ' HA ' ' HD3' ' A' ' 48' ' ' LYS . 0.0 OUTLIER -51.07 -40.43 58.32 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.801 -179.751 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.612 ' O ' ' HG3' ' A' ' 49' ' ' GLU . 19.2 mtpp -66.88 -46.0 76.3 Favored 'General case' 0 CA--C 1.488 -1.417 0 CA-C-O 121.95 0.881 . . . . 0.0 109.286 178.253 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.431 ' HB3' HD13 ' A' ' 44' ' ' LEU . 9.0 tt -60.14 -49.68 76.68 Favored 'General case' 0 C--N 1.291 -1.948 0 CA-C-N 114.616 -1.175 . . . . 0.0 110.11 -176.044 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.526 ' HA ' ' CE2' ' A' ' 51' ' ' TYR . 29.9 mtpt -59.26 -46.51 88.32 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.745 -0.661 . . . . 0.0 111.018 179.46 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.612 ' HG3' ' O ' ' A' ' 46' ' ' LYS . 1.4 pp20? -71.92 -30.68 65.59 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 121.336 0.589 . . . . 0.0 110.406 -178.346 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . 0.406 ' O ' ' HG2' ' A' ' 53' ' ' GLN . 17.8 m -70.42 -42.64 71.35 Favored 'General case' 0 N--CA 1.44 -0.954 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.943 -179.338 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.526 ' CE2' ' HA ' ' A' ' 48' ' ' LYS . 3.0 p90 -76.3 -32.87 58.98 Favored 'General case' 0 C--N 1.321 -0.649 0 C-N-CA 119.3 -0.96 . . . . 0.0 110.102 179.182 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . 0.574 ' SG ' HD11 ' A' ' 62' ' ' LEU . 47.4 m -60.82 -44.08 97.39 Favored 'General case' 0 CA--C 1.512 -0.483 0 CA-C-O 120.975 0.417 . . . . 0.0 110.691 177.749 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . 0.406 ' HG2' ' O ' ' A' ' 50' ' ' SER . 12.3 pt20 -66.76 -35.06 79.21 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.58 179.463 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 2.5 mmm180 -59.02 -30.12 67.77 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-O 121.006 0.432 . . . . 0.0 111.246 177.024 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.449 HE21 ' HB2' ' A' ' 55' ' ' GLN . 3.5 mt-30 -90.4 -21.74 21.8 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 120.953 0.406 . . . . 0.0 110.844 179.602 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 78.85 34.03 35.5 Favored Glycine 0 N--CA 1.444 -0.772 0 C-N-CA 120.492 -0.861 . . . . 0.0 111.897 179.722 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 33.4 m -134.02 150.18 73.64 Favored Pre-proline 0 C--N 1.327 -0.401 0 O-C-N 122.543 -0.386 . . . . 0.0 110.417 -179.213 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . 0.513 ' HG2' ' OG ' ' A' ' 61' ' ' SER . 28.6 Cg_endo -64.12 150.9 87.39 Favored 'Trans proline' 0 N--CA 1.46 -0.498 0 C-N-CA 122.681 2.254 . . . . 0.0 112.269 179.199 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.436 ' HG2' ' SG ' ' A' ' 52' ' ' CYS . 74.4 mtp -73.07 -10.32 59.67 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.12 -178.142 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . 0.421 ' OD1' ' HB2' ' A' ' 58' ' ' PRO . 2.2 p-10 -91.87 -9.68 42.43 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.232 -179.457 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.513 ' OG ' ' HG2' ' A' ' 58' ' ' PRO . 68.4 m -93.87 -12.89 27.94 Favored 'General case' 0 C--N 1.317 -0.807 0 N-CA-C 113.127 0.788 . . . . 0.0 113.127 -179.406 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.574 HD11 ' SG ' ' A' ' 52' ' ' CYS . 1.3 pp -128.26 165.56 20.28 Favored 'General case' 0 C--N 1.308 -1.213 0 O-C-N 121.638 -0.664 . . . . 0.0 112.726 -179.349 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.586 ' HB2' ' HB2' ' A' ' 91' ' ' TYR . 3.7 mmp_? -111.95 118.12 34.61 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.814 -177.361 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -103.06 113.75 27.48 Favored 'General case' 0 C--N 1.302 -1.461 0 CA-C-O 120.94 0.4 . . . . 0.0 110.559 176.026 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.461 ' C ' HD22 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -142.25 161.21 38.61 Favored 'General case' 0 N--CA 1.445 -0.685 0 CA-C-O 121.605 0.716 . . . . 0.0 111.438 -179.455 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 93.7 t80 -144.63 136.73 26.1 Favored 'General case' 0 C--N 1.311 -1.093 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 179.061 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.465 ' HG2' HE21 ' A' ' 69' ' ' GLN . 7.7 pt-20 48.88 27.06 1.48 Allowed 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 124.358 1.063 . . . . 0.0 112.631 -179.368 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 84.62 25.43 42.42 Favored Glycine 0 N--CA 1.447 -0.593 0 C-N-CA 120.806 -0.712 . . . . 0.0 113.025 -179.112 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . 0.465 HE21 ' HG2' ' A' ' 67' ' ' GLU . 3.4 pt20 -131.95 137.66 48.02 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 178.896 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -74.31 145.36 44.0 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-O 121.324 0.583 . . . . 0.0 109.747 178.492 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.403 HG21 HD12 ' A' ' 44' ' ' LEU . 23.6 mm -90.36 119.93 38.33 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.606 0 CA-C-O 121.15 0.5 . . . . 0.0 110.622 -178.508 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -90.64 163.46 14.53 Favored 'General case' 0 N--CA 1.437 -1.075 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 179.636 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . 0.446 ' HB3' ' HB3' ' A' ' 45' ' ' LYS . 59.6 m-20 -71.17 -21.38 62.17 Favored 'General case' 0 C--N 1.313 -1.007 0 CA-C-O 121.627 0.727 . . . . 0.0 110.362 -179.818 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 9.0 m-80 -97.73 6.83 47.4 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.735 -0.666 . . . . 0.0 109.504 179.528 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . 0.476 ' O ' ' HB2' ' A' ' 44' ' ' LEU . 3.4 m170 -82.81 140.74 32.78 Favored 'General case' 0 CA--C 1.508 -0.664 0 N-CA-C 109.538 -0.542 . . . . 0.0 109.538 178.858 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.425 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 67.0 p -117.73 154.77 51.08 Favored Pre-proline 0 C--N 1.309 -1.154 0 CA-C-O 120.45 0.166 . . . . 0.0 110.703 179.601 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -59.57 -39.79 71.74 Favored 'Trans proline' 0 N--CA 1.458 -0.576 0 C-N-CA 122.439 2.093 . . . . 0.0 111.43 179.129 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . 0.489 ' HG3' ' N ' ' A' ' 79' ' ' GLU . 28.2 pttt -67.77 -38.92 84.06 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.225 -178.013 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . 0.489 ' N ' ' HG3' ' A' ' 78' ' ' LYS . 9.4 mm-40 -73.32 -36.26 66.18 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.929 0.395 . . . . 0.0 110.953 -178.291 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.447 HD21 ' CG ' ' A' ' 75' ' ' HIS . 5.8 mt -82.3 2.72 30.72 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.212 0.529 . . . . 0.0 110.996 -179.704 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 72.62 39.6 55.58 Favored Glycine 0 N--CA 1.453 -0.188 0 C-N-CA 120.962 -0.637 . . . . 0.0 112.618 177.745 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 65.0 mtt -98.55 162.5 13.11 Favored 'General case' 0 C--N 1.312 -1.046 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 179.514 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -143.59 -170.74 3.37 Favored 'General case' 0 C--N 1.306 -1.293 0 CA-C-O 120.803 0.335 . . . . 0.0 110.201 -179.563 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.426 ' HA ' ' HB ' ' A' ' 22' ' ' ILE . 5.6 pt-20 -70.84 136.01 48.44 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 120.994 0.426 . . . . 0.0 110.829 179.875 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 16.1 mm-40 74.25 5.58 4.64 Favored 'General case' 0 C--O 1.238 0.485 0 C-N-CA 124.008 0.923 . . . . 0.0 111.813 178.356 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 6.2 t0 -60.54 160.37 9.09 Favored 'General case' 0 C--O 1.238 0.453 0 CA-C-O 121.271 0.558 . . . . 0.0 110.874 176.109 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . 0.42 ' HA ' ' O ' ' A' ' 25' ' ' LYS . 7.5 p -126.54 143.62 39.42 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.002 0 CA-C-O 121.255 0.55 . . . . 0.0 111.443 -177.238 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . 0.419 ' HB ' HG22 ' A' ' 26' ' ' VAL . 3.7 mp -116.1 153.72 17.68 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 179.063 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -106.11 138.76 41.73 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.923 0.392 . . . . 0.0 110.37 -176.737 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . 0.561 ' HA ' ' O ' ' A' ' 63' ' ' ARG . 89.4 t -128.33 134.38 64.96 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-O 121.389 0.614 . . . . 0.0 111.475 178.987 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . 0.586 ' HB2' ' HB2' ' A' ' 63' ' ' ARG . 70.4 m-85 -116.31 176.24 5.19 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.85 -0.614 . . . . 0.0 109.693 178.536 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 9.3 tp60 -108.41 129.58 55.25 Favored 'General case' 0 C--N 1.31 -1.109 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 178.429 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 . . . . . 0 C--N 1.323 -0.576 0 CA-C-O 121.079 0.466 . . . . 0.0 110.629 178.177 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . 0.436 ' HB ' ' HA ' ' A' ' 84' ' ' GLU . 27.9 pt . . . . . 0 N--CA 1.442 -0.859 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 6.8 mtmt -112.37 145.9 39.28 Favored 'General case' 0 C--N 1.289 -2.055 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 -178.914 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.6 mp -140.84 160.29 40.37 Favored 'General case' 0 C--N 1.302 -1.459 0 CA-C-O 121.21 0.529 . . . . 0.0 110.797 173.799 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.407 ' O ' ' HA ' ' A' ' 87' ' ' VAL . 5.1 tmmm? -132.74 142.69 49.16 Favored 'General case' 0 C--N 1.312 -1.039 0 CA-C-O 121.391 0.615 . . . . 0.0 110.721 -179.088 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.556 HG23 ' HZ ' ' A' ' 36' ' ' PHE . 0.9 OUTLIER -117.27 141.18 36.94 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.439 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.608 -179.991 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.462 ' O ' ' HB ' ' A' ' 90' ' ' VAL . 43.7 mm -104.24 114.77 44.72 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.037 0 N-CA-C 107.409 -1.33 . . . . 0.0 107.409 174.378 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . 0.473 ' HA2' ' HB ' ' A' ' 90' ' ' VAL . . . -87.01 162.84 34.21 Favored Glycine 0 N--CA 1.423 -2.207 0 C-N-CA 119.856 -1.164 . . . . 0.0 111.241 -177.337 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.68 -30.07 30.02 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-O 121.116 0.484 . . . . 0.0 112.258 177.175 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -93.55 13.62 21.34 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-O 121.272 0.558 . . . . 0.0 110.193 -179.301 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 23.6 m 74.65 21.01 2.28 Favored 'General case' 0 CA--C 1.504 -0.811 0 CA-C-O 122.623 1.201 . . . . 0.0 108.396 -178.91 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 2.5 m -68.78 94.57 0.61 Allowed 'General case' 0 N--CA 1.425 -1.721 0 CA-C-N 113.295 -1.775 . . . . 0.0 111.763 -179.164 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.494 ' HA ' ' O ' ' A' ' 26' ' ' VAL . 37.9 mt-10 -82.33 104.08 12.38 Favored 'General case' 0 CA--C 1.506 -0.746 0 C-N-CA 120.369 -0.532 . . . . 0.0 110.265 176.968 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.478 HG21 ' HA ' ' A' ' 51' ' ' TYR . 36.8 mm -100.18 133.73 42.21 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.767 0 N-CA-C 108.963 -0.755 . . . . 0.0 108.963 178.419 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 12.5 m170 -113.34 128.81 56.58 Favored 'General case' 0 C--N 1.316 -0.854 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 -179.43 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.556 ' HZ ' HG23 ' A' ' 26' ' ' VAL . 1.1 p90 -140.91 149.08 41.43 Favored 'General case' 0 C--N 1.306 -1.301 0 CA-C-O 121.488 0.661 . . . . 0.0 111.311 -177.937 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 96.3 mttt -113.97 105.65 13.49 Favored 'General case' 0 C--N 1.31 -1.117 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.859 -178.691 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.496 ' HB ' HG21 ' A' ' 42' ' ' THR . 14.6 m -129.88 162.58 37.29 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.277 -177.592 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 46.3 mtpt -79.46 178.32 8.2 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-O 121.731 0.777 . . . . 0.0 112.093 -178.779 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -87.59 -31.03 20.06 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.538 -0.756 . . . . 0.0 109.91 178.3 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 10.2 t -92.87 13.0 21.76 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 115.617 -0.719 . . . . 0.0 111.465 -177.631 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . 0.496 HG21 ' HB ' ' A' ' 38' ' ' VAL . 6.4 t -94.56 162.83 13.64 Favored 'General case' 0 C--N 1.318 -0.795 0 O-C-N 122.029 -0.419 . . . . 0.0 109.974 -178.371 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . 0.516 ' O ' ' HG3' ' A' ' 46' ' ' LYS . 24.5 m170 -85.37 141.15 30.21 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-O 121.033 0.444 . . . . 0.0 110.149 177.838 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.643 ' O ' ' HG3' ' A' ' 48' ' ' LYS . 0.5 OUTLIER -63.76 -20.28 65.64 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.888 -179.898 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.702 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -50.7 -47.29 59.04 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 112.173 0.435 . . . . 0.0 112.173 -178.476 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.516 ' HG3' ' O ' ' A' ' 43' ' ' HIS . 0.0 OUTLIER -68.84 -30.11 68.59 Favored 'General case' 0 C--O 1.222 -0.363 0 CA-C-O 121.165 0.507 . . . . 0.0 110.964 -178.872 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.462 HD12 HG21 ' A' ' 38' ' ' VAL . 7.8 tt -72.19 -48.53 42.53 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.549 178.559 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.643 ' HG3' ' O ' ' A' ' 44' ' ' LEU . 24.4 mtpt -57.16 -46.6 82.63 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-O 121.374 0.607 . . . . 0.0 110.46 -178.463 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.702 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 8.3 pt-20 -71.95 -32.94 67.79 Favored 'General case' 0 C--N 1.312 -1.052 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.692 -179.166 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . 0.556 ' O ' ' HG2' ' A' ' 54' ' ' ARG . 23.2 t -62.18 -46.23 89.88 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-O 121.01 0.433 . . . . 0.0 110.699 -179.178 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.487 ' CD1' HG11 ' A' ' 26' ' ' VAL . 2.4 p90 -75.39 -33.0 60.96 Favored 'General case' 0 N--CA 1.441 -0.924 0 C-N-CA 119.744 -0.783 . . . . 0.0 110.701 -178.064 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . 0.552 ' SG ' ' HG2' ' A' ' 59' ' ' MET . 97.0 m -63.08 -45.89 90.0 Favored 'General case' 0 CA--C 1.509 -0.615 0 CA-C-O 121.08 0.467 . . . . 0.0 110.644 179.607 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -66.8 -34.45 77.85 Favored 'General case' 0 N--CA 1.442 -0.847 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.476 -179.499 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.556 ' HG2' ' O ' ' A' ' 50' ' ' SER . 40.0 mmt180 -57.23 -40.44 77.56 Favored 'General case' 0 C--N 1.349 0.572 0 CA-C-O 121.105 0.478 . . . . 0.0 111.153 176.813 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.507 ' NE2' ' HA ' ' A' ' 52' ' ' CYS . 2.8 mt-30 -77.24 -21.45 53.73 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.028 0.442 . . . . 0.0 110.982 -179.335 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 80.63 38.28 17.41 Favored Glycine 0 N--CA 1.443 -0.863 0 C-N-CA 120.674 -0.774 . . . . 0.0 111.793 -179.908 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 29.9 m -140.67 149.19 55.98 Favored Pre-proline 0 C--N 1.327 -0.392 0 N-CA-C 110.172 -0.307 . . . . 0.0 110.172 -179.952 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . 0.406 ' HG2' ' OG ' ' A' ' 61' ' ' SER . 30.3 Cg_endo -66.07 150.7 85.1 Favored 'Trans proline' 0 C--O 1.241 0.674 0 C-N-CA 122.325 2.016 . . . . 0.0 111.964 178.529 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.552 ' HG2' ' SG ' ' A' ' 52' ' ' CYS . 81.2 mtp -69.19 -8.87 49.66 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.95 -176.845 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 22.8 p30 -91.94 -12.46 33.36 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-O 121.134 0.492 . . . . 0.0 111.534 -178.476 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.406 ' OG ' ' HG2' ' A' ' 58' ' ' PRO . 75.3 m -84.28 -23.14 30.46 Favored 'General case' 0 N--CA 1.442 -0.831 0 CA-C-O 121.225 0.536 . . . . 0.0 111.391 179.848 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.532 HD11 ' SG ' ' A' ' 52' ' ' CYS . 2.0 pp -131.82 151.96 51.32 Favored 'General case' 0 C--N 1.309 -1.183 0 CA-C-O 121.549 0.69 . . . . 0.0 112.204 -178.231 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.441 ' HG3' ' HB2' ' A' ' 91' ' ' TYR . 1.1 ptp180 -109.97 139.96 44.51 Favored 'General case' 0 C--N 1.312 -1.06 0 CA-C-O 121.5 0.667 . . . . 0.0 112.657 -179.417 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -112.3 119.71 39.23 Favored 'General case' 0 C--N 1.311 -1.077 0 CA-C-N 114.96 -1.018 . . . . 0.0 110.726 -177.969 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.455 ' C ' HD22 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -142.79 164.23 30.65 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-O 121.327 0.584 . . . . 0.0 111.101 178.955 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 88.4 t80 -145.68 134.12 21.94 Favored 'General case' 0 C--N 1.312 -1.053 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 179.091 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.431 ' HG2' HE21 ' A' ' 69' ' ' GLN . 6.5 pt-20 49.1 28.08 1.98 Allowed 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 124.155 0.982 . . . . 0.0 112.102 -179.351 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 84.55 25.26 43.37 Favored Glycine 0 N--CA 1.447 -0.571 0 C-N-CA 120.848 -0.692 . . . . 0.0 113.195 -178.906 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . 0.431 HE21 ' HG2' ' A' ' 67' ' ' GLU . 3.0 pt20 -131.63 134.68 46.25 Favored 'General case' 0 C--N 1.32 -0.695 0 O-C-N 122.21 -0.582 . . . . 0.0 109.893 178.681 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.451 ' HD3' ' H ' ' A' ' 70' ' ' ARG . 0.0 OUTLIER -65.77 144.1 57.09 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-O 121.553 0.692 . . . . 0.0 110.43 176.767 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 23.3 mm -94.5 119.79 42.98 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.573 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 179.471 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -98.02 162.9 13.0 Favored 'General case' 0 N--CA 1.438 -1.031 0 CA-C-O 120.909 0.385 . . . . 0.0 110.0 -178.237 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . 0.488 ' HB3' ' HB3' ' A' ' 45' ' ' LYS . 62.0 m-20 -67.65 -23.75 65.37 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-O 121.375 0.607 . . . . 0.0 111.381 -178.511 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 3.1 m-80 -97.25 4.93 50.77 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-O 121.433 0.635 . . . . 0.0 109.69 -178.719 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . 0.527 ' O ' ' HB2' ' A' ' 44' ' ' LEU . 5.9 m170 -84.72 142.69 29.67 Favored 'General case' 0 CA--C 1.504 -0.826 0 CA-C-N 116.187 -0.46 . . . . 0.0 109.768 179.908 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 81.8 p -117.29 154.0 50.13 Favored Pre-proline 0 C--N 1.304 -1.401 0 CA-C-N 116.631 -0.259 . . . . 0.0 110.792 179.177 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_exo -60.33 -37.71 80.16 Favored 'Trans proline' 0 N--CA 1.456 -0.68 0 C-N-CA 122.435 2.09 . . . . 0.0 111.204 179.298 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . 0.464 ' HG3' ' N ' ' A' ' 79' ' ' GLU . 34.5 pttt -68.93 -35.88 77.32 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.14 -178.279 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . 0.464 ' N ' ' HG3' ' A' ' 78' ' ' LYS . 14.4 mm-40 -76.61 -37.35 56.57 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-O 121.039 0.447 . . . . 0.0 111.322 -178.898 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.458 HD21 ' CG ' ' A' ' 75' ' ' HIS . 5.2 mt -78.72 -5.16 52.42 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.241 0.543 . . . . 0.0 110.627 179.626 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 78.73 43.43 11.72 Favored Glycine 0 N--CA 1.45 -0.368 0 CA-C-N 115.884 -0.598 . . . . 0.0 112.883 176.99 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 61.1 mtt -101.89 162.29 13.02 Favored 'General case' 0 C--N 1.312 -1.025 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 178.652 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -138.14 -170.98 2.92 Favored 'General case' 0 C--N 1.313 -1.016 0 N-CA-C 110.04 -0.356 . . . . 0.0 110.04 179.506 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.436 ' HA ' ' HB ' ' A' ' 22' ' ' ILE . 8.8 pt-20 -70.11 129.38 39.25 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-O 121.273 0.559 . . . . 0.0 111.049 179.755 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 76.25 11.98 2.78 Favored 'General case' 0 C--N 1.316 -0.865 0 C-N-CA 124.312 1.045 . . . . 0.0 112.399 178.216 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -66.11 167.24 10.34 Favored 'General case' 0 C--O 1.239 0.551 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.107 174.332 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . 0.407 ' HA ' ' O ' ' A' ' 25' ' ' LYS . 8.8 p -129.39 145.27 35.99 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.105 0 CA-C-O 121.298 0.57 . . . . 0.0 111.751 -176.928 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 3.8 mp -115.82 153.71 17.37 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.741 0 N-CA-C 108.63 -0.878 . . . . 0.0 108.63 178.824 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -106.35 137.66 43.92 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 120.981 0.42 . . . . 0.0 110.491 -176.149 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . 0.473 ' HB ' ' HA2' ' A' ' 28' ' ' GLY . 97.9 t -129.61 135.89 60.43 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.909 0 CA-C-O 121.254 0.55 . . . . 0.0 110.821 178.971 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . 0.441 ' HB2' ' HG3' ' A' ' 63' ' ' ARG . 84.5 m-85 -122.77 171.75 8.95 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.065 179.853 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 9.0 tp60 -97.49 135.83 38.78 Favored 'General case' 0 C--N 1.308 -1.205 0 N-CA-C 109.779 -0.452 . . . . 0.0 109.779 179.482 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 . . . . . 0 C--N 1.321 -0.667 0 CA-C-O 121.306 0.574 . . . . 0.0 110.764 176.994 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 29.0 pt . . . . . 0 N--CA 1.448 -0.559 0 CA-C-O 121.785 0.803 . . . . 0.0 110.632 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.422 ' HE3' ' HG3' ' A' ' 85' ' ' GLU . 11.2 mtmt -115.57 145.86 42.28 Favored 'General case' 0 C--N 1.295 -1.781 0 CA-C-N 115.791 -0.641 . . . . 0.0 109.54 -178.356 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.0 mp -141.03 163.48 32.85 Favored 'General case' 0 C--N 1.306 -1.289 0 CA-C-O 121.213 0.53 . . . . 0.0 111.335 174.25 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.538 ' NZ ' HD11 ' A' ' 27' ' ' ILE . 3.1 tmmt? -135.52 144.26 46.21 Favored 'General case' 0 N--CA 1.445 -0.71 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.568 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.559 ' O ' ' HA ' ' A' ' 33' ' ' GLU . 0.9 OUTLIER -114.41 142.48 26.97 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.121 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.891 179.886 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.538 HD11 ' NZ ' ' A' ' 25' ' ' LYS . 41.4 mm -110.94 97.71 6.09 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.842 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 176.079 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . 0.565 ' HA2' ' HB ' ' A' ' 90' ' ' VAL . . . -66.21 165.06 39.71 Favored Glycine 0 N--CA 1.434 -1.476 0 C-N-CA 120.646 -0.787 . . . . 0.0 113.918 178.691 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.407 ' HG3' ' H ' ' A' ' 29' ' ' GLN . 0.0 OUTLIER -56.91 -19.48 18.04 Favored 'General case' 0 C--N 1.315 -0.933 0 C-N-CA 124.286 1.034 . . . . 0.0 112.411 178.906 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.406 ' O ' ' HB2' ' A' ' 31' ' ' SER . 23.4 t70 -106.9 13.4 27.76 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.521 0.677 . . . . 0.0 110.03 -179.039 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . 0.406 ' HB2' ' O ' ' A' ' 30' ' ' ASP . 62.6 m 74.72 23.6 1.78 Allowed 'General case' 0 CA--C 1.506 -0.742 0 CA-C-O 122.768 1.271 . . . . 0.0 108.076 -178.076 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 9.6 m -71.09 91.51 0.91 Allowed 'General case' 0 N--CA 1.426 -1.655 0 CA-C-N 113.384 -1.734 . . . . 0.0 110.411 179.096 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.559 ' HA ' ' O ' ' A' ' 26' ' ' VAL . 24.8 mt-10 -83.09 107.33 15.59 Favored 'General case' 0 CA--C 1.511 -0.555 0 CA-C-O 121.279 0.561 . . . . 0.0 110.887 -179.816 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 28.2 mm -103.65 138.12 29.43 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.242 0 N-CA-C 109.147 -0.686 . . . . 0.0 109.147 178.637 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . 0.42 ' CD2' ' HG3' ' A' ' 25' ' ' LYS . 12.3 m170 -115.45 133.64 55.84 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 -179.915 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.535 ' HZ ' HG23 ' A' ' 26' ' ' VAL . 0.9 OUTLIER -146.6 165.31 29.89 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-O 121.141 0.496 . . . . 0.0 111.035 -177.997 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 64.7 mmtt -123.79 115.33 21.18 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.14 -0.482 . . . . 0.0 109.912 -177.683 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.407 ' HB ' HG21 ' A' ' 42' ' ' THR . 20.3 m -136.79 154.5 31.85 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-O 120.91 0.386 . . . . 0.0 110.346 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.55 ' O ' HG22 ' A' ' 42' ' ' THR . 83.4 tttt -81.14 163.03 23.4 Favored 'General case' 0 C--N 1.314 -0.955 0 O-C-N 121.837 -0.54 . . . . 0.0 111.07 -178.663 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . 0.47 ' O ' ' HG2' ' A' ' 78' ' ' LYS . 0.0 OUTLIER -68.64 -39.59 80.68 Favored 'General case' 0 N--CA 1.466 0.327 0 O-C-N 121.905 -0.497 . . . . 0.0 111.986 -177.785 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 14.9 t -93.23 13.39 21.37 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-O 121.167 0.508 . . . . 0.0 111.742 -175.777 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . 0.55 HG22 ' O ' ' A' ' 39' ' ' LYS . 2.2 t -92.95 164.37 13.32 Favored 'General case' 0 C--N 1.323 -0.57 0 O-C-N 121.833 -0.542 . . . . 0.0 110.34 -179.031 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . 0.498 ' O ' ' HG2' ' A' ' 46' ' ' LYS . 17.2 m170 -77.12 139.55 39.99 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.42 0.628 . . . . 0.0 111.146 178.93 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.626 ' HB2' ' O ' ' A' ' 75' ' ' HIS . 0.2 OUTLIER -70.03 -17.6 63.27 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 115.68 -0.691 . . . . 0.0 109.516 -179.224 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.754 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -53.94 -45.64 71.31 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.963 -178.456 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.498 ' HG2' ' O ' ' A' ' 43' ' ' HIS . 13.6 ptmm? -63.5 -30.15 71.32 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 121.563 0.697 . . . . 0.0 110.61 -178.649 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.591 ' HB3' HD13 ' A' ' 44' ' ' LEU . 8.2 tt -72.44 -48.91 37.42 Favored 'General case' 0 C--N 1.31 -1.139 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.085 179.37 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.589 ' HD3' ' HA ' ' A' ' 45' ' ' LYS . 27.0 mtpt -58.57 -46.84 86.07 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 121.321 0.581 . . . . 0.0 110.619 -178.292 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.754 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 5.9 pt-20 -70.3 -31.55 68.94 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.683 -179.167 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 26.6 t -67.28 -45.85 75.39 Favored 'General case' 0 N--CA 1.455 -0.193 0 CA-C-O 121.102 0.477 . . . . 0.0 111.32 -179.129 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.453 ' CD1' HG11 ' A' ' 26' ' ' VAL . 2.1 p90 -76.03 -32.53 59.4 Favored 'General case' 0 N--CA 1.443 -0.784 0 C-N-CA 119.613 -0.835 . . . . 0.0 110.359 -176.992 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . 0.506 ' SG ' ' HG2' ' A' ' 59' ' ' MET . 85.1 m -63.01 -43.65 98.19 Favored 'General case' 0 CA--C 1.513 -0.449 0 CA-C-O 120.969 0.414 . . . . 0.0 110.864 178.878 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 12.7 pt20 -68.74 -33.58 74.15 Favored 'General case' 0 N--CA 1.448 -0.546 0 C-N-CA 120.513 -0.475 . . . . 0.0 110.419 -179.638 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.483 ' HA ' ' CZ ' ' A' ' 54' ' ' ARG . 3.2 mmp_? -57.79 -43.45 85.62 Favored 'General case' 0 C--N 1.341 0.236 0 CA-C-O 121.233 0.54 . . . . 0.0 111.117 177.319 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.404 ' NE2' ' HA ' ' A' ' 52' ' ' CYS . 2.9 mt-30 -75.33 -20.24 59.16 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 121.222 0.534 . . . . 0.0 110.814 179.299 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 79.94 29.39 47.02 Favored Glycine 0 N--CA 1.446 -0.698 0 C-N-CA 121.056 -0.592 . . . . 0.0 112.044 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 34.7 m -129.47 148.99 71.57 Favored Pre-proline 0 C--N 1.322 -0.607 0 O-C-N 122.48 -0.423 . . . . 0.0 110.981 -178.527 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . 0.518 ' HG2' ' OG ' ' A' ' 61' ' ' SER . 33.5 Cg_endo -66.99 150.87 82.82 Favored 'Trans proline' 0 N--CA 1.456 -0.728 0 C-N-CA 122.459 2.106 . . . . 0.0 112.296 178.713 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.506 ' HG2' ' SG ' ' A' ' 52' ' ' CYS . 75.8 mtp -70.61 -8.83 54.57 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.589 -177.086 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . 0.42 ' OD1' ' HB2' ' A' ' 58' ' ' PRO . 1.8 p-10 -92.37 -9.74 40.68 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.662 -179.466 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.518 ' OG ' ' HG2' ' A' ' 58' ' ' PRO . 70.0 m -89.64 -22.78 22.13 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-O 121.016 0.436 . . . . 0.0 111.703 -179.182 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 1.2 pp -126.05 171.15 11.05 Favored 'General case' 0 C--N 1.314 -0.978 0 O-C-N 121.965 -0.46 . . . . 0.0 111.996 -178.69 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.507 ' CG ' ' HB3' ' A' ' 93' ' ' GLU . 57.1 mtp180 -122.38 122.8 39.88 Favored 'General case' 0 CA--C 1.506 -0.744 0 CA-C-O 120.967 0.413 . . . . 0.0 110.663 -177.698 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -100.83 115.01 29.33 Favored 'General case' 0 C--N 1.304 -1.384 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.614 177.671 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.458 ' C ' HD22 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -143.87 162.01 37.21 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-O 121.46 0.648 . . . . 0.0 111.396 179.728 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 87.1 t80 -143.18 135.56 27.28 Favored 'General case' 0 C--N 1.306 -1.304 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 179.002 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.445 ' HG2' HE21 ' A' ' 69' ' ' GLN . 9.9 pt-20 49.62 31.12 3.98 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.057 0.943 . . . . 0.0 112.166 -179.564 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 84.94 14.24 70.13 Favored Glycine 0 N--CA 1.447 -0.612 0 CA-C-N 116.019 -0.537 . . . . 0.0 113.447 179.025 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . 0.445 HE21 ' HG2' ' A' ' 67' ' ' GLU . 2.7 pt20 -122.25 135.16 54.71 Favored 'General case' 0 C--N 1.317 -0.807 0 O-C-N 122.139 -0.624 . . . . 0.0 109.505 -178.737 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.46 140.57 48.35 Favored 'General case' 0 C--N 1.313 -1.005 0 CA-C-O 121.44 0.638 . . . . 0.0 109.961 178.843 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.451 HG21 HD12 ' A' ' 44' ' ' LEU . 22.8 mm -86.74 121.76 38.04 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.517 0 CA-C-O 121.075 0.464 . . . . 0.0 110.344 -178.338 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.416 ' O ' ' HB2' ' A' ' 75' ' ' HIS . . . -95.75 161.15 14.14 Favored 'General case' 0 N--CA 1.434 -1.246 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 179.667 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 48.5 m-20 -66.01 -27.89 68.46 Favored 'General case' 0 C--N 1.311 -1.108 0 CA-C-O 121.352 0.596 . . . . 0.0 110.925 -178.689 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 8.0 m-80 -91.92 1.64 57.05 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-O 121.107 0.48 . . . . 0.0 109.97 -178.793 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . 0.626 ' O ' ' HB2' ' A' ' 44' ' ' LEU . 7.6 m170 -81.02 146.75 30.5 Favored 'General case' 0 CA--C 1.498 -1.033 0 N-CA-C 109.778 -0.453 . . . . 0.0 109.778 -179.381 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.431 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 80.5 p -122.13 155.69 60.98 Favored Pre-proline 0 C--N 1.303 -1.44 0 C-N-CA 121.086 -0.245 . . . . 0.0 111.072 178.897 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_exo -60.79 -36.91 82.02 Favored 'Trans proline' 0 N--CA 1.46 -0.46 0 C-N-CA 122.385 2.056 . . . . 0.0 111.086 178.962 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . 0.47 ' HG2' ' O ' ' A' ' 40' ' ' MET . 16.4 ptmt -67.47 -38.92 85.13 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.848 -0.614 . . . . 0.0 111.376 -179.306 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -77.96 -32.71 51.58 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.602 -178.317 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.438 HD21 ' CG ' ' A' ' 75' ' ' HIS . 5.5 mt -83.16 0.92 43.05 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.137 0.494 . . . . 0.0 110.733 179.27 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 72.86 44.45 37.66 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 121.158 -0.544 . . . . 0.0 112.975 176.746 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 62.9 mtt -102.52 166.33 10.59 Favored 'General case' 0 C--N 1.313 -0.998 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 179.285 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . 0.435 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 11.3 pt-20 -140.8 -171.28 3.21 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-O 120.717 0.294 . . . . 0.0 110.65 178.829 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -69.15 126.91 31.27 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-O 121.687 0.756 . . . . 0.0 111.698 -177.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . 0.422 ' HG3' ' HE3' ' A' ' 23' ' ' LYS . 44.0 mt-10 76.2 13.34 2.61 Favored 'General case' 0 C--N 1.316 -0.859 0 C-N-CA 124.745 1.218 . . . . 0.0 111.498 178.03 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . 0.435 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 4.3 t0 -59.43 162.05 5.19 Favored 'General case' 0 C--O 1.239 0.549 0 CA-C-N 115.456 -0.793 . . . . 0.0 109.842 173.965 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 12.1 p -125.78 143.76 38.22 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.467 0 CA-C-O 121.342 0.591 . . . . 0.0 111.086 -176.415 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 3.8 mp -113.4 153.26 14.98 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.994 0 N-CA-C 109.087 -0.708 . . . . 0.0 109.087 179.207 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -105.72 138.7 41.47 Favored 'General case' 0 C--N 1.314 -0.946 0 CA-C-O 120.992 0.425 . . . . 0.0 109.932 -176.652 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . 0.565 ' HB ' ' HA2' ' A' ' 28' ' ' GLY . 91.4 t -131.04 134.73 61.14 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.066 0 CA-C-O 121.382 0.611 . . . . 0.0 110.733 179.394 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 92.0 m-85 -121.87 -178.92 3.97 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-N 115.913 -0.585 . . . . 0.0 109.511 179.543 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 8.1 tp60 -103.32 144.94 30.7 Favored 'General case' 0 C--N 1.307 -1.275 0 N-CA-C 109.747 -0.464 . . . . 0.0 109.747 179.135 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' GLU . . . . . 0.507 ' HB3' ' CG ' ' A' ' 63' ' ' ARG . 10.1 pt-20 . . . . . 0 C--N 1.326 -0.414 0 CA-C-O 121.322 0.582 . . . . 0.0 110.684 176.12 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . 0.409 ' HB ' ' HA ' ' A' ' 84' ' ' GLU . 28.2 pt . . . . . 0 N--CA 1.44 -0.958 0 CA-C-O 121.325 0.583 . . . . 0.0 110.365 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 1.5 mppt? -119.12 145.41 45.98 Favored 'General case' 0 C--N 1.298 -1.638 0 N-CA-C 108.744 -0.835 . . . . 0.0 108.744 -179.356 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.4 mp -138.36 164.59 28.92 Favored 'General case' 0 C--N 1.303 -1.444 0 CA-C-O 121.332 0.587 . . . . 0.0 111.089 176.19 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.426 ' O ' ' HA ' ' A' ' 87' ' ' VAL . 5.5 tmmm? -133.26 143.02 48.82 Favored 'General case' 0 N--CA 1.434 -1.228 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.358 -178.965 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.532 ' O ' ' HA ' ' A' ' 33' ' ' GLU . 0.9 OUTLIER -114.4 142.68 26.24 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.377 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.039 -179.261 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.432 HD13 ' HG2' ' A' ' 33' ' ' GLU . 46.5 mm -105.04 115.16 46.37 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.028 0 N-CA-C 107.505 -1.295 . . . . 0.0 107.505 175.042 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . 0.433 ' HA2' ' HB ' ' A' ' 90' ' ' VAL . . . -82.77 166.9 45.54 Favored Glycine 0 N--CA 1.42 -2.37 0 C-N-CA 120.202 -0.999 . . . . 0.0 111.748 -176.58 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.38 -23.07 65.53 Favored 'General case' 0 C--N 1.305 -1.343 0 CA-C-O 121.527 0.68 . . . . 0.0 111.023 178.395 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -103.4 15.36 29.26 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.429 0.633 . . . . 0.0 109.493 178.704 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 29.2 t 73.12 16.85 4.2 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 123.771 0.828 . . . . 0.0 111.139 179.526 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 12.5 t -73.45 111.57 8.71 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 116.154 -0.476 . . . . 0.0 109.822 179.477 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.532 ' HA ' ' O ' ' A' ' 26' ' ' VAL . 43.9 mt-10 -88.37 108.64 19.45 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 121.376 0.607 . . . . 0.0 110.701 179.768 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 27.0 mm -98.37 137.22 26.51 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.269 0 N-CA-C 109.233 -0.654 . . . . 0.0 109.233 179.741 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 12.8 m170 -115.75 133.1 56.37 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 -179.846 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.513 ' HZ ' HG23 ' A' ' 26' ' ' VAL . 1.2 p90 -147.79 165.13 31.48 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-O 121.147 0.499 . . . . 0.0 111.552 -178.428 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 9.4 ptpp? -119.91 125.23 47.94 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.173 0.511 . . . . 0.0 110.94 179.713 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 33.9 m -140.56 154.94 22.45 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 178.773 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.439 ' O ' HG22 ' A' ' 42' ' ' THR . 83.9 tttt -87.87 162.81 16.73 Favored 'General case' 0 C--N 1.306 -1.29 0 O-C-N 121.796 -0.565 . . . . 0.0 111.442 -178.02 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -78.45 15.26 1.02 Allowed 'General case' 0 N--CA 1.479 1.018 0 O-C-N 121.856 -0.527 . . . . 0.0 112.25 -177.03 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 14.4 t -138.66 3.34 2.28 Favored 'General case' 0 C--N 1.308 -1.236 0 CA-C-O 121.23 0.538 . . . . 0.0 110.784 -177.162 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . 0.439 HG22 ' O ' ' A' ' 39' ' ' LYS . 7.3 t -96.84 166.22 11.73 Favored 'General case' 0 N--CA 1.44 -0.97 0 CA-C-O 120.913 0.387 . . . . 0.0 110.357 -175.355 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . 0.401 ' HB3' ' O ' ' A' ' 73' ' ' ASP . 63.4 m170 -84.63 144.12 28.81 Favored 'General case' 0 C--N 1.314 -0.974 0 CA-C-O 121.498 0.666 . . . . 0.0 111.276 -178.896 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.543 ' O ' ' HG2' ' A' ' 48' ' ' LYS . 0.9 OUTLIER -65.7 -15.0 62.39 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.423 -0.808 . . . . 0.0 111.129 178.975 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.677 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -52.07 -48.37 64.71 Favored 'General case' 0 C--O 1.222 -0.391 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.803 -179.481 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 20.5 ptmt -67.03 -31.65 72.33 Favored 'General case' 0 C--O 1.208 -1.117 0 CA-C-O 120.894 0.378 . . . . 0.0 110.892 -179.943 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.408 ' HB3' HD13 ' A' ' 44' ' ' LEU . 8.6 tt -71.19 -49.97 38.02 Favored 'General case' 0 C--N 1.307 -1.241 0 CA-C-O 121.021 0.438 . . . . 0.0 110.766 -178.834 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.543 ' HG2' ' O ' ' A' ' 44' ' ' LEU . 6.1 ptmm? -62.41 -41.16 98.47 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.657 -178.207 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.677 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 8.7 pt-20 -72.04 -34.2 68.59 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-O 121.09 0.472 . . . . 0.0 110.417 178.072 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 5.4 m -65.06 -43.53 91.97 Favored 'General case' 0 C--O 1.234 0.262 0 N-CA-C 112.296 0.48 . . . . 0.0 112.296 -178.118 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.483 ' CD1' HG11 ' A' ' 26' ' ' VAL . 2.1 p90 -76.03 -33.38 59.63 Favored 'General case' 0 N--CA 1.444 -0.767 0 C-N-CA 119.326 -0.95 . . . . 0.0 110.189 -178.951 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . 0.509 ' SG ' HD11 ' A' ' 62' ' ' LEU . 91.6 m -62.42 -44.91 95.31 Favored 'General case' 0 CA--C 1.511 -0.544 0 CA-C-O 121.199 0.523 . . . . 0.0 110.611 179.556 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 13.2 pt20 -67.35 -34.79 78.04 Favored 'General case' 0 N--CA 1.443 -0.78 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.533 -179.032 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 2.3 mmp_? -56.3 -43.06 78.52 Favored 'General case' 0 C--N 1.346 0.427 0 CA-C-O 121.045 0.45 . . . . 0.0 111.232 177.331 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.409 ' NE2' ' HA ' ' A' ' 52' ' ' CYS . 2.9 mt-30 -73.86 -21.46 60.1 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.127 0.489 . . . . 0.0 110.931 179.631 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 84.68 28.12 33.19 Favored Glycine 0 N--CA 1.444 -0.769 0 C-N-CA 120.814 -0.707 . . . . 0.0 112.247 179.501 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 31.4 m -128.83 150.2 74.36 Favored Pre-proline 0 C--N 1.327 -0.405 0 O-C-N 122.418 -0.46 . . . . 0.0 110.753 -178.706 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . 0.478 ' HG2' ' OG ' ' A' ' 61' ' ' SER . 28.8 Cg_endo -65.39 153.96 75.83 Favored 'Trans proline' 0 N--CA 1.456 -0.715 0 C-N-CA 122.216 1.944 . . . . 0.0 111.5 177.115 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.459 ' HG2' ' SG ' ' A' ' 52' ' ' CYS . 77.3 mtp -74.97 -8.63 57.07 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.437 -176.201 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 24.2 p30 -90.55 -12.13 38.03 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-O 121.102 0.477 . . . . 0.0 111.596 -178.225 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.478 ' OG ' ' HG2' ' A' ' 58' ' ' PRO . 64.3 m -83.95 -21.08 31.93 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-O 121.24 0.543 . . . . 0.0 111.275 -179.234 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.509 HD11 ' SG ' ' A' ' 52' ' ' CYS . 1.2 pp -129.9 173.04 11.06 Favored 'General case' 0 C--N 1.309 -1.179 0 CA-C-O 121.479 0.657 . . . . 0.0 112.667 -176.932 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.47 ' HG3' ' HB2' ' A' ' 91' ' ' TYR . 1.1 ptp180 -129.35 132.64 47.12 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 115.53 -0.759 . . . . 0.0 111.741 -179.659 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.481 ' CZ ' ' HE2' ' A' ' 48' ' ' LYS . 0.1 OUTLIER -107.66 120.29 41.82 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-N 115.187 -0.915 . . . . 0.0 110.758 -177.662 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.465 ' C ' HD22 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -145.51 163.91 33.24 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-O 121.491 0.662 . . . . 0.0 111.173 179.72 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 80.3 t80 -146.29 135.59 22.84 Favored 'General case' 0 C--N 1.307 -1.267 0 N-CA-C 109.199 -0.667 . . . . 0.0 109.199 178.503 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.417 ' HG2' HE21 ' A' ' 69' ' ' GLN . 7.2 pt-20 49.89 28.57 2.89 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 124.126 0.971 . . . . 0.0 112.387 179.525 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 85.03 22.69 51.83 Favored Glycine 0 N--CA 1.445 -0.742 0 C-N-CA 121.146 -0.55 . . . . 0.0 112.96 179.596 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . 0.417 HE21 ' HG2' ' A' ' 67' ' ' GLU . 2.6 pt20 -130.15 134.41 47.3 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 179.085 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 1.3 ppt_? -71.98 148.39 45.98 Favored 'General case' 0 C--N 1.31 -1.142 0 CA-C-O 121.298 0.57 . . . . 0.0 110.252 178.303 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 23.4 mm -95.39 123.23 47.46 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.226 0 O-C-N 121.919 -0.488 . . . . 0.0 110.901 -177.757 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -99.46 164.56 12.05 Favored 'General case' 0 N--CA 1.447 -0.596 0 N-CA-C 110.168 -0.308 . . . . 0.0 110.168 179.704 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . 0.401 ' O ' ' HB3' ' A' ' 43' ' ' HIS . 31.7 m-20 -64.87 -28.06 69.29 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.239 0.542 . . . . 0.0 111.015 -179.298 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 3.3 m-80 -96.12 5.59 50.75 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 121.097 0.475 . . . . 0.0 110.06 -177.373 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . 0.475 ' CG ' HD21 ' A' ' 80' ' ' LEU . 3.4 m170 -83.17 140.52 32.53 Favored 'General case' 0 CA--C 1.502 -0.896 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 179.788 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.439 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 59.9 p -119.08 155.7 53.0 Favored Pre-proline 0 C--N 1.306 -1.311 0 C-N-CA 120.985 -0.286 . . . . 0.0 110.936 179.469 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_exo -61.82 -37.87 63.73 Favored 'Trans proline' 0 N--CA 1.46 -0.461 0 C-N-CA 122.465 2.11 . . . . 0.0 111.341 179.808 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . 0.476 ' HG3' ' N ' ' A' ' 79' ' ' GLU . 34.1 pttt -68.04 -36.01 79.19 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.621 -179.344 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . 0.476 ' N ' ' HG3' ' A' ' 78' ' ' LYS . 11.2 mm-40 -74.01 -42.5 60.25 Favored 'General case' 0 CA--C 1.512 -0.511 0 CA-C-O 121.18 0.514 . . . . 0.0 111.01 -179.576 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.475 HD21 ' CG ' ' A' ' 75' ' ' HIS . 5.7 mt -76.19 -6.45 51.35 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.037 0.446 . . . . 0.0 111.237 -178.246 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 80.57 46.9 7.08 Favored Glycine 0 N--CA 1.447 -0.575 0 C-N-CA 120.862 -0.685 . . . . 0.0 112.744 177.885 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 59.3 mtt -106.64 164.32 12.18 Favored 'General case' 0 C--N 1.314 -0.942 0 O-C-N 122.51 -0.406 . . . . 0.0 109.982 178.437 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -138.18 -169.35 2.55 Favored 'General case' 0 C--N 1.313 -0.987 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 178.256 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.429 ' O ' ' HB2' ' A' ' 85' ' ' GLU . 11.5 pt-20 -78.44 134.32 37.38 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-O 121.545 0.688 . . . . 0.0 111.719 -178.893 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . 0.429 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 37.7 mt-10 78.97 8.22 1.97 Allowed 'General case' 0 C--N 1.325 -0.468 0 C-N-CA 125.104 1.361 . . . . 0.0 111.539 -179.426 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 4.6 t0 -63.26 166.52 6.15 Favored 'General case' 0 C--O 1.239 0.539 0 CA-C-N 115.734 -0.667 . . . . 0.0 110.472 175.687 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . 0.426 ' HA ' ' O ' ' A' ' 25' ' ' LYS . 8.3 p -129.08 143.63 40.65 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.076 0 CA-C-O 121.358 0.599 . . . . 0.0 111.654 -176.754 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 3.5 mp -113.58 154.87 14.9 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 179.18 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 11.0 tp10 -107.88 138.9 43.32 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-O 121.032 0.444 . . . . 0.0 110.686 -176.262 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . 0.433 ' HB ' ' HA2' ' A' ' 28' ' ' GLY . 97.6 t -129.92 135.29 61.44 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.92 0 CA-C-O 121.362 0.601 . . . . 0.0 110.883 178.872 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . 0.47 ' HB2' ' HG3' ' A' ' 63' ' ' ARG . 81.2 m-85 -121.78 173.91 7.18 Favored 'General case' 0 C--N 1.31 -1.147 0 CA-C-N 116.115 -0.493 . . . . 0.0 109.915 178.856 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 9.5 tp60 -101.09 148.83 24.61 Favored 'General case' 0 C--N 1.306 -1.315 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 179.903 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 . . . . . 0 C--N 1.321 -0.637 0 CA-C-O 121.075 0.464 . . . . 0.0 110.998 177.419 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . 0.475 ' HB ' ' HA ' ' A' ' 84' ' ' GLU . 23.9 pt . . . . . 0 N--CA 1.439 -1.021 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.494 ' HG2' ' HG2' ' A' ' 37' ' ' LYS . 34.6 mtmt -110.66 148.85 31.39 Favored 'General case' 0 C--N 1.298 -1.635 0 N-CA-C 109.75 -0.463 . . . . 0.0 109.75 179.739 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.6 mp -140.53 154.22 46.47 Favored 'General case' 0 C--N 1.3 -1.58 0 CA-C-O 121.345 0.593 . . . . 0.0 110.664 171.916 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.466 ' O ' ' HA ' ' A' ' 87' ' ' VAL . 5.4 tmmm? -128.41 143.84 51.05 Favored 'General case' 0 C--N 1.308 -1.212 0 CA-C-O 121.376 0.608 . . . . 0.0 110.334 -178.546 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.509 HG23 ' HZ ' ' A' ' 36' ' ' PHE . 0.9 OUTLIER -115.96 140.16 39.18 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.494 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.249 -179.132 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.402 HD13 ' HG2' ' A' ' 33' ' ' GLU . 46.8 mm -103.81 112.12 36.09 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.28 0 N-CA-C 107.194 -1.41 . . . . 0.0 107.194 174.496 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . 0.49 ' HA2' ' HB ' ' A' ' 90' ' ' VAL . . . -80.87 166.58 48.94 Favored Glycine 0 N--CA 1.428 -1.89 0 C-N-CA 120.181 -1.009 . . . . 0.0 111.493 -176.92 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.92 -20.07 64.83 Favored 'General case' 0 C--N 1.314 -0.978 0 CA-C-O 121.567 0.699 . . . . 0.0 110.902 177.481 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -97.16 12.97 30.87 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 121.685 0.755 . . . . 0.0 109.568 177.653 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 21.7 m 69.81 14.64 8.02 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.744 -179.055 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 7.9 t -72.79 116.93 13.87 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.533 -179.215 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.498 ' HA ' ' O ' ' A' ' 26' ' ' VAL . 41.7 mt-10 -89.44 106.33 18.38 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.214 0.531 . . . . 0.0 110.791 178.333 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 29.5 mm -96.44 136.11 28.36 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.426 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 178.574 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 12.5 m170 -115.62 131.35 56.96 Favored 'General case' 0 C--N 1.321 -0.674 0 N-CA-C 109.783 -0.451 . . . . 0.0 109.783 -178.373 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.509 ' HZ ' HG23 ' A' ' 26' ' ' VAL . 2.1 p90 -147.2 149.09 32.26 Favored 'General case' 0 C--N 1.309 -1.163 0 CA-C-O 121.33 0.586 . . . . 0.0 111.379 -179.311 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.494 ' HG2' ' HG2' ' A' ' 23' ' ' LYS . 38.1 mtmt -110.03 123.3 49.43 Favored 'General case' 0 C--N 1.313 -0.979 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.418 178.774 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.479 HG21 HD12 ' A' ' 47' ' ' LEU . 22.5 m -141.33 165.19 19.19 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.96 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 179.816 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.433 ' O ' HG22 ' A' ' 42' ' ' THR . 48.0 mtpt -84.81 176.71 8.34 Favored 'General case' 0 C--N 1.308 -1.237 0 CA-C-O 121.566 0.698 . . . . 0.0 111.517 179.854 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.38 -33.99 20.34 Favored 'General case' 0 C--N 1.307 -1.27 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.25 178.672 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 9.0 t -94.06 25.32 3.78 Favored 'General case' 0 N--CA 1.444 -0.732 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.24 -177.765 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . 0.433 HG22 ' O ' ' A' ' 39' ' ' LYS . 7.0 t -108.08 172.6 6.74 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 109.711 -0.477 . . . . 0.0 109.711 178.85 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . 0.423 ' O ' ' HG3' ' A' ' 46' ' ' LYS . 47.8 m170 -92.92 143.89 25.8 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-O 121.501 0.667 . . . . 0.0 111.479 -179.618 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.539 ' HB2' ' O ' ' A' ' 75' ' ' HIS . 0.7 OUTLIER -68.13 -17.3 64.32 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.564 178.469 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.514 ' HA ' ' HD3' ' A' ' 48' ' ' LYS . 0.0 OUTLIER -54.82 -44.94 74.3 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.883 -179.361 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.581 ' O ' ' HB2' ' A' ' 50' ' ' SER . 0.0 OUTLIER -74.0 -26.12 60.27 Favored 'General case' 0 N--CA 1.439 -1.009 0 CA-C-O 121.296 0.57 . . . . 0.0 110.493 -179.176 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.479 HD12 HG21 ' A' ' 38' ' ' VAL . 8.7 tt -72.96 -52.03 16.09 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.605 178.464 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.514 ' HD3' ' HA ' ' A' ' 45' ' ' LYS . 6.1 ptmm? -59.7 -41.04 89.88 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.98 0.419 . . . . 0.0 111.557 -178.695 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.47 -31.12 65.16 Favored 'General case' 0 C--N 1.318 -0.779 0 C-N-CA 120.437 -0.505 . . . . 0.0 110.564 178.247 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . 0.581 ' HB2' ' O ' ' A' ' 46' ' ' LYS . 8.6 t -66.23 -42.89 88.04 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.481 -178.398 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.463 ' CD2' ' HA ' ' A' ' 48' ' ' LYS . 3.4 p90 -76.51 -32.85 58.55 Favored 'General case' 0 N--CA 1.446 -0.625 0 C-N-CA 119.672 -0.811 . . . . 0.0 110.502 -179.473 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . 0.464 ' SG ' HD11 ' A' ' 62' ' ' LEU . 90.8 m -63.77 -45.03 91.65 Favored 'General case' 0 CA--C 1.509 -0.625 0 CA-C-O 121.229 0.537 . . . . 0.0 110.291 179.07 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . 0.44 ' HG2' ' O ' ' A' ' 50' ' ' SER . 13.8 pt20 -66.46 -33.96 76.88 Favored 'General case' 0 N--CA 1.444 -0.734 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.319 -178.987 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 2.2 mmp_? -56.05 -39.16 71.6 Favored 'General case' 0 C--N 1.349 0.571 0 CA-C-O 121.244 0.545 . . . . 0.0 111.08 176.204 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.461 ' NE2' ' HA ' ' A' ' 52' ' ' CYS . 2.7 mt-30 -82.32 -22.07 35.78 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.363 -178.482 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 83.6 29.54 32.32 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 120.43 -0.891 . . . . 0.0 111.721 179.736 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 21.0 m -129.11 149.9 73.89 Favored Pre-proline 0 C--O 1.238 0.495 0 O-C-N 122.519 -0.401 . . . . 0.0 110.692 -177.955 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . 0.512 ' HG2' ' OG ' ' A' ' 61' ' ' SER . 34.3 Cg_endo -65.78 149.71 86.6 Favored 'Trans proline' 0 C--O 1.238 0.483 0 C-N-CA 122.487 2.125 . . . . 0.0 112.383 178.445 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.446 ' HG2' ' SG ' ' A' ' 52' ' ' CYS . 73.4 mtp -74.25 -9.31 58.48 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.514 -177.28 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 2.0 p-10 -91.73 -8.32 47.26 Favored 'General case' 0 C--N 1.311 -1.068 0 CA-C-O 121.142 0.496 . . . . 0.0 111.266 -179.09 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.512 ' OG ' ' HG2' ' A' ' 58' ' ' PRO . 71.0 m -91.76 -20.32 21.65 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 121.012 0.434 . . . . 0.0 111.946 -179.785 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.464 HD11 ' SG ' ' A' ' 52' ' ' CYS . 1.9 pp -130.4 155.21 46.78 Favored 'General case' 0 C--N 1.315 -0.931 0 N-CA-C 112.629 0.603 . . . . 0.0 112.629 -179.229 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.553 ' O ' ' HA ' ' A' ' 90' ' ' VAL . 40.2 mtm-85 -105.79 130.23 53.82 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.576 -177.943 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -107.12 116.12 31.37 Favored 'General case' 0 C--N 1.309 -1.191 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.458 178.131 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.464 ' C ' HD22 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -141.89 163.2 33.54 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 121.464 0.65 . . . . 0.0 111.353 179.704 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 90.5 t80 -145.07 138.04 26.41 Favored 'General case' 0 C--N 1.308 -1.218 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 179.602 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.479 ' HG2' HE21 ' A' ' 69' ' ' GLN . 6.8 pt-20 49.86 26.76 2.06 Favored 'General case' 0 N--CA 1.485 1.314 0 C-N-CA 123.997 0.919 . . . . 0.0 112.118 -179.261 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 82.66 23.11 56.94 Favored Glycine 0 CA--C 1.522 0.512 0 C-N-CA 120.525 -0.845 . . . . 0.0 113.087 -177.618 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . 0.479 HE21 ' HG2' ' A' ' 67' ' ' GLU . 2.6 pt20 -129.57 134.36 47.69 Favored 'General case' 0 C--N 1.319 -0.735 0 O-C-N 122.177 -0.601 . . . . 0.0 109.471 179.797 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.45 ' CD ' ' H ' ' A' ' 70' ' ' ARG . 0.2 OUTLIER -68.31 143.59 55.14 Favored 'General case' 0 C--N 1.307 -1.278 0 CA-C-O 121.53 0.681 . . . . 0.0 110.612 176.662 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.422 HG21 HD12 ' A' ' 44' ' ' LEU . 25.1 mm -90.26 122.94 42.18 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.468 0 CA-C-O 121.055 0.455 . . . . 0.0 110.866 -178.148 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.414 ' O ' ' HB2' ' A' ' 75' ' ' HIS . . . -96.04 163.12 13.26 Favored 'General case' 0 N--CA 1.436 -1.153 0 N-CA-C 109.701 -0.481 . . . . 0.0 109.701 178.8 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . 0.434 ' HB3' ' HB3' ' A' ' 45' ' ' LYS . 36.5 m-20 -68.53 -24.07 64.6 Favored 'General case' 0 C--N 1.31 -1.113 0 CA-C-O 121.645 0.736 . . . . 0.0 110.547 -179.644 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 12.0 m-80 -97.4 8.45 44.56 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.725 -0.67 . . . . 0.0 109.956 -178.984 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . 0.539 ' O ' ' HB2' ' A' ' 44' ' ' LEU . 4.5 m170 -85.91 140.57 30.25 Favored 'General case' 0 CA--C 1.502 -0.887 0 CA-C-N 115.982 -0.554 . . . . 0.0 109.568 179.426 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 81.9 p -117.83 155.34 50.98 Favored Pre-proline 0 C--N 1.306 -1.317 0 C-N-CA 120.945 -0.302 . . . . 0.0 111.343 179.237 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -59.94 -40.97 57.47 Favored 'Trans proline' 0 C--N 1.347 0.453 0 C-N-CA 122.756 2.304 . . . . 0.0 111.625 179.517 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . 0.493 ' HG3' ' N ' ' A' ' 79' ' ' GLU . 35.2 pttt -67.04 -37.21 83.7 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.204 0.525 . . . . 0.0 110.813 -178.775 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . 0.493 ' N ' ' HG3' ' A' ' 78' ' ' LYS . 23.6 mm-40 -72.3 -41.82 66.19 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-O 121.007 0.432 . . . . 0.0 111.051 -179.128 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.445 HD21 ' CG ' ' A' ' 75' ' ' HIS . 4.6 mt -77.21 -9.1 58.57 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.068 0.461 . . . . 0.0 111.123 -178.885 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 82.42 44.05 7.62 Favored Glycine 0 C--O 1.237 0.323 0 C-N-CA 120.739 -0.743 . . . . 0.0 113.004 178.121 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 55.3 mtt -103.62 162.71 12.83 Favored 'General case' 0 C--N 1.317 -0.843 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 178.414 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -143.45 -165.43 2.09 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 121.06 0.457 . . . . 0.0 111.017 178.934 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.475 ' HA ' ' HB ' ' A' ' 22' ' ' ILE . 9.0 pt-20 -68.55 117.41 10.26 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-O 121.737 0.779 . . . . 0.0 112.743 -177.454 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 11.3 tt0 82.07 14.46 0.51 Allowed 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 125.435 1.494 . . . . 0.0 110.944 175.851 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -62.44 166.57 5.01 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-N 115.54 -0.755 . . . . 0.0 110.445 176.423 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . 0.466 ' HA ' ' O ' ' A' ' 25' ' ' LYS . 10.4 p -126.9 146.02 33.51 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.072 0 CA-C-O 121.451 0.643 . . . . 0.0 111.897 -175.925 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 3.6 mp -116.05 153.76 17.63 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.752 0 N-CA-C 108.764 -0.828 . . . . 0.0 108.764 177.507 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 13.5 tp10 -106.15 137.9 43.28 Favored 'General case' 0 C--N 1.319 -0.723 0 O-C-N 122.073 -0.392 . . . . 0.0 110.83 -176.822 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . 0.553 ' HA ' ' O ' ' A' ' 63' ' ' ARG . 95.2 t -127.31 131.8 70.13 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-O 121.251 0.548 . . . . 0.0 111.553 178.85 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 63.9 m-85 -116.13 174.95 5.77 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.101 -0.5 . . . . 0.0 109.829 179.461 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 10.2 tp60 -103.06 128.17 50.04 Favored 'General case' 0 C--N 1.312 -1.038 0 N-CA-C 110.058 -0.349 . . . . 0.0 110.058 178.047 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' GLU . . . . . 0.434 ' HB3' ' CG ' ' A' ' 63' ' ' ARG . 11.6 pt-20 . . . . . 0 C--N 1.33 -0.241 0 CA-C-O 121.151 0.5 . . . . 0.0 110.9 177.904 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . 0.411 ' HB ' ' HA ' ' A' ' 84' ' ' GLU . 26.3 pt . . . . . 0 N--CA 1.44 -0.975 0 N-CA-C 109.233 -0.655 . . . . 0.0 109.233 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 16.2 mtmt -113.66 142.81 45.56 Favored 'General case' 0 C--N 1.293 -1.869 0 N-CA-C 109.384 -0.599 . . . . 0.0 109.384 -178.174 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.401 HD13 ' CG2' ' A' ' 38' ' ' VAL . 5.6 mp -137.83 159.72 41.22 Favored 'General case' 0 C--N 1.302 -1.491 0 CA-C-O 121.216 0.531 . . . . 0.0 110.851 174.605 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.539 ' HG3' ' CD2' ' A' ' 35' ' ' HIS . 3.1 tmmt? -131.63 143.87 50.63 Favored 'General case' 0 N--CA 1.433 -1.299 0 CA-C-O 121.259 0.552 . . . . 0.0 110.638 -179.592 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.536 HG11 ' CD1' ' A' ' 51' ' ' TYR . 0.9 OUTLIER -112.06 141.06 28.72 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.429 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.182 178.672 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.426 HD11 ' NZ ' ' A' ' 25' ' ' LYS . 41.6 mm -106.46 115.84 48.92 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.133 0 N-CA-C 107.641 -1.244 . . . . 0.0 107.641 175.214 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . 0.441 ' HA2' ' HB ' ' A' ' 90' ' ' VAL . . . -86.14 169.47 41.99 Favored Glycine 0 N--CA 1.416 -2.651 0 C-N-CA 120.302 -0.951 . . . . 0.0 111.689 -177.008 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.25 -22.15 66.84 Favored 'General case' 0 C--N 1.299 -1.604 0 CA-C-O 121.634 0.73 . . . . 0.0 110.579 178.671 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -102.25 14.63 31.45 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.506 -0.77 . . . . 0.0 109.44 -179.338 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 46.2 m 69.99 19.71 6.8 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 115.574 -0.739 . . . . 0.0 111.005 179.812 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 11.1 t -76.71 114.55 15.58 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.172 178.86 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.45 ' HA ' ' O ' ' A' ' 26' ' ' VAL . 24.1 mt-10 -90.01 113.44 25.12 Favored 'General case' 0 CA--C 1.502 -0.896 0 CA-C-O 121.159 0.504 . . . . 0.0 110.696 177.614 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 30.1 mm -102.59 130.07 53.14 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.909 0 N-CA-C 108.152 -1.055 . . . . 0.0 108.152 176.378 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . 0.539 ' CD2' ' HG3' ' A' ' 25' ' ' LYS . 11.0 m170 -117.55 116.25 26.73 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 -177.148 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.518 ' HZ ' HG23 ' A' ' 26' ' ' VAL . 0.9 OUTLIER -129.28 170.08 14.06 Favored 'General case' 0 C--N 1.304 -1.397 0 CA-C-O 121.18 0.514 . . . . 0.0 111.452 -175.254 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 61.1 mmtt -121.44 121.64 38.0 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 -178.798 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.435 HG21 HD12 ' A' ' 47' ' ' LEU . 33.0 m -139.84 156.13 25.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-O 120.93 0.395 . . . . 0.0 110.439 179.545 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.527 ' O ' HG22 ' A' ' 42' ' ' THR . 79.2 tttt -86.55 163.13 17.65 Favored 'General case' 0 C--N 1.314 -0.94 0 O-C-N 121.964 -0.46 . . . . 0.0 110.794 -178.732 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . 0.483 ' O ' ' HG2' ' A' ' 78' ' ' LYS . 0.0 OUTLIER -71.89 -37.93 70.07 Favored 'General case' 0 CA--C 1.519 -0.238 0 N-CA-C 112.234 0.457 . . . . 0.0 112.234 -177.026 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 14.9 t -92.71 15.11 15.23 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-O 121.343 0.592 . . . . 0.0 111.608 -177.027 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . 0.527 HG22 ' O ' ' A' ' 39' ' ' LYS . 2.3 t -96.48 169.74 9.7 Favored 'General case' 0 C--N 1.32 -0.684 0 O-C-N 121.485 -0.76 . . . . 0.0 110.224 -179.267 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 29.8 m170 -85.81 142.24 29.07 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-O 121.4 0.619 . . . . 0.0 111.163 179.535 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.611 ' HB2' ' O ' ' A' ' 75' ' ' HIS . 0.2 OUTLIER -69.21 -17.16 63.75 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.559 -0.746 . . . . 0.0 109.686 -179.115 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.659 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -53.88 -45.65 71.13 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-N 115.728 -0.669 . . . . 0.0 112.602 -177.9 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.536 ' O ' ' HB2' ' A' ' 50' ' ' SER . 0.1 OUTLIER -69.89 -25.02 63.49 Favored 'General case' 0 C--O 1.219 -0.536 0 CA-C-O 121.297 0.57 . . . . 0.0 110.795 -178.266 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.558 ' HB3' HD13 ' A' ' 44' ' ' LEU . 7.8 tt -73.4 -47.29 43.14 Favored 'General case' 0 C--N 1.312 -1.062 0 CA-C-N 115.927 -0.579 . . . . 0.0 109.776 177.282 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.598 ' HG3' ' O ' ' A' ' 44' ' ' LEU . 26.7 mtpt -57.81 -47.59 82.16 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.605 -179.277 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.659 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 5.0 pt-20 -69.97 -34.52 73.5 Favored 'General case' 0 C--N 1.313 -0.981 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.446 -179.058 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . 0.536 ' HB2' ' O ' ' A' ' 46' ' ' LYS . 7.9 t -65.63 -43.88 88.17 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.351 -177.682 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.536 ' CD1' HG11 ' A' ' 26' ' ' VAL . 1.7 p90 -76.51 -33.7 58.62 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 119.727 -0.789 . . . . 0.0 110.531 -178.593 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . 0.507 ' SG ' HD11 ' A' ' 62' ' ' LEU . 98.6 m -62.54 -44.54 96.1 Favored 'General case' 0 C--O 1.239 0.545 0 CA-C-O 121.252 0.549 . . . . 0.0 110.657 179.327 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 14.0 pt20 -69.28 -33.78 73.73 Favored 'General case' 0 N--CA 1.442 -0.832 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.508 -179.228 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 2.1 mmp_? -57.47 -40.05 77.72 Favored 'General case' 0 C--N 1.349 0.569 0 CA-C-O 121.179 0.514 . . . . 0.0 111.377 177.625 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 3.3 mt-30 -78.1 -20.96 51.17 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.236 0.541 . . . . 0.0 110.964 -179.819 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 82.86 29.1 35.83 Favored Glycine 0 N--CA 1.445 -0.72 0 C-N-CA 120.896 -0.668 . . . . 0.0 112.138 -179.542 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 34.6 m -128.39 150.85 75.44 Favored Pre-proline 0 C--N 1.325 -0.467 0 N-CA-C 110.211 -0.292 . . . . 0.0 110.211 -179.826 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . 0.582 ' HG2' ' OG ' ' A' ' 61' ' ' SER . 31.1 Cg_endo -70.61 152.84 65.18 Favored 'Trans proline' 0 N--CA 1.455 -0.755 0 C-N-CA 122.212 1.941 . . . . 0.0 112.212 179.349 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.41 ' HG2' ' SG ' ' A' ' 52' ' ' CYS . 81.2 mtp -68.65 -10.19 54.59 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 121.092 0.472 . . . . 0.0 111.729 -176.532 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . 0.512 ' OD1' ' HB2' ' A' ' 58' ' ' PRO . 2.1 p-10 -91.16 -11.99 36.78 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-O 121.137 0.494 . . . . 0.0 111.114 -179.991 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.582 ' OG ' ' HG2' ' A' ' 58' ' ' PRO . 74.9 m -83.21 -23.6 32.76 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-O 121.088 0.47 . . . . 0.0 111.87 -178.481 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.507 HD11 ' SG ' ' A' ' 52' ' ' CYS . 1.1 pp -124.65 171.79 9.77 Favored 'General case' 0 C--N 1.305 -1.369 0 N-CA-C 113.117 0.784 . . . . 0.0 113.117 -175.796 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.457 ' O ' ' HA ' ' A' ' 90' ' ' VAL . 51.3 mtm180 -121.11 113.88 20.65 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.584 -0.735 . . . . 0.0 110.851 -177.375 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -98.21 116.41 30.36 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-O 121.194 0.521 . . . . 0.0 111.513 179.943 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.495 HD11 ' HG2' ' A' ' 89' ' ' GLU . 0.0 OUTLIER -147.06 166.51 26.65 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 121.186 0.517 . . . . 0.0 110.597 178.956 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 83.0 t80 -147.38 136.13 22.02 Favored 'General case' 0 C--N 1.31 -1.141 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 177.672 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.454 ' HG2' HE21 ' A' ' 69' ' ' GLN . 7.0 pt-20 51.58 26.8 3.51 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 124.31 1.044 . . . . 0.0 112.028 -179.869 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 84.37 22.57 53.88 Favored Glycine 0 N--CA 1.448 -0.535 0 C-N-CA 120.808 -0.71 . . . . 0.0 112.611 -179.145 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . 0.454 HE21 ' HG2' ' A' ' 67' ' ' GLU . 2.5 pt20 -128.82 134.27 48.29 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 179.57 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 15.4 ptt180 -68.2 146.98 52.88 Favored 'General case' 0 C--N 1.306 -1.309 0 CA-C-O 121.368 0.604 . . . . 0.0 111.038 178.443 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.459 HG21 HD12 ' A' ' 44' ' ' LEU . 21.8 mm -94.65 117.54 38.63 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.13 0 CA-C-O 121.147 0.498 . . . . 0.0 110.041 179.11 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -95.78 160.99 14.21 Favored 'General case' 0 N--CA 1.435 -1.195 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 179.71 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . 0.432 ' CA ' ' HB3' ' A' ' 45' ' ' LYS . 55.1 m-20 -65.33 -22.99 66.89 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-O 121.665 0.745 . . . . 0.0 110.646 -179.511 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 12.4 m-80 -97.07 4.55 51.31 Favored 'General case' 0 C--N 1.311 -1.08 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.132 -178.08 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . 0.611 ' O ' ' HB2' ' A' ' 44' ' ' LEU . 4.8 m170 -83.68 146.7 28.09 Favored 'General case' 0 CA--C 1.508 -0.65 0 N-CA-C 109.43 -0.581 . . . . 0.0 109.43 178.874 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.417 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 59.7 p -120.24 155.11 56.26 Favored Pre-proline 0 C--N 1.311 -1.069 0 C-N-CA 120.867 -0.333 . . . . 0.0 111.012 178.3 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -59.22 -40.21 71.24 Favored 'Trans proline' 0 N--CA 1.461 -0.438 0 C-N-CA 122.607 2.205 . . . . 0.0 111.693 179.557 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . 0.483 ' HG2' ' O ' ' A' ' 40' ' ' MET . 0.0 OUTLIER -69.47 -36.2 76.34 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.852 0.358 . . . . 0.0 111.617 -178.042 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -74.93 -35.28 62.18 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.882 0.372 . . . . 0.0 111.246 -179.055 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.434 HD21 ' CG ' ' A' ' 75' ' ' HIS . 5.5 mt -80.55 -0.76 39.09 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.245 0.545 . . . . 0.0 110.819 179.728 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 76.36 45.76 13.85 Favored Glycine 0 CA--C 1.509 -0.317 0 CA-C-N 116.062 -0.517 . . . . 0.0 112.794 177.6 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 59.6 mtt -106.37 164.65 11.86 Favored 'General case' 0 C--N 1.311 -1.082 0 O-C-N 122.522 -0.399 . . . . 0.0 110.255 179.422 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . 0.451 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 10.0 pt-20 -141.16 -166.24 2.13 Favored 'General case' 0 C--N 1.316 -0.885 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 177.584 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.422 ' O ' ' HB2' ' A' ' 85' ' ' GLU . 6.9 pt-20 -72.93 141.52 47.83 Favored 'General case' 0 N--CA 1.444 -0.774 0 C-N-CA 120.363 -0.535 . . . . 0.0 109.801 177.747 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . 0.422 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 66.5 mm-40 72.87 4.92 5.1 Favored 'General case' 0 C--N 1.32 -0.682 0 C-N-CA 123.722 0.809 . . . . 0.0 111.848 -179.109 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . 0.451 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 2.3 t70 -60.8 155.41 19.49 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 121.139 0.495 . . . . 0.0 110.179 176.862 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . 0.471 ' HA ' ' O ' ' A' ' 25' ' ' LYS . 8.8 p -125.94 141.78 44.61 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.497 0 CA-C-O 121.406 0.622 . . . . 0.0 111.265 -177.011 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 3.7 mp -110.24 152.52 12.23 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.884 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 179.029 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . 0.495 ' HG2' HD11 ' A' ' 65' ' ' LEU . 3.0 tt0 -103.32 130.9 50.71 Favored 'General case' 0 C--N 1.309 -1.153 0 CA-C-O 121.296 0.57 . . . . 0.0 111.127 -175.507 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . 0.457 ' HA ' ' O ' ' A' ' 63' ' ' ARG . 60.6 t -126.73 132.94 69.6 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.948 0 CA-C-O 121.588 0.708 . . . . 0.0 111.242 179.959 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . 0.417 ' HB2' ' HB2' ' A' ' 63' ' ' ARG . 76.3 m-85 -116.78 -178.22 3.38 Favored 'General case' 0 C--N 1.309 -1.182 0 CA-C-N 115.639 -0.71 . . . . 0.0 109.724 177.639 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 9.3 tp60 -109.66 145.63 36.18 Favored 'General case' 0 C--N 1.313 -0.982 0 N-CA-C 109.779 -0.452 . . . . 0.0 109.779 179.676 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 . . . . . 0 C--N 1.327 -0.37 0 CA-C-O 121.346 0.593 . . . . 0.0 110.296 175.57 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 24.0 pt . . . . . 0 N--CA 1.446 -0.627 0 CA-C-O 121.372 0.605 . . . . 0.0 109.714 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 11.6 mtmt -114.61 144.46 43.36 Favored 'General case' 0 C--N 1.294 -1.805 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 -178.74 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.9 mp -139.05 161.3 37.72 Favored 'General case' 0 C--N 1.301 -1.52 0 CA-C-O 121.339 0.59 . . . . 0.0 110.945 175.051 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.437 ' O ' ' HA ' ' A' ' 87' ' ' VAL . 5.6 tmmm? -130.22 142.37 50.57 Favored 'General case' 0 N--CA 1.438 -1.043 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.377 -179.43 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.533 HG23 ' HZ ' ' A' ' 36' ' ' PHE . 0.9 OUTLIER -113.14 142.35 25.85 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.411 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.392 179.844 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 45.0 mm -103.82 113.36 40.49 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.251 0 N-CA-C 107.381 -1.34 . . . . 0.0 107.381 175.147 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -74.64 -177.56 38.74 Favored Glycine 0 N--CA 1.432 -1.598 0 C-N-CA 120.755 -0.736 . . . . 0.0 113.105 -175.649 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.848 ' H ' ' NE2' ' A' ' 29' ' ' GLN . 0.0 OUTLIER -70.0 -26.21 63.97 Favored 'General case' 0 C--N 1.305 -1.367 0 N-CA-C 108.532 -0.914 . . . . 0.0 108.532 -178.672 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 37.0 t70 -102.83 12.51 36.1 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 114.868 -1.06 . . . . 0.0 108.47 177.09 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 49.9 m 71.15 20.66 5.07 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 114.974 -1.012 . . . . 0.0 110.905 -179.141 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 8.2 t -67.7 120.56 14.27 Favored 'General case' 0 N--CA 1.447 -0.597 0 N-CA-C 108.779 -0.823 . . . . 0.0 108.779 177.711 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.524 ' HA ' ' O ' ' A' ' 26' ' ' VAL . 46.5 mt-10 -89.15 108.97 19.9 Favored 'General case' 0 C--N 1.313 -0.986 0 CA-C-O 121.338 0.59 . . . . 0.0 111.217 -178.138 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 38.9 mm -98.54 136.85 27.89 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.562 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 177.68 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 11.7 m170 -117.34 133.31 56.12 Favored 'General case' 0 C--N 1.316 -0.854 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 -178.388 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.533 ' HZ ' HG23 ' A' ' 26' ' ' VAL . 1.7 p90 -147.2 170.35 17.42 Favored 'General case' 0 C--N 1.309 -1.178 0 CA-C-O 121.376 0.608 . . . . 0.0 111.607 -178.35 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 15.1 ptpt -130.7 119.91 23.08 Favored 'General case' 0 C--N 1.314 -0.975 0 CA-C-N 115.584 -0.734 . . . . 0.0 111.027 -178.543 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.426 HG21 HD12 ' A' ' 47' ' ' LEU . 24.4 m -139.84 159.57 27.0 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 116.23 -0.441 . . . . 0.0 109.968 -179.26 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 25.9 mtpp -77.11 176.17 8.96 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-O 121.342 0.592 . . . . 0.0 111.18 179.347 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.5 -35.79 19.39 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.874 178.323 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 13.8 t -93.8 10.52 32.78 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 121.292 0.567 . . . . 0.0 111.607 -176.181 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 7.2 t -94.74 173.65 7.5 Favored 'General case' 0 C--N 1.32 -0.698 0 O-C-N 121.779 -0.575 . . . . 0.0 110.201 -179.617 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 46.0 m170 -90.4 147.72 23.26 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 121.637 0.732 . . . . 0.0 111.611 -179.101 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.492 ' O ' ' HG2' ' A' ' 48' ' ' LYS . 1.3 mm? -70.23 -13.22 62.08 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.426 -0.806 . . . . 0.0 110.707 178.754 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.542 ' HB3' ' HB2' ' A' ' 73' ' ' ASP . 0.0 OUTLIER -54.26 -43.23 70.77 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.986 -178.899 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -71.19 -33.35 69.88 Favored 'General case' 0 C--O 1.2 -1.536 0 CA-C-O 121.069 0.461 . . . . 0.0 110.443 178.918 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.426 HD12 HG21 ' A' ' 38' ' ' VAL . 9.4 tt -69.14 -50.96 43.16 Favored 'General case' 0 C--N 1.309 -1.187 0 CA-C-O 121.105 0.479 . . . . 0.0 110.793 -178.855 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.492 ' HG2' ' O ' ' A' ' 44' ' ' LEU . 4.5 ptmm? -62.17 -40.62 96.61 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.542 -178.966 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.7 -32.86 68.26 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.11 0.481 . . . . 0.0 110.468 177.986 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . 0.651 ' O ' ' HG2' ' A' ' 54' ' ' ARG . 5.3 m -68.81 -40.98 79.24 Favored 'General case' 0 N--CA 1.45 -0.445 0 N-CA-C 112.52 0.563 . . . . 0.0 112.52 -177.822 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.475 ' CD1' HG11 ' A' ' 26' ' ' VAL . 2.0 p90 -76.45 -33.06 58.76 Favored 'General case' 0 C--N 1.317 -0.809 0 C-N-CA 119.005 -1.078 . . . . 0.0 110.203 179.352 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . 0.615 ' SG ' HD11 ' A' ' 62' ' ' LEU . 92.0 m -61.37 -45.65 93.47 Favored 'General case' 0 CA--C 1.511 -0.521 0 CA-C-O 121.221 0.534 . . . . 0.0 110.19 178.597 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -65.44 -35.67 81.61 Favored 'General case' 0 N--CA 1.442 -0.845 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.536 -179.663 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.651 ' HG2' ' O ' ' A' ' 50' ' ' SER . 41.9 mmt-85 -57.36 -39.1 75.26 Favored 'General case' 0 C--N 1.348 0.524 0 CA-C-O 121.123 0.487 . . . . 0.0 111.388 177.327 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.432 HE21 ' HB2' ' A' ' 55' ' ' GLN . 3.0 mt-30 -78.53 -21.78 48.3 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-O 120.958 0.408 . . . . 0.0 110.783 179.859 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 82.9 29.74 33.85 Favored Glycine 0 N--CA 1.442 -0.931 0 C-N-CA 120.434 -0.888 . . . . 0.0 111.727 179.348 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 35.9 m -130.43 148.26 69.2 Favored Pre-proline 0 C--N 1.323 -0.584 0 O-C-N 122.454 -0.439 . . . . 0.0 110.645 -178.969 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 29.1 Cg_endo -65.78 150.73 85.79 Favored 'Trans proline' 0 N--CA 1.458 -0.602 0 C-N-CA 122.27 1.98 . . . . 0.0 111.72 177.971 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 73.6 mtp -67.49 -7.79 28.51 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-N 116.113 -0.494 . . . . 0.0 112.236 -176.661 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 24.2 p30 -90.41 -12.19 38.22 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 121.387 0.613 . . . . 0.0 111.162 -179.194 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 68.1 m -84.94 -20.32 30.82 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.775 -179.906 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.615 HD11 ' SG ' ' A' ' 52' ' ' CYS . 1.4 pp -136.66 157.44 46.75 Favored 'General case' 0 C--N 1.31 -1.115 0 CA-C-O 121.71 0.767 . . . . 0.0 113.027 -176.545 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.439 ' HG3' ' HB2' ' A' ' 91' ' ' TYR . 1.2 ptp180 -115.68 138.1 51.43 Favored 'General case' 0 C--N 1.314 -0.953 0 CA-C-N 115.049 -0.978 . . . . 0.0 112.376 179.224 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.444 ' CZ ' ' HE2' ' A' ' 48' ' ' LYS . 0.1 OUTLIER -114.14 120.84 41.88 Favored 'General case' 0 C--N 1.313 -0.979 0 CA-C-N 114.983 -1.008 . . . . 0.0 110.541 -176.968 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.453 ' C ' HD22 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -142.94 164.76 29.21 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.33 0.586 . . . . 0.0 111.043 179.298 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 92.3 t80 -147.05 135.33 21.69 Favored 'General case' 0 C--N 1.314 -0.952 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 178.918 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.447 ' HG2' HE21 ' A' ' 69' ' ' GLN . 6.6 pt-20 49.33 26.3 1.54 Allowed 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 124.406 1.082 . . . . 0.0 112.549 -179.17 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 87.57 21.76 46.42 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.913 -0.661 . . . . 0.0 112.934 -179.082 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . 0.447 HE21 ' HG2' ' A' ' 67' ' ' GLU . 2.7 pt20 -129.93 136.78 49.87 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 109.365 -0.606 . . . . 0.0 109.365 -179.808 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 3.1 ptt180 -68.67 147.5 51.78 Favored 'General case' 0 C--N 1.308 -1.231 0 CA-C-O 121.585 0.707 . . . . 0.0 111.02 177.671 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 21.8 mm -97.52 118.55 44.19 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.227 0 N-CA-C 109.708 -0.478 . . . . 0.0 109.708 179.014 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -103.28 167.05 10.06 Favored 'General case' 0 N--CA 1.442 -0.864 0 CA-C-O 120.881 0.372 . . . . 0.0 110.211 -178.854 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . 0.542 ' HB2' ' HB3' ' A' ' 45' ' ' LYS . 8.6 p-10 -66.6 -22.06 66.13 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.779 -178.236 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 9.2 m-80 -98.93 1.78 45.91 Favored 'General case' 0 CA--C 1.51 -0.568 0 CA-C-O 121.238 0.542 . . . . 0.0 110.205 -178.553 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . 0.45 ' CG ' HD21 ' A' ' 80' ' ' LEU . 3.2 m170 -81.06 141.72 34.06 Favored 'General case' 0 C--N 1.318 -0.799 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 179.714 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.426 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 70.2 p -116.64 153.58 49.1 Favored Pre-proline 0 C--N 1.307 -1.245 0 C-N-CA 121.072 -0.251 . . . . 0.0 110.675 179.242 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_exo -61.36 -37.75 69.95 Favored 'Trans proline' 0 N--CA 1.459 -0.549 0 C-N-CA 122.463 2.109 . . . . 0.0 111.557 179.796 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . 0.515 ' HG3' ' N ' ' A' ' 79' ' ' GLU . 33.1 pttt -68.83 -38.65 79.97 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.92 -178.713 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . 0.515 ' N ' ' HG3' ' A' ' 78' ' ' LYS . 11.8 mm-40 -72.74 -38.29 67.44 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-O 120.953 0.406 . . . . 0.0 111.098 -178.808 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.45 HD21 ' CG ' ' A' ' 75' ' ' HIS . 5.2 mt -76.46 -6.79 53.29 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-O 121.485 0.66 . . . . 0.0 110.468 179.39 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 79.44 43.08 10.74 Favored Glycine 0 N--CA 1.452 -0.258 0 CA-C-N 115.905 -0.588 . . . . 0.0 112.954 177.201 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 60.6 mtt -102.82 165.6 10.96 Favored 'General case' 0 C--N 1.314 -0.937 0 N-CA-C 109.835 -0.431 . . . . 0.0 109.835 179.126 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -142.66 -171.45 3.43 Favored 'General case' 0 C--N 1.314 -0.952 0 N-CA-C 109.37 -0.604 . . . . 0.0 109.37 177.663 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -71.24 139.01 49.91 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-O 121.435 0.636 . . . . 0.0 111.145 -178.845 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 17.7 tp10 74.51 5.72 4.53 Favored 'General case' 0 C--N 1.321 -0.659 0 C-N-CA 125.012 1.325 . . . . 0.0 111.761 179.229 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -66.22 165.91 12.95 Favored 'General case' 0 C--O 1.238 0.475 0 CA-C-O 121.05 0.452 . . . . 0.0 110.763 176.941 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . 0.437 ' HA ' ' O ' ' A' ' 25' ' ' LYS . 14.9 p -127.55 145.18 35.37 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.876 0 CA-C-O 121.443 0.64 . . . . 0.0 112.054 -175.299 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 3.6 mp -115.56 152.86 17.17 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 177.527 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 -107.19 138.19 43.84 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.038 0.447 . . . . 0.0 110.601 -175.981 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 84.9 t -129.74 137.38 56.85 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.75 0 CA-C-O 121.299 0.571 . . . . 0.0 111.351 -179.3 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . 0.439 ' HB2' ' HG3' ' A' ' 63' ' ' ARG . 96.5 m-85 -123.77 167.09 14.49 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.09 178.802 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 7.0 tp60 -95.39 139.01 32.29 Favored 'General case' 0 C--N 1.31 -1.113 0 N-CA-C 109.841 -0.429 . . . . 0.0 109.841 -179.654 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 . . . . . 0 C--N 1.324 -0.518 0 CA-C-O 121.366 0.603 . . . . 0.0 110.281 176.911 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 26.3 pt . . . . . 0 N--CA 1.447 -0.61 0 CA-C-O 121.463 0.649 . . . . 0.0 110.593 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 3.7 mtmt -120.1 141.95 49.34 Favored 'General case' 0 C--N 1.299 -1.599 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 -179.271 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.4 mp -136.02 162.51 32.68 Favored 'General case' 0 C--N 1.305 -1.361 0 CA-C-O 121.283 0.563 . . . . 0.0 111.02 177.218 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.418 ' O ' ' HA ' ' A' ' 87' ' ' VAL . 4.9 tmmm? -131.4 142.54 50.06 Favored 'General case' 0 N--CA 1.437 -1.092 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.386 -179.114 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.515 HG23 ' HZ ' ' A' ' 36' ' ' PHE . 0.9 OUTLIER -113.13 142.05 26.83 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.447 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.232 179.892 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.458 ' O ' ' HB ' ' A' ' 90' ' ' VAL . 43.7 mm -104.32 115.54 46.44 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.952 0 N-CA-C 107.373 -1.343 . . . . 0.0 107.373 175.373 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -78.85 179.09 52.97 Favored Glycine 0 N--CA 1.431 -1.669 0 C-N-CA 120.795 -0.717 . . . . 0.0 113.138 -175.683 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.836 ' H ' ' NE2' ' A' ' 29' ' ' GLN . 0.0 OUTLIER -74.7 -22.26 58.94 Favored 'General case' 0 N--CA 1.436 -1.167 0 CA-C-O 121.996 0.903 . . . . 0.0 108.73 -178.105 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -102.62 12.57 36.19 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.032 -0.985 . . . . 0.0 108.525 176.171 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 37.1 t 73.36 18.09 3.76 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 115.174 -0.921 . . . . 0.0 110.418 -179.541 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 7.9 t -70.44 116.57 10.92 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 179.058 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.493 ' HA ' ' O ' ' A' ' 26' ' ' VAL . 37.0 mt-10 -87.76 110.59 20.57 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-O 121.144 0.497 . . . . 0.0 110.484 179.979 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 32.1 mm -98.57 139.04 21.4 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.573 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 178.235 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 10.1 m170 -119.37 131.73 55.73 Favored 'General case' 0 C--N 1.315 -0.905 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 -178.962 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.515 ' HZ ' HG23 ' A' ' 26' ' ' VAL . 1.4 p90 -146.88 173.42 12.42 Favored 'General case' 0 C--N 1.309 -1.167 0 CA-C-O 121.15 0.5 . . . . 0.0 110.862 -178.463 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 17.6 ptpt -134.29 120.65 20.22 Favored 'General case' 0 C--N 1.314 -0.951 0 CA-C-O 121.191 0.519 . . . . 0.0 111.137 -179.144 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 26.3 m -137.97 162.47 31.26 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 N-CA-C 109.406 -0.59 . . . . 0.0 109.406 -179.743 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.512 ' O ' HG22 ' A' ' 42' ' ' THR . 40.6 tttp -86.79 163.26 17.36 Favored 'General case' 0 C--N 1.313 -0.988 0 O-C-N 121.519 -0.738 . . . . 0.0 110.947 -179.596 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . 0.401 ' H ' ' HG2' ' A' ' 39' ' ' LYS . 0.0 OUTLIER -65.82 -41.72 91.49 Favored 'General case' 0 CA--C 1.517 -0.298 0 N-CA-C 112.79 0.663 . . . . 0.0 112.79 -177.808 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 11.9 t -96.11 13.14 28.22 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-O 121.068 0.461 . . . . 0.0 112.113 -174.988 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . 0.512 HG22 ' O ' ' A' ' 39' ' ' LYS . 2.0 t -91.03 161.88 14.94 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 179.666 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . 0.428 ' O ' ' HG2' ' A' ' 46' ' ' LYS . 42.5 m170 -75.06 138.86 42.44 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-O 121.589 0.709 . . . . 0.0 111.572 -179.979 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.634 HD13 ' HB3' ' A' ' 47' ' ' LEU . 0.2 OUTLIER -67.94 -15.4 63.59 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.219 -0.901 . . . . 0.0 109.972 -179.02 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.679 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -53.35 -45.97 69.36 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.844 -0.616 . . . . 0.0 112.433 -177.952 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.428 ' HG2' ' O ' ' A' ' 43' ' ' HIS . 21.8 ptmt -65.82 -29.37 69.83 Favored 'General case' 0 C--O 1.218 -0.562 0 CA-C-O 121.345 0.593 . . . . 0.0 110.579 -178.528 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.634 ' HB3' HD13 ' A' ' 44' ' ' LEU . 7.7 tt -72.97 -46.47 52.16 Favored 'General case' 0 C--N 1.311 -1.076 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.925 -179.596 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.607 ' HG3' ' O ' ' A' ' 44' ' ' LEU . 26.8 mtpt -58.29 -48.79 79.37 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-O 121.512 0.672 . . . . 0.0 110.185 -179.142 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.679 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 7.0 pt-20 -71.16 -31.32 67.53 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.976 -178.793 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . 0.45 ' O ' ' HG2' ' A' ' 54' ' ' ARG . 38.0 t -65.44 -45.69 82.84 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.979 0.419 . . . . 0.0 111.283 -179.811 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.495 ' CD1' HG11 ' A' ' 26' ' ' VAL . 2.1 p90 -76.47 -32.64 58.49 Favored 'General case' 0 N--CA 1.443 -0.786 0 C-N-CA 119.86 -0.736 . . . . 0.0 110.539 -177.378 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . 0.488 ' SG ' ' HG2' ' A' ' 59' ' ' MET . 99.7 m -64.15 -44.15 92.99 Favored 'General case' 0 CA--C 1.509 -0.634 0 CA-C-O 121.105 0.479 . . . . 0.0 110.547 179.436 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 13.5 pt20 -67.73 -33.46 74.92 Favored 'General case' 0 N--CA 1.443 -0.779 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.274 -179.668 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.45 ' HG2' ' O ' ' A' ' 50' ' ' SER . 13.7 mmt180 -57.5 -38.16 74.17 Favored 'General case' 0 C--N 1.348 0.524 0 CA-C-O 121.018 0.437 . . . . 0.0 111.042 177.055 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.428 HE21 ' HB2' ' A' ' 55' ' ' GLN . 3.7 mt-30 -82.19 -22.47 35.96 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.968 -179.746 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 82.94 29.18 35.26 Favored Glycine 0 N--CA 1.443 -0.849 0 C-N-CA 120.548 -0.834 . . . . 0.0 111.886 -179.868 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 33.9 m -125.56 150.9 69.46 Favored Pre-proline 0 C--N 1.325 -0.467 0 O-C-N 122.45 -0.441 . . . . 0.0 110.649 -178.661 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . 0.502 ' HG2' ' OG ' ' A' ' 61' ' ' SER . 43.4 Cg_endo -71.01 149.9 59.74 Favored 'Trans proline' 0 N--CA 1.453 -0.871 0 C-N-CA 122.295 1.997 . . . . 0.0 111.856 177.277 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.488 ' HG2' ' SG ' ' A' ' 52' ' ' CYS . 80.6 mtp -70.1 -7.55 42.38 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.779 -177.279 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 31.3 p30 -89.12 -11.98 42.39 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.472 0.653 . . . . 0.0 110.968 179.272 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.502 ' OG ' ' HG2' ' A' ' 58' ' ' PRO . 70.3 m -90.81 -19.05 23.87 Favored 'General case' 0 N--CA 1.439 -0.986 0 N-CA-C 112.459 0.54 . . . . 0.0 112.459 -178.122 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.471 HD11 ' SG ' ' A' ' 52' ' ' CYS . 1.4 pp -128.09 167.89 16.13 Favored 'General case' 0 C--N 1.313 -1.0 0 N-CA-C 113.139 0.792 . . . . 0.0 113.139 -177.674 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.499 ' O ' ' HA ' ' A' ' 90' ' ' VAL . 35.6 mtm180 -118.66 118.29 31.26 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.261 -0.881 . . . . 0.0 110.669 -177.566 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -101.56 112.41 24.95 Favored 'General case' 0 C--N 1.312 -1.037 0 CA-C-O 121.134 0.492 . . . . 0.0 110.723 178.704 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.462 ' C ' HD22 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -141.52 164.62 29.73 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-O 121.528 0.68 . . . . 0.0 111.461 -179.377 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 88.3 t80 -144.77 133.81 22.68 Favored 'General case' 0 C--N 1.308 -1.198 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 177.733 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 49.36 29.59 2.85 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 124.264 1.025 . . . . 0.0 112.288 -178.884 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 87.26 16.28 60.94 Favored Glycine 0 N--CA 1.446 -0.681 0 C-N-CA 120.969 -0.634 . . . . 0.0 113.599 179.593 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 2.7 pt20 -125.86 135.73 52.28 Favored 'General case' 0 C--N 1.32 -0.698 0 O-C-N 122.254 -0.556 . . . . 0.0 109.623 -178.907 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.417 ' H ' ' HD2' ' A' ' 70' ' ' ARG . 0.2 OUTLIER -70.48 148.64 48.05 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-O 121.667 0.746 . . . . 0.0 110.379 177.792 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.486 HG21 HD12 ' A' ' 44' ' ' LEU . 23.4 mm -96.47 122.42 47.95 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.917 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.049 -179.278 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -95.31 166.07 12.07 Favored 'General case' 0 N--CA 1.436 -1.158 0 N-CA-C 109.697 -0.482 . . . . 0.0 109.697 -179.786 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . 0.422 ' CA ' ' HB3' ' A' ' 45' ' ' LYS . 11.8 p-10 -71.18 -21.04 62.21 Favored 'General case' 0 C--N 1.31 -1.121 0 CA-C-O 121.4 0.619 . . . . 0.0 110.773 -179.598 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 13.2 m-80 -98.73 4.0 47.71 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-O 121.175 0.512 . . . . 0.0 110.152 179.437 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . 0.601 ' O ' ' HB2' ' A' ' 44' ' ' LEU . 3.2 m170 -83.16 146.52 28.59 Favored 'General case' 0 CA--C 1.503 -0.862 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 -179.875 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.499 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 69.0 p -122.25 155.89 61.1 Favored Pre-proline 0 C--N 1.306 -1.308 0 C-N-CA 121.041 -0.264 . . . . 0.0 110.976 178.53 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -60.79 -41.67 44.26 Favored 'Trans proline' 0 N--CA 1.459 -0.533 0 C-N-CA 122.418 2.079 . . . . 0.0 111.01 179.619 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . 0.525 ' HG3' ' N ' ' A' ' 79' ' ' GLU . 44.6 pttt -65.28 -41.56 94.04 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.106 -178.618 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . 0.525 ' N ' ' HG3' ' A' ' 78' ' ' LYS . 60.2 mm-40 -71.2 -36.14 71.81 Favored 'General case' 0 N--CA 1.445 -0.725 0 CA-C-O 120.999 0.428 . . . . 0.0 111.176 -177.661 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.499 ' HG ' ' O ' ' A' ' 76' ' ' THR . 5.9 mt -79.22 -6.05 55.71 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.202 0.525 . . . . 0.0 110.908 179.922 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 83.14 42.37 8.07 Favored Glycine 0 N--CA 1.454 -0.16 0 C-N-CA 121.032 -0.604 . . . . 0.0 113.027 177.855 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 61.1 mtt -103.59 165.89 10.76 Favored 'General case' 0 C--N 1.315 -0.914 0 O-C-N 122.314 -0.521 . . . . 0.0 109.885 178.775 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . 0.415 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 10.1 pt-20 -137.22 -172.12 3.12 Favored 'General case' 0 C--N 1.312 -1.046 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 178.455 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -76.93 141.88 40.3 Favored 'General case' 0 N--CA 1.444 -0.743 0 C-N-CA 119.52 -0.872 . . . . 0.0 110.56 179.6 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 77.8 3.22 2.96 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 124.779 1.232 . . . . 0.0 110.71 -178.93 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . 0.415 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 1.6 t0 -63.05 164.74 7.91 Favored 'General case' 0 C--O 1.239 0.551 0 CA-C-O 121.249 0.547 . . . . 0.0 111.035 177.874 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . 0.418 ' HA ' ' O ' ' A' ' 25' ' ' LYS . 7.9 p -128.34 145.01 36.08 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.067 0 CA-C-O 121.288 0.566 . . . . 0.0 111.338 -176.996 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 3.7 mp -113.88 153.7 15.38 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.825 0 N-CA-C 109.095 -0.705 . . . . 0.0 109.095 177.86 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -104.0 135.95 44.55 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-O 120.918 0.39 . . . . 0.0 110.545 -175.643 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . 0.499 ' HA ' ' O ' ' A' ' 63' ' ' ARG . 57.9 t -129.84 134.0 63.8 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.854 0 CA-C-O 121.391 0.615 . . . . 0.0 110.904 178.356 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 83.3 m-85 -122.78 176.0 6.22 Favored 'General case' 0 C--N 1.313 -0.994 0 CA-C-N 115.962 -0.563 . . . . 0.0 109.492 178.819 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 6.7 tp60 -101.08 146.77 27.02 Favored 'General case' 0 C--N 1.305 -1.366 0 N-CA-C 109.705 -0.48 . . . . 0.0 109.705 178.87 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 . . . . . 0 C--N 1.321 -0.637 0 CA-C-O 121.452 0.644 . . . . 0.0 110.454 175.695 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . 0.554 ' HB ' ' HA ' ' A' ' 84' ' ' GLU . 19.9 pt . . . . . 0 N--CA 1.443 -0.821 0 CA-C-O 121.301 0.572 . . . . 0.0 110.566 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.476 ' HD3' ' N ' ' A' ' 23' ' ' LYS . 0.0 OUTLIER -121.51 143.44 49.27 Favored 'General case' 0 C--N 1.308 -1.201 0 N-CA-C 108.706 -0.85 . . . . 0.0 108.706 -179.489 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.4 mp -138.0 166.62 23.64 Favored 'General case' 0 C--N 1.306 -1.294 0 CA-C-O 121.256 0.551 . . . . 0.0 111.195 177.606 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 4.8 tmmm? -134.0 144.08 48.52 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.518 -179.917 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.609 ' O ' ' HA ' ' A' ' 33' ' ' GLU . 0.9 OUTLIER -115.41 141.54 32.01 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.159 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.707 -179.932 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.47 HD13 ' HG2' ' A' ' 33' ' ' GLU . 35.4 mm -111.26 99.57 8.97 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.728 0 N-CA-C 108.234 -1.024 . . . . 0.0 108.234 175.827 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . 0.671 ' HA3' ' OG ' ' A' ' 32' ' ' SER . . . -71.63 172.46 45.63 Favored Glycine 0 N--CA 1.426 -2.014 0 C-N-CA 119.626 -1.274 . . . . 0.0 114.007 179.722 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.416 ' HG3' ' H ' ' A' ' 29' ' ' GLN . 0.0 OUTLIER -66.04 -18.26 65.23 Favored 'General case' 0 C--N 1.307 -1.245 0 CA-C-N 114.607 -0.797 . . . . 0.0 110.99 179.539 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -100.19 10.5 41.16 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.465 -0.788 . . . . 0.0 109.375 178.589 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 50.2 m 71.61 23.31 3.81 Favored 'General case' 0 C--N 1.342 0.275 0 CA-C-O 121.913 0.864 . . . . 0.0 109.113 -175.244 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . 0.671 ' OG ' ' HA3' ' A' ' 28' ' ' GLY . 2.2 p -70.77 92.52 0.89 Allowed 'General case' 0 N--CA 1.42 -1.933 0 CA-C-N 114.983 -1.008 . . . . 0.0 111.403 -179.339 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.609 ' HA ' ' O ' ' A' ' 26' ' ' VAL . 31.4 mt-10 -81.52 102.08 10.35 Favored 'General case' 0 CA--C 1.505 -0.759 0 CA-C-O 121.211 0.529 . . . . 0.0 110.579 178.71 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.426 HG21 ' HA ' ' A' ' 51' ' ' TYR . 29.5 mm -99.73 138.97 22.45 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.718 0 N-CA-C 109.283 -0.636 . . . . 0.0 109.283 179.317 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 12.0 m170 -116.43 132.9 56.55 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 178.991 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.537 ' HZ ' HG23 ' A' ' 26' ' ' VAL . 1.0 OUTLIER -147.26 167.89 23.12 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-O 121.179 0.514 . . . . 0.0 111.555 -177.456 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 91.7 mttt -124.11 125.12 43.94 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.902 -0.59 . . . . 0.0 109.805 -178.963 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 24.1 m -144.72 152.77 14.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 121.048 0.451 . . . . 0.0 110.443 -179.852 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 36.5 mtpt -77.65 174.93 10.39 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-O 121.665 0.745 . . . . 0.0 111.401 177.436 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -87.02 -32.67 19.89 Favored 'General case' 0 C--N 1.31 -1.122 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.371 179.24 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 9.8 t -94.68 14.63 20.52 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.324 -177.293 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 6.4 t -105.42 167.36 9.8 Favored 'General case' 0 C--N 1.316 -0.865 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 179.903 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . 0.444 ' O ' ' HG2' ' A' ' 46' ' ' LYS . 46.4 m170 -81.9 142.41 32.51 Favored 'General case' 0 C--N 1.312 -1.022 0 CA-C-O 121.675 0.75 . . . . 0.0 111.84 -179.309 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.652 ' O ' ' HG3' ' A' ' 48' ' ' LYS . 0.2 OUTLIER -64.88 -17.68 64.52 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 114.998 -1.001 . . . . 0.0 109.893 179.296 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.739 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -51.9 -47.81 64.44 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.967 -179.043 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.444 ' HG2' ' O ' ' A' ' 43' ' ' HIS . 22.5 ptmt -58.97 -34.29 71.63 Favored 'General case' 0 C--O 1.207 -1.147 0 CA-C-O 121.077 0.465 . . . . 0.0 110.385 -179.274 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.554 ' HB3' HD13 ' A' ' 44' ' ' LEU . 8.2 tt -70.6 -47.98 57.44 Favored 'General case' 0 C--N 1.301 -1.531 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.124 -179.997 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.652 ' HG3' ' O ' ' A' ' 44' ' ' LEU . 20.8 mtpt -59.98 -49.93 75.73 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.509 -178.041 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.739 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 10.4 pt-20 -67.67 -33.89 75.83 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.441 -179.25 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . 0.613 ' O ' ' HG2' ' A' ' 54' ' ' ARG . 7.5 m -66.39 -45.66 79.27 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.845 -179.659 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.462 ' CE2' ' HA ' ' A' ' 48' ' ' LYS . 2.1 p90 -76.35 -32.69 58.79 Favored 'General case' 0 N--CA 1.445 -0.677 0 C-N-CA 119.667 -0.813 . . . . 0.0 110.672 -177.775 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . 0.529 ' SG ' ' HG2' ' A' ' 59' ' ' MET . 69.2 m -61.98 -44.75 96.09 Favored 'General case' 0 C--O 1.238 0.466 0 CA-C-O 121.0 0.428 . . . . 0.0 110.793 179.083 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 11.6 pt20 -67.99 -33.39 74.53 Favored 'General case' 0 N--CA 1.447 -0.601 0 C-N-CA 120.66 -0.416 . . . . 0.0 110.533 -179.922 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.613 ' HG2' ' O ' ' A' ' 50' ' ' SER . 17.8 mmt85 -57.67 -38.04 74.44 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-O 121.313 0.578 . . . . 0.0 110.832 177.531 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.417 HE21 ' HB2' ' A' ' 55' ' ' GLN . 3.4 mt-30 -81.29 -21.31 39.4 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.954 179.914 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 82.86 29.99 33.31 Favored Glycine 0 N--CA 1.446 -0.688 0 C-N-CA 120.834 -0.698 . . . . 0.0 112.325 179.224 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 35.0 m -132.17 147.63 66.55 Favored Pre-proline 0 C--N 1.324 -0.504 0 O-C-N 122.508 -0.407 . . . . 0.0 110.786 -179.042 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . 0.597 ' HG2' ' OG ' ' A' ' 61' ' ' SER . 18.8 Cg_endo -63.35 150.35 88.79 Favored 'Trans proline' 0 N--CA 1.456 -0.683 0 C-N-CA 122.33 2.02 . . . . 0.0 111.955 177.601 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.529 ' HG2' ' SG ' ' A' ' 52' ' ' CYS . 69.8 mtp -70.01 -9.16 54.33 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.77 -176.338 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . 0.403 ' OD1' ' HB2' ' A' ' 58' ' ' PRO . 1.9 p-10 -92.19 -8.52 45.26 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 121.23 0.538 . . . . 0.0 110.886 -179.607 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.597 ' OG ' ' HG2' ' A' ' 58' ' ' PRO . 67.3 m -84.66 -23.36 29.49 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 121.002 0.429 . . . . 0.0 111.836 179.516 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.457 HD11 ' SG ' ' A' ' 52' ' ' CYS . 1.2 pp -125.57 169.14 12.76 Favored 'General case' 0 C--N 1.307 -1.247 0 N-CA-C 113.313 0.856 . . . . 0.0 113.313 -175.091 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.466 ' O ' ' HA ' ' A' ' 90' ' ' VAL . 52.5 mtm180 -116.16 112.42 21.65 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.176 -0.92 . . . . 0.0 110.722 -178.156 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.41 ' HB3' ' OH ' ' A' ' 51' ' ' TYR . 0.1 OUTLIER -96.91 115.12 26.88 Favored 'General case' 0 C--N 1.31 -1.131 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.522 178.466 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.459 ' C ' HD22 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -143.54 162.12 36.68 Favored 'General case' 0 N--CA 1.443 -0.792 0 CA-C-O 121.745 0.783 . . . . 0.0 111.834 -179.65 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 92.5 t80 -145.79 136.95 24.75 Favored 'General case' 0 C--N 1.309 -1.168 0 N-CA-C 108.785 -0.82 . . . . 0.0 108.785 178.564 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.453 ' HG2' HE21 ' A' ' 69' ' ' GLN . 7.1 pt-20 48.54 29.04 1.94 Allowed 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 124.391 1.076 . . . . 0.0 112.231 -178.417 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 83.57 23.17 54.49 Favored Glycine 0 N--CA 1.447 -0.589 0 C-N-CA 120.935 -0.65 . . . . 0.0 113.26 -179.646 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . 0.453 HE21 ' HG2' ' A' ' 67' ' ' GLU . 3.0 pt20 -130.47 137.41 49.77 Favored 'General case' 0 C--N 1.32 -0.711 0 O-C-N 122.212 -0.581 . . . . 0.0 109.462 179.826 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.422 ' H ' ' HD2' ' A' ' 70' ' ' ARG . 0.5 OUTLIER -73.07 146.62 45.69 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-O 121.704 0.764 . . . . 0.0 110.172 178.154 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.454 HG21 HD12 ' A' ' 44' ' ' LEU . 22.6 mm -92.63 119.56 40.45 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.855 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.308 -178.391 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -94.88 161.03 14.32 Favored 'General case' 0 N--CA 1.434 -1.232 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 178.841 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . 0.413 ' HB3' ' HB3' ' A' ' 45' ' ' LYS . 66.3 m-20 -67.87 -21.18 65.18 Favored 'General case' 0 C--N 1.314 -0.964 0 CA-C-O 121.303 0.573 . . . . 0.0 111.506 -177.918 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 6.1 m-80 -100.44 6.78 44.44 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-O 121.268 0.556 . . . . 0.0 110.1 -179.437 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . 0.582 ' O ' ' HB2' ' A' ' 44' ' ' LEU . 2.2 m170 -83.27 145.84 28.88 Favored 'General case' 0 CA--C 1.5 -0.955 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 178.342 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.417 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 68.8 p -118.24 152.91 51.29 Favored Pre-proline 0 C--N 1.301 -1.53 0 C-N-CA 120.824 -0.351 . . . . 0.0 111.476 179.647 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_exo -57.3 -41.03 77.52 Favored 'Trans proline' 0 C--N 1.349 0.584 0 C-N-CA 122.597 2.198 . . . . 0.0 111.431 178.508 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . 0.54 ' HG3' ' N ' ' A' ' 79' ' ' GLU . 48.1 pttt -64.58 -40.92 96.41 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.877 -178.918 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . 0.54 ' N ' ' HG3' ' A' ' 78' ' ' LYS . 55.6 mm-40 -73.55 -35.73 65.55 Favored 'General case' 0 N--CA 1.439 -0.99 0 CA-C-O 120.951 0.405 . . . . 0.0 111.463 -177.592 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.455 HD21 ' CG ' ' A' ' 75' ' ' HIS . 5.5 mt -80.69 -0.93 40.44 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.119 0.485 . . . . 0.0 111.253 -179.35 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 78.26 37.78 27.35 Favored Glycine 0 CA--C 1.51 -0.256 0 C-N-CA 120.872 -0.68 . . . . 0.0 112.963 177.174 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 61.0 mtt -100.18 165.26 11.58 Favored 'General case' 0 C--N 1.311 -1.082 0 N-CA-C 109.844 -0.428 . . . . 0.0 109.844 179.35 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -148.2 -171.32 3.81 Favored 'General case' 0 C--N 1.311 -1.084 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 178.151 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.554 ' HA ' ' HB ' ' A' ' 22' ' ' ILE . 15.8 pt-20 -71.19 138.39 49.5 Favored 'General case' 0 N--CA 1.443 -0.778 0 C-N-CA 120.223 -0.591 . . . . 0.0 110.928 -179.89 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 79.7 -2.29 2.1 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 124.801 1.24 . . . . 0.0 111.433 178.861 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -59.33 162.5 4.65 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-O 121.395 0.617 . . . . 0.0 111.284 179.109 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 7.1 p -129.48 143.38 41.32 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.948 0 CA-C-O 121.285 0.564 . . . . 0.0 111.33 -177.001 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 3.7 mp -114.47 153.9 15.91 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 179.642 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 11.0 tp10 -107.41 138.56 43.39 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 120.802 0.334 . . . . 0.0 110.102 -177.226 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . 0.596 ' HB ' ' HA2' ' A' ' 28' ' ' GLY . 97.1 t -130.62 134.05 62.62 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.974 0 CA-C-O 121.47 0.653 . . . . 0.0 110.922 178.863 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 89.0 m-85 -119.27 -177.36 3.33 Favored 'General case' 0 C--N 1.306 -1.284 0 CA-C-N 115.886 -0.597 . . . . 0.0 109.465 179.799 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 8.1 tp60 -108.31 148.26 30.3 Favored 'General case' 0 C--N 1.307 -1.263 0 O-C-N 121.934 -0.478 . . . . 0.0 110.38 -179.281 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' GLU . . . . . 0.419 ' OE2' ' HG2' ' A' ' 63' ' ' ARG . 10.5 pt-20 . . . . . 0 C--N 1.329 -0.309 0 CA-C-O 121.702 0.763 . . . . 0.0 110.322 174.658 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . 0.518 ' HB ' ' HA ' ' A' ' 84' ' ' GLU . 27.7 pt . . . . . 0 N--CA 1.44 -0.973 0 CA-C-O 121.471 0.653 . . . . 0.0 110.131 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 41.1 mtmt -120.95 142.5 49.69 Favored 'General case' 0 C--N 1.296 -1.745 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 179.899 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.6 mp -135.76 160.83 37.32 Favored 'General case' 0 C--N 1.301 -1.539 0 CA-C-O 121.278 0.561 . . . . 0.0 110.755 176.708 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.429 ' O ' ' HA ' ' A' ' 87' ' ' VAL . 5.1 tmmm? -130.17 142.09 50.61 Favored 'General case' 0 C--N 1.309 -1.156 0 CA-C-O 121.37 0.605 . . . . 0.0 110.315 -178.728 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.519 HG23 ' HZ ' ' A' ' 36' ' ' PHE . 0.9 OUTLIER -112.87 142.82 24.03 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.544 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.353 -179.142 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 44.4 mm -106.97 115.61 48.86 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.138 0 N-CA-C 107.463 -1.31 . . . . 0.0 107.463 174.737 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -78.13 178.31 52.66 Favored Glycine 0 N--CA 1.423 -2.202 0 C-N-CA 120.796 -0.716 . . . . 0.0 113.257 -175.054 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.837 ' H ' ' NE2' ' A' ' 29' ' ' GLN . 0.0 OUTLIER -72.72 -27.63 62.17 Favored 'General case' 0 C--N 1.3 -1.581 0 CA-C-O 122.141 0.972 . . . . 0.0 108.442 -179.02 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -102.73 16.28 26.95 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 114.705 -1.134 . . . . 0.0 108.343 178.375 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 21.3 m 73.46 15.86 4.13 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 115.267 -0.879 . . . . 0.0 111.402 179.003 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 21.6 t -68.04 110.41 3.92 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.05 179.304 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.512 ' HA ' ' O ' ' A' ' 26' ' ' VAL . 4.3 mp0 -86.65 108.48 18.65 Favored 'General case' 0 N--CA 1.445 -0.714 0 CA-C-O 121.3 0.571 . . . . 0.0 110.828 179.9 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 28.7 mm -98.59 141.28 16.61 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.212 0 N-CA-C 109.365 -0.606 . . . . 0.0 109.365 179.582 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 11.4 m170 -120.02 129.31 54.2 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 -179.898 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.519 ' HZ ' HG23 ' A' ' 26' ' ' VAL . 1.7 p90 -147.17 162.56 38.62 Favored 'General case' 0 C--N 1.313 -0.984 0 CA-C-O 121.351 0.596 . . . . 0.0 111.625 -177.676 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 19.2 ptpt -118.69 127.61 53.73 Favored 'General case' 0 N--CA 1.445 -0.704 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.853 179.41 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.423 HG21 HD12 ' A' ' 47' ' ' LEU . 34.6 m -142.17 162.34 19.46 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 178.098 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.583 ' O ' HG22 ' A' ' 42' ' ' THR . 70.9 tttt -94.46 166.56 12.0 Favored 'General case' 0 C--N 1.305 -1.33 0 O-C-N 121.587 -0.695 . . . . 0.0 110.649 -179.426 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -76.1 -35.06 59.48 Favored 'General case' 0 C--N 1.328 -0.362 0 O-C-N 121.914 -0.491 . . . . 0.0 111.923 -177.436 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 15.1 t -90.05 16.91 7.52 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 120.996 0.426 . . . . 0.0 111.606 -177.961 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . 0.583 HG22 ' O ' ' A' ' 39' ' ' LYS . 2.0 t -106.86 170.63 7.83 Favored 'General case' 0 C--N 1.321 -0.67 0 O-C-N 121.938 -0.476 . . . . 0.0 110.174 -178.624 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 44.3 m170 -85.41 147.35 26.54 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.557 0.694 . . . . 0.0 111.522 -179.75 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.58 HD13 ' HB3' ' A' ' 47' ' ' LEU . 0.2 OUTLIER -73.77 -13.26 60.92 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.309 -179.345 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.734 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -55.75 -43.37 76.6 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.986 -178.966 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 12.0 ptmt -68.34 -29.15 67.81 Favored 'General case' 0 C--O 1.213 -0.861 0 CA-C-O 121.127 0.489 . . . . 0.0 110.596 -178.929 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.58 ' HB3' HD13 ' A' ' 44' ' ' LEU . 9.1 tt -73.23 -49.03 30.1 Favored 'General case' 0 C--N 1.305 -1.357 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.153 -179.866 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.535 ' HA ' ' CD2' ' A' ' 51' ' ' TYR . 7.7 ptmm? -63.65 -41.63 98.2 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.726 -177.563 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.734 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 8.4 pt-20 -69.71 -33.76 72.95 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 121.0 0.428 . . . . 0.0 110.426 176.992 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 4.7 m -67.83 -41.76 82.49 Favored 'General case' 0 C--O 1.236 0.354 0 N-CA-C 112.512 0.56 . . . . 0.0 112.512 -178.312 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.535 ' CD2' ' HA ' ' A' ' 48' ' ' LYS . 2.7 p90 -76.78 -32.38 57.65 Favored 'General case' 0 N--CA 1.444 -0.734 0 C-N-CA 119.436 -0.905 . . . . 0.0 110.229 -179.096 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . 0.567 ' SG ' HD11 ' A' ' 62' ' ' LEU . 98.6 m -62.34 -45.08 94.8 Favored 'General case' 0 CA--C 1.51 -0.559 0 CA-C-O 120.967 0.413 . . . . 0.0 110.646 178.857 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 10.6 pt20 -66.36 -34.67 78.48 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.159 -179.727 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.433 ' HA ' ' NE ' ' A' ' 54' ' ' ARG . 3.9 mmp_? -59.23 -39.56 83.11 Favored 'General case' 0 CA--C 1.514 -0.432 0 CA-C-O 121.023 0.44 . . . . 0.0 111.329 177.707 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.414 HE21 ' HB2' ' A' ' 55' ' ' GLN . 3.3 mt-30 -77.46 -21.28 53.17 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-O 121.137 0.494 . . . . 0.0 110.715 179.371 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 82.75 30.85 31.22 Favored Glycine 0 N--CA 1.444 -0.813 0 C-N-CA 120.937 -0.649 . . . . 0.0 112.217 179.25 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 35.6 m -133.65 148.31 68.06 Favored Pre-proline 0 C--N 1.326 -0.439 0 O-C-N 122.42 -0.459 . . . . 0.0 110.803 -179.045 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . 0.57 ' HG2' ' OG ' ' A' ' 61' ' ' SER . 18.0 Cg_endo -62.45 153.43 71.05 Favored 'Trans proline' 0 N--CA 1.461 -0.422 0 C-N-CA 122.585 2.19 . . . . 0.0 111.866 177.205 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.469 ' HG2' ' SG ' ' A' ' 52' ' ' CYS . 74.1 mtp -72.69 -8.72 56.76 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.134 0.493 . . . . 0.0 111.529 -176.356 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.9 p-10 -91.63 -8.75 46.32 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-O 121.268 0.556 . . . . 0.0 110.561 179.551 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.57 ' OG ' ' HG2' ' A' ' 58' ' ' PRO . 75.6 m -87.25 -18.03 31.2 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-O 121.095 0.474 . . . . 0.0 111.862 -179.742 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.567 HD11 ' SG ' ' A' ' 52' ' ' CYS . 1.3 pp -131.19 169.69 15.59 Favored 'General case' 0 C--N 1.31 -1.114 0 N-CA-C 113.067 0.765 . . . . 0.0 113.067 -176.999 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.435 ' O ' ' HA ' ' A' ' 90' ' ' VAL . 35.8 mtm180 -119.72 121.15 38.56 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.416 -177.748 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.415 ' HB3' ' OH ' ' A' ' 51' ' ' TYR . 0.2 OUTLIER -105.1 117.96 35.33 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-O 121.206 0.527 . . . . 0.0 111.462 179.475 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.445 ' C ' HD22 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -147.85 164.42 33.74 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 121.208 0.528 . . . . 0.0 110.471 179.606 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 77.9 t80 -144.69 135.84 25.14 Favored 'General case' 0 C--N 1.313 -0.994 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 178.134 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.477 ' HG2' HE21 ' A' ' 69' ' ' GLN . 7.3 pt-20 50.88 26.37 2.61 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 124.117 0.967 . . . . 0.0 112.327 -179.899 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 85.04 23.27 49.73 Favored Glycine 0 N--CA 1.445 -0.726 0 C-N-CA 120.871 -0.68 . . . . 0.0 112.902 -179.38 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . 0.477 HE21 ' HG2' ' A' ' 67' ' ' GLU . 2.8 pt20 -129.92 134.39 47.45 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 178.953 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 10.8 ptt180 -65.56 148.68 51.34 Favored 'General case' 0 C--N 1.31 -1.136 0 CA-C-O 121.586 0.708 . . . . 0.0 111.113 177.824 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.474 HG21 HD12 ' A' ' 44' ' ' LEU . 21.0 mm -98.92 115.56 39.73 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.301 0 N-CA-C 109.629 -0.508 . . . . 0.0 109.629 177.724 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -96.34 165.99 11.93 Favored 'General case' 0 N--CA 1.437 -1.091 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 -179.237 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . 0.428 ' CA ' ' HB3' ' A' ' 45' ' ' LYS . 37.1 m-20 -69.32 -25.44 64.22 Favored 'General case' 0 C--N 1.31 -1.124 0 CA-C-O 121.518 0.675 . . . . 0.0 110.982 -178.268 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 8.5 m-80 -96.5 4.66 51.93 Favored 'General case' 0 C--N 1.311 -1.076 0 CA-C-O 121.491 0.662 . . . . 0.0 109.708 -178.026 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . 0.546 ' O ' ' HB2' ' A' ' 44' ' ' LEU . 4.5 m170 -83.77 144.75 29.11 Favored 'General case' 0 CA--C 1.503 -0.855 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 178.849 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.523 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 77.6 p -117.85 155.29 51.06 Favored Pre-proline 0 C--N 1.302 -1.499 0 N-CA-C 110.276 -0.268 . . . . 0.0 110.276 178.516 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -67.49 -30.57 35.63 Favored 'Trans proline' 0 N--CA 1.454 -0.822 0 C-N-CA 121.95 1.767 . . . . 0.0 111.043 -179.896 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . 0.466 ' HG3' ' N ' ' A' ' 79' ' ' GLU . 33.2 pttt -70.73 -38.47 73.57 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.952 0.406 . . . . 0.0 110.551 179.59 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . 0.466 ' N ' ' HG3' ' A' ' 78' ' ' LYS . 5.0 mm-40 -74.14 -37.64 64.0 Favored 'General case' 0 N--CA 1.447 -0.623 0 CA-C-O 121.015 0.436 . . . . 0.0 111.269 -179.572 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.523 ' HG ' ' O ' ' A' ' 76' ' ' THR . 5.9 mt -77.29 -5.04 47.96 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.278 0.561 . . . . 0.0 110.872 -179.862 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 78.34 42.96 13.7 Favored Glycine 0 C--O 1.227 -0.34 0 C-N-CA 121.129 -0.558 . . . . 0.0 113.217 176.733 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 61.4 mtt -101.65 165.68 11.1 Favored 'General case' 0 C--N 1.315 -0.932 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 179.51 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -142.6 -170.72 3.27 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 110.073 -0.343 . . . . 0.0 110.073 177.104 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.518 ' HA ' ' HB ' ' A' ' 22' ' ' ILE . 14.4 pt-20 -68.7 135.94 52.11 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.97 0.414 . . . . 0.0 111.003 -179.421 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 79.07 4.41 2.33 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 124.361 1.064 . . . . 0.0 111.158 177.574 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 17.6 t0 -60.64 159.26 11.02 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-O 121.422 0.629 . . . . 0.0 110.982 178.515 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . 0.429 ' HA ' ' O ' ' A' ' 25' ' ' LYS . 7.4 p -127.05 141.48 46.14 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.243 0 CA-C-O 121.386 0.612 . . . . 0.0 111.417 -177.387 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 3.6 mp -111.33 155.91 12.61 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.743 0 CA-C-N 116.203 -0.453 . . . . 0.0 109.82 -179.379 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 6.3 tp10 -105.34 135.3 46.97 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.929 0.395 . . . . 0.0 110.227 -177.25 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . 0.435 ' HA ' ' O ' ' A' ' 63' ' ' ARG . 60.4 t -128.87 134.75 63.72 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.912 0 CA-C-O 121.119 0.485 . . . . 0.0 110.809 178.148 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 87.9 m-85 -119.05 173.9 6.63 Favored 'General case' 0 C--N 1.32 -0.713 0 N-CA-C 108.947 -0.761 . . . . 0.0 108.947 178.115 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 7.1 tp60 -102.44 146.85 27.5 Favored 'General case' 0 C--N 1.314 -0.947 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 178.633 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 23.0 pt-20 . . . . . 0 C--N 1.328 -0.362 0 CA-C-O 121.165 0.507 . . . . 0.0 111.191 176.267 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 24.5 pt . . . . . 0 N--CA 1.442 -0.837 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 1.8 mppt? -118.44 142.84 47.16 Favored 'General case' 0 C--N 1.296 -1.74 0 N-CA-C 109.017 -0.735 . . . . 0.0 109.017 -179.508 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.5 mp -135.3 162.83 31.46 Favored 'General case' 0 C--N 1.301 -1.508 0 CA-C-O 121.197 0.523 . . . . 0.0 110.572 176.67 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.428 ' O ' ' HA ' ' A' ' 87' ' ' VAL . 5.3 tmmm? -132.5 142.55 49.26 Favored 'General case' 0 N--CA 1.434 -1.274 0 CA-C-O 121.436 0.636 . . . . 0.0 110.775 -178.775 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.515 HG11 ' CD1' ' A' ' 51' ' ' TYR . 0.9 OUTLIER -115.98 141.89 31.57 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.324 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.036 -179.954 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.43 ' O ' ' HB ' ' A' ' 90' ' ' VAL . 48.3 mm -104.6 118.27 51.62 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.109 0 N-CA-C 107.425 -1.324 . . . . 0.0 107.425 174.626 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . 0.472 ' HA2' ' HB ' ' A' ' 90' ' ' VAL . . . -91.53 162.22 27.86 Favored Glycine 0 N--CA 1.423 -2.215 0 C-N-CA 120.145 -1.026 . . . . 0.0 111.32 -177.064 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.83 -24.45 62.01 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-O 121.531 0.681 . . . . 0.0 111.351 177.701 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 36.4 t70 -89.1 9.1 26.65 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-O 121.401 0.62 . . . . 0.0 110.177 178.598 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 8.6 t 70.06 16.7 7.48 Favored 'General case' 0 C--N 1.342 0.279 0 CA-C-O 122.177 0.989 . . . . 0.0 109.301 -177.458 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 5.0 t -77.13 111.56 12.86 Favored 'General case' 0 N--CA 1.444 -0.754 0 CA-C-N 114.997 -1.001 . . . . 0.0 110.195 -179.821 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.419 ' HA ' ' O ' ' A' ' 26' ' ' VAL . 41.3 mt-10 -87.15 112.08 21.59 Favored 'General case' 0 CA--C 1.507 -0.705 0 N-CA-C 109.803 -0.443 . . . . 0.0 109.803 177.861 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.416 HG21 ' HA ' ' A' ' 51' ' ' TYR . 32.1 mm -101.6 136.86 31.54 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.659 0 N-CA-C 109.489 -0.56 . . . . 0.0 109.489 179.681 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . 0.407 ' NE2' ' HG3' ' A' ' 25' ' ' LYS . 11.7 m170 -117.28 134.71 54.49 Favored 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 179.397 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.485 ' HZ ' HG23 ' A' ' 26' ' ' VAL . 1.0 OUTLIER -147.13 159.47 43.58 Favored 'General case' 0 C--N 1.309 -1.184 0 CA-C-O 121.22 0.533 . . . . 0.0 111.332 -177.765 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -116.41 117.21 29.32 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.743 -178.712 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 32.6 m -137.74 158.39 33.83 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 N-CA-C 109.884 -0.413 . . . . 0.0 109.884 179.787 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 24.2 mtpp -81.85 175.92 10.02 Favored 'General case' 0 CA--C 1.503 -0.837 0 CA-C-O 121.497 0.665 . . . . 0.0 111.205 178.382 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -83.05 -32.39 26.86 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-N 115.712 -0.676 . . . . 0.0 111.118 178.843 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 14.8 t -97.13 15.21 23.25 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.03 0.443 . . . . 0.0 112.002 -177.351 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 4.2 t -98.71 163.99 12.41 Favored 'General case' 0 C--N 1.316 -0.852 0 O-C-N 121.87 -0.518 . . . . 0.0 110.052 -178.908 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 27.6 m170 -77.34 142.68 39.24 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.458 0.647 . . . . 0.0 111.421 179.114 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.605 ' O ' ' HG3' ' A' ' 48' ' ' LYS . 0.2 OUTLIER -70.81 -15.96 62.7 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 115.391 -0.822 . . . . 0.0 109.41 -179.878 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.659 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -55.22 -45.43 75.96 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.868 -0.605 . . . . 0.0 112.576 -177.506 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 21.9 ptmt -66.46 -28.99 69.02 Favored 'General case' 0 C--O 1.22 -0.494 0 CA-C-O 121.283 0.563 . . . . 0.0 110.407 -178.699 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.576 ' HB3' HD13 ' A' ' 44' ' ' LEU . 8.1 tt -70.16 -47.72 60.41 Favored 'General case' 0 C--N 1.312 -1.052 0 CA-C-N 115.721 -0.672 . . . . 0.0 109.668 178.726 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.605 ' HG3' ' O ' ' A' ' 44' ' ' LEU . 20.9 mtpt -57.31 -48.12 79.77 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-O 121.512 0.673 . . . . 0.0 110.434 -179.329 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.659 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 6.3 pt-20 -71.61 -32.63 68.21 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.859 -178.386 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . 0.443 ' O ' ' HG2' ' A' ' 53' ' ' GLN . 28.5 t -63.87 -46.44 84.92 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-O 121.173 0.511 . . . . 0.0 110.944 -179.687 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.515 ' CD1' HG11 ' A' ' 26' ' ' VAL . 1.9 p90 -76.46 -32.55 58.46 Favored 'General case' 0 N--CA 1.44 -0.931 0 C-N-CA 119.976 -0.689 . . . . 0.0 110.564 -177.783 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . 0.537 ' SG ' HD11 ' A' ' 62' ' ' LEU . 74.7 m -63.63 -43.37 97.03 Favored 'General case' 0 CA--C 1.511 -0.537 0 CA-C-O 121.159 0.504 . . . . 0.0 110.704 179.226 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . 0.443 ' HG2' ' O ' ' A' ' 50' ' ' SER . 13.7 pt20 -67.5 -34.77 77.82 Favored 'General case' 0 N--CA 1.443 -0.786 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.271 -179.875 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.512 ' HA ' ' NE ' ' A' ' 54' ' ' ARG . 4.0 mmp_? -58.08 -38.53 76.55 Favored 'General case' 0 C--N 1.347 0.47 0 CA-C-O 121.075 0.464 . . . . 0.0 111.444 177.496 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.43 HE21 ' HB2' ' A' ' 55' ' ' GLN . 3.0 mt-30 -79.91 -21.13 44.3 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 121.218 0.533 . . . . 0.0 110.956 179.519 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 83.64 29.31 32.81 Favored Glycine 0 N--CA 1.448 -0.553 0 C-N-CA 121.005 -0.617 . . . . 0.0 112.24 178.313 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 28.8 m -130.62 151.59 78.98 Favored Pre-proline 0 C--N 1.323 -0.56 0 O-C-N 122.238 -0.566 . . . . 0.0 111.074 -177.824 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . 0.556 ' HG2' ' OG ' ' A' ' 61' ' ' SER . 19.2 Cg_endo -64.5 155.11 68.16 Favored 'Trans proline' 0 N--CA 1.455 -0.773 0 C-N-CA 122.301 2.001 . . . . 0.0 111.481 176.405 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.404 ' HG2' ' SG ' ' A' ' 52' ' ' CYS . 82.4 mtp -74.69 -8.77 57.41 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-O 121.146 0.498 . . . . 0.0 111.458 -176.101 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 29.9 p30 -91.58 -10.43 40.56 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 121.328 0.585 . . . . 0.0 110.749 -179.445 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.556 ' OG ' ' HG2' ' A' ' 58' ' ' PRO . 71.4 m -83.47 -24.8 31.64 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 121.175 0.512 . . . . 0.0 111.649 -179.106 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.537 HD11 ' SG ' ' A' ' 52' ' ' CYS . 1.4 pp -124.99 170.14 11.43 Favored 'General case' 0 C--N 1.302 -1.473 0 N-CA-C 112.685 0.624 . . . . 0.0 112.685 -175.629 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.532 ' O ' ' HA ' ' A' ' 90' ' ' VAL . 42.2 mtm180 -119.14 120.02 35.89 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.811 -0.632 . . . . 0.0 110.66 -178.223 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -102.61 114.76 29.25 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-O 121.124 0.488 . . . . 0.0 110.993 178.264 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.446 ' C ' HD22 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -143.72 162.91 34.77 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-O 121.39 0.614 . . . . 0.0 111.059 -179.854 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 85.9 t80 -144.61 134.15 23.35 Favored 'General case' 0 C--N 1.31 -1.137 0 CA-C-N 116.01 -0.541 . . . . 0.0 109.614 179.168 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.465 ' HG2' HE21 ' A' ' 69' ' ' GLN . 7.0 pt-20 49.31 26.85 1.69 Allowed 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 124.282 1.033 . . . . 0.0 112.562 179.964 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 87.25 22.81 42.99 Favored Glycine 0 N--CA 1.446 -0.653 0 C-N-CA 121.049 -0.596 . . . . 0.0 113.471 -179.683 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . 0.465 HE21 ' HG2' ' A' ' 67' ' ' GLU . 3.4 pt20 -130.06 138.2 50.62 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 179.198 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -72.34 146.75 46.89 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-O 121.28 0.562 . . . . 0.0 110.031 178.065 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.482 HG21 HD12 ' A' ' 44' ' ' LEU . 23.6 mm -94.94 122.27 46.24 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.255 0 CA-C-O 121.174 0.511 . . . . 0.0 110.546 -179.016 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -96.67 160.75 14.21 Favored 'General case' 0 N--CA 1.44 -0.949 0 N-CA-C 109.468 -0.567 . . . . 0.0 109.468 179.561 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . 0.452 ' CA ' ' HB3' ' A' ' 45' ' ' LYS . 11.6 p-10 -68.94 -21.9 64.17 Favored 'General case' 0 C--N 1.311 -1.08 0 CA-C-O 121.377 0.608 . . . . 0.0 111.04 -179.323 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 4.9 m-80 -96.8 1.86 51.23 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-O 121.209 0.528 . . . . 0.0 109.63 -179.721 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . 0.568 ' O ' ' HB2' ' A' ' 44' ' ' LEU . 2.8 m170 -81.29 146.32 30.46 Favored 'General case' 0 CA--C 1.501 -0.915 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 -179.234 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.48 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 72.7 p -118.48 153.83 52.08 Favored Pre-proline 0 C--N 1.302 -1.465 0 C-N-CA 121.038 -0.265 . . . . 0.0 110.699 178.383 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 22.1 Cg_endo -62.1 -37.92 60.21 Favored 'Trans proline' 0 N--CA 1.455 -0.783 0 C-N-CA 122.197 1.931 . . . . 0.0 111.395 -179.387 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . 0.536 ' HG3' ' N ' ' A' ' 79' ' ' GLU . 36.2 pttt -66.11 -41.52 90.46 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.917 0.389 . . . . 0.0 110.797 -179.652 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . 0.536 ' N ' ' HG3' ' A' ' 78' ' ' LYS . 49.7 mm-40 -70.33 -35.9 73.92 Favored 'General case' 0 CA--C 1.515 -0.398 0 CA-C-O 121.023 0.44 . . . . 0.0 111.305 -178.63 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.51 HD21 ' CG ' ' A' ' 75' ' ' HIS . 5.2 mt -78.15 -8.02 57.77 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 120.514 -0.474 . . . . 0.0 110.712 179.843 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 84.07 38.98 9.61 Favored Glycine 0 C--N 1.321 -0.265 0 C-N-CA 120.965 -0.636 . . . . 0.0 112.777 177.905 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 61.6 mtt -100.87 162.34 12.97 Favored 'General case' 0 C--N 1.314 -0.946 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 179.193 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . 0.452 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 4.9 pt-20 -143.4 -171.83 3.58 Favored 'General case' 0 C--N 1.306 -1.303 0 N-CA-C 109.914 -0.402 . . . . 0.0 109.914 179.953 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -69.85 136.59 50.89 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.103 0.478 . . . . 0.0 111.235 -178.777 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 75.55 5.21 4.04 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.712 1.205 . . . . 0.0 111.285 179.306 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . 0.452 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 1.9 t0 -62.78 162.48 10.85 Favored 'General case' 0 C--O 1.238 0.495 0 CA-C-O 121.347 0.594 . . . . 0.0 111.065 177.719 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . 0.428 ' HA ' ' O ' ' A' ' 25' ' ' LYS . 11.4 p -128.51 144.07 39.09 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.911 0 CA-C-O 121.383 0.611 . . . . 0.0 111.734 -176.82 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 3.6 mp -115.5 153.66 17.02 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.758 0 N-CA-C 108.728 -0.842 . . . . 0.0 108.728 178.518 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -107.85 139.44 42.44 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 121.195 0.521 . . . . 0.0 110.915 -176.836 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . 0.532 ' HA ' ' O ' ' A' ' 63' ' ' ARG . 63.3 t -128.77 133.47 66.25 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.023 0 CA-C-O 121.412 0.625 . . . . 0.0 110.949 179.844 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 86.7 m-85 -118.63 179.67 4.06 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-N 115.972 -0.558 . . . . 0.0 109.79 179.183 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 7.5 tp60 -109.47 131.84 54.69 Favored 'General case' 0 C--N 1.316 -0.871 0 O-C-N 122.267 -0.271 . . . . 0.0 110.763 179.207 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' GLU . . . . . 0.418 ' OE1' ' HG2' ' A' ' 63' ' ' ARG . 7.4 pt-20 . . . . . 0 CA--C 1.533 0.316 0 CA-C-O 120.753 0.311 . . . . 0.0 110.691 177.899 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . 0.499 ' HB ' ' HA ' ' A' ' 84' ' ' GLU . 25.9 pt . . . . . 0 N--CA 1.441 -0.921 0 CA-C-O 121.465 0.65 . . . . 0.0 109.79 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.507 ' HE3' ' HG3' ' A' ' 85' ' ' GLU . 0.0 OUTLIER -117.43 149.03 41.24 Favored 'General case' 0 C--N 1.293 -1.872 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 -179.156 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -142.04 158.41 43.79 Favored 'General case' 0 C--N 1.3 -1.581 0 CA-C-O 121.406 0.622 . . . . 0.0 111.477 175.201 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 5.3 tmmm? -128.73 141.97 51.15 Favored 'General case' 0 N--CA 1.436 -1.158 0 CA-C-N 115.604 -0.725 . . . . 0.0 110.225 179.945 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.542 ' O ' ' HA ' ' A' ' 33' ' ' GLU . 0.9 OUTLIER -112.92 142.35 25.59 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.442 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.293 -179.372 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.464 ' O ' ' HB ' ' A' ' 90' ' ' VAL . 44.6 mm -103.92 115.22 45.45 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.359 0 N-CA-C 106.83 -1.544 . . . . 0.0 106.83 173.562 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . 0.439 ' HA2' ' HB ' ' A' ' 90' ' ' VAL . . . -86.26 161.64 34.41 Favored Glycine 0 N--CA 1.422 -2.256 0 C-N-CA 120.022 -1.085 . . . . 0.0 111.185 -175.971 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.17 -24.08 62.77 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-O 121.417 0.627 . . . . 0.0 111.081 176.556 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -96.9 20.1 11.63 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 121.504 0.669 . . . . 0.0 109.658 178.774 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 43.2 m 64.28 17.61 10.83 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-O 121.84 0.829 . . . . 0.0 110.53 -179.101 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 10.6 t -76.8 108.78 10.06 Favored 'General case' 0 N--CA 1.444 -0.734 0 CA-C-N 115.152 -0.931 . . . . 0.0 110.222 -179.372 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.542 ' HA ' ' O ' ' A' ' 26' ' ' VAL . 41.9 mt-10 -87.15 109.79 19.69 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 121.363 0.602 . . . . 0.0 109.943 178.38 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 33.5 mm -100.9 139.11 23.02 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.431 0 CA-C-N 116.037 -0.529 . . . . 0.0 109.596 -178.756 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 12.2 m170 -117.34 132.4 56.6 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 109.395 -0.595 . . . . 0.0 109.395 179.851 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.518 ' HZ ' HG23 ' A' ' 26' ' ' VAL . 1.3 p90 -147.61 163.9 35.16 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-O 121.216 0.532 . . . . 0.0 111.603 -178.668 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 88.1 mttt -119.66 119.47 33.8 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.66 -179.123 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.444 HG21 HD12 ' A' ' 47' ' ' LEU . 35.7 m -138.81 157.93 29.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-O 120.911 0.386 . . . . 0.0 110.276 178.904 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 47.5 mtpt -83.12 178.14 8.25 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-O 121.45 0.643 . . . . 0.0 111.426 179.073 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -87.26 -31.17 20.4 Favored 'General case' 0 C--N 1.313 -1.01 0 CA-C-O 121.371 0.605 . . . . 0.0 110.144 178.04 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 9.0 t -98.78 19.71 14.36 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.312 -177.268 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 10.0 t -105.54 176.01 5.31 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 178.678 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 53.0 m170 -91.76 147.34 23.06 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-O 121.432 0.634 . . . . 0.0 111.387 -179.426 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.613 ' HB2' ' O ' ' A' ' 75' ' ' HIS . 0.2 OUTLIER -74.58 -12.61 60.5 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 115.53 -0.759 . . . . 0.0 109.226 179.113 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.76 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -57.15 -45.11 83.88 Favored 'General case' 0 N--CA 1.442 -0.825 0 CA-C-N 115.563 -0.744 . . . . 0.0 111.899 -178.55 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.425 ' HG3' ' N ' ' A' ' 47' ' ' LEU . 19.4 ptpt -65.85 -32.1 73.43 Favored 'General case' 0 CA--C 1.508 -0.651 0 CA-C-O 121.695 0.759 . . . . 0.0 109.883 -178.888 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.536 ' HB3' HD13 ' A' ' 44' ' ' LEU . 8.2 tt -71.05 -51.55 24.65 Favored 'General case' 0 N--CA 1.428 -1.553 0 CA-C-N 115.197 -0.911 . . . . 0.0 110.738 -176.724 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.463 ' HA ' ' CD2' ' A' ' 51' ' ' TYR . 6.4 ptmm? -61.19 -41.01 96.04 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.721 -178.017 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.76 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 8.8 pt-20 -72.46 -30.92 65.0 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-O 121.029 0.443 . . . . 0.0 110.703 178.012 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . 0.579 ' O ' ' HG2' ' A' ' 54' ' ' ARG . 32.7 t -68.71 -44.73 73.31 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.945 0.402 . . . . 0.0 111.677 -178.632 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.468 ' CD1' HG11 ' A' ' 26' ' ' VAL . 2.3 p90 -75.06 -32.82 61.61 Favored 'General case' 0 N--CA 1.446 -0.657 0 C-N-CA 119.512 -0.875 . . . . 0.0 110.176 -178.09 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . 0.524 ' SG ' HD11 ' A' ' 62' ' ' LEU . 83.5 m -59.8 -43.94 94.2 Favored 'General case' 0 C--O 1.238 0.454 0 CA-C-O 120.938 0.399 . . . . 0.0 110.703 177.985 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 11.9 pt20 -69.94 -33.69 72.47 Favored 'General case' 0 N--CA 1.447 -0.622 0 C-N-CA 120.769 -0.373 . . . . 0.0 110.617 -179.213 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.579 ' HG2' ' O ' ' A' ' 50' ' ' SER . 9.3 mmp_? -54.78 -40.99 69.99 Favored 'General case' 0 C--N 1.351 0.634 0 CA-C-O 121.403 0.62 . . . . 0.0 110.607 176.192 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.417 HE21 ' HB2' ' A' ' 55' ' ' GLN . 2.9 mt-30 -78.45 -21.48 49.05 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.747 179.6 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 81.74 27.48 46.4 Favored Glycine 0 N--CA 1.443 -0.887 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.223 179.276 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 33.9 m -127.18 148.1 64.62 Favored Pre-proline 0 C--N 1.321 -0.666 0 O-C-N 122.505 -0.409 . . . . 0.0 110.283 -179.145 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . 0.471 ' HG2' ' OG ' ' A' ' 61' ' ' SER . 26.0 Cg_endo -64.87 150.52 88.01 Favored 'Trans proline' 0 N--CA 1.457 -0.647 0 C-N-CA 122.278 1.985 . . . . 0.0 111.999 178.632 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.415 ' HG2' ' SG ' ' A' ' 52' ' ' CYS . 66.2 mtp -69.06 -9.11 50.97 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.231 0.538 . . . . 0.0 111.721 -176.905 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 28.8 p30 -88.82 -12.88 40.72 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-O 121.214 0.53 . . . . 0.0 111.33 -178.751 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.471 ' OG ' ' HG2' ' A' ' 58' ' ' PRO . 55.6 m -88.06 -19.08 27.59 Favored 'General case' 0 C--N 1.316 -0.878 0 N-CA-C 112.654 0.613 . . . . 0.0 112.654 -177.738 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.524 HD11 ' SG ' ' A' ' 52' ' ' CYS . 1.5 pp -132.4 159.96 37.74 Favored 'General case' 0 C--N 1.315 -0.934 0 N-CA-C 113.413 0.894 . . . . 0.0 113.413 -177.386 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.484 ' O ' ' HA ' ' A' ' 90' ' ' VAL . 50.0 mtm-85 -107.86 124.87 50.73 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 114.903 -1.044 . . . . 0.0 111.741 -177.997 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -106.09 117.26 33.56 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.545 178.329 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.472 ' C ' HD22 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -143.01 160.85 39.57 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-O 121.362 0.601 . . . . 0.0 111.161 179.951 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 90.7 t80 -141.35 134.26 28.96 Favored 'General case' 0 C--N 1.31 -1.118 0 N-CA-C 109.033 -0.729 . . . . 0.0 109.033 178.775 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.478 ' HG2' HE21 ' A' ' 69' ' ' GLN . 6.4 pt-20 50.04 26.75 2.19 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 124.124 0.97 . . . . 0.0 112.33 -179.16 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 85.02 25.03 42.22 Favored Glycine 0 N--CA 1.447 -0.627 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.948 -178.833 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . 0.478 HE21 ' HG2' ' A' ' 67' ' ' GLU . 3.3 pt20 -130.86 136.71 48.9 Favored 'General case' 0 C--N 1.322 -0.619 0 O-C-N 122.074 -0.663 . . . . 0.0 109.888 179.279 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.435 ' HD3' ' N ' ' A' ' 70' ' ' ARG . 0.0 OUTLIER -66.72 146.88 53.98 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-O 121.336 0.588 . . . . 0.0 110.557 178.067 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.483 HG21 HD12 ' A' ' 44' ' ' LEU . 20.9 mm -101.45 118.05 47.64 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.133 0 CA-C-O 120.89 0.376 . . . . 0.0 110.264 -179.535 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -99.65 167.34 10.63 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-O 120.882 0.373 . . . . 0.0 110.365 -179.517 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . 0.506 ' CA ' ' HB3' ' A' ' 45' ' ' LYS . 7.8 p-10 -67.92 -22.1 65.09 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-O 121.194 0.521 . . . . 0.0 111.391 -179.618 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 8.0 m-80 -98.56 1.09 46.15 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-O 121.338 0.589 . . . . 0.0 110.076 -178.324 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . 0.613 ' O ' ' HB2' ' A' ' 44' ' ' LEU . 2.1 m170 -80.8 142.71 33.46 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 -179.512 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.47 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 81.0 p -116.96 153.25 49.44 Favored Pre-proline 0 C--N 1.306 -1.302 0 CA-C-N 116.79 -0.186 . . . . 0.0 111.29 -179.949 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_exo -58.2 -39.68 82.89 Favored 'Trans proline' 0 C--N 1.347 0.484 0 C-N-CA 122.492 2.128 . . . . 0.0 111.586 178.809 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . 0.518 ' HG3' ' N ' ' A' ' 79' ' ' GLU . 32.7 pttt -67.39 -39.61 85.62 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.082 -178.379 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . 0.518 ' N ' ' HG3' ' A' ' 78' ' ' LYS . 45.9 mm-40 -73.31 -35.66 66.11 Favored 'General case' 0 CA--C 1.511 -0.553 0 CA-C-O 121.166 0.508 . . . . 0.0 110.936 -179.206 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.486 HD21 ' CG ' ' A' ' 75' ' ' HIS . 5.4 mt -81.1 -3.93 53.6 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.074 0.464 . . . . 0.0 110.96 -179.456 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 75.45 48.1 11.32 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.972 -0.632 . . . . 0.0 112.813 177.738 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 63.5 mtt -105.64 161.13 14.65 Favored 'General case' 0 C--N 1.315 -0.929 0 N-CA-C 110.023 -0.362 . . . . 0.0 110.023 178.83 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 14.2 pt-20 -143.04 -173.03 3.8 Favored 'General case' 0 C--N 1.317 -0.841 0 N-CA-C 109.917 -0.401 . . . . 0.0 109.917 179.134 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.499 ' HA ' ' HB ' ' A' ' 22' ' ' ILE . 11.6 pt-20 -68.33 126.46 29.66 Favored 'General case' 0 N--CA 1.447 -0.584 0 CA-C-O 121.466 0.65 . . . . 0.0 111.68 -179.188 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . 0.507 ' HG3' ' HE3' ' A' ' 23' ' ' LYS . 33.5 mt-10 77.54 8.39 2.66 Favored 'General case' 0 C--N 1.322 -0.625 0 C-N-CA 124.723 1.209 . . . . 0.0 112.738 177.19 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -63.42 167.15 5.69 Favored 'General case' 0 C--O 1.239 0.539 0 CA-C-O 121.082 0.468 . . . . 0.0 110.302 174.754 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 15.0 p -125.9 143.93 37.73 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.036 0 CA-C-O 121.516 0.674 . . . . 0.0 111.752 -176.153 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . 0.425 ' HB ' HG22 ' A' ' 26' ' ' VAL . 2.3 mt -111.86 152.96 13.63 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 N-CA-C 108.836 -0.801 . . . . 0.0 108.836 177.646 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . 0.404 ' O ' HD13 ' A' ' 65' ' ' LEU . 9.5 tp10 -106.64 137.44 44.65 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-O 120.924 0.392 . . . . 0.0 110.58 -177.38 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . 0.484 ' HA ' ' O ' ' A' ' 63' ' ' ARG . 90.2 t -129.02 133.4 66.08 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-O 121.317 0.58 . . . . 0.0 111.454 178.667 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 82.1 m-85 -118.92 178.41 4.5 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.375 179.429 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 9.5 tp60 -105.15 135.95 45.54 Favored 'General case' 0 C--N 1.31 -1.124 0 O-C-N 122.241 -0.287 . . . . 0.0 110.623 -179.281 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 . . . . . 0 C--N 1.33 -0.28 0 CA-C-O 121.262 0.553 . . . . 0.0 110.403 176.358 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . 0.4 ' HB ' ' HA ' ' A' ' 84' ' ' GLU . 24.0 pt . . . . . 0 N--CA 1.445 -0.678 0 N-CA-C 109.395 -0.594 . . . . 0.0 109.395 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 45.3 mtmt -115.75 142.54 46.61 Favored 'General case' 0 C--N 1.294 -1.827 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 -179.509 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.4 mp -136.21 162.59 32.55 Favored 'General case' 0 C--N 1.302 -1.473 0 CA-C-O 121.098 0.475 . . . . 0.0 110.445 175.257 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.45 ' HE2' ' HB3' ' A' ' 25' ' ' LYS . 5.3 tmmm? -133.62 143.59 48.72 Favored 'General case' 0 C--N 1.308 -1.211 0 CA-C-O 121.403 0.621 . . . . 0.0 110.592 -178.786 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.511 HG23 ' HZ ' ' A' ' 36' ' ' PHE . 0.9 OUTLIER -115.0 143.33 24.98 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.454 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.046 -179.896 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.421 ' O ' ' HB ' ' A' ' 90' ' ' VAL . 45.4 mm -107.61 116.57 51.42 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.022 0 N-CA-C 107.683 -1.228 . . . . 0.0 107.683 175.392 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . 0.453 ' HA2' ' HB ' ' A' ' 90' ' ' VAL . . . -84.65 175.44 50.68 Favored Glycine 0 N--CA 1.419 -2.488 0 C-N-CA 120.158 -1.02 . . . . 0.0 111.834 -177.312 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.57 -22.18 63.55 Favored 'General case' 0 C--N 1.302 -1.476 0 CA-C-O 121.626 0.727 . . . . 0.0 110.324 179.906 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -100.57 13.73 33.71 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.693 -0.685 . . . . 0.0 109.219 178.523 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 19.3 m 71.49 15.59 6.11 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 115.376 -0.829 . . . . 0.0 111.319 179.265 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 10.9 t -72.35 114.59 10.63 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 109.697 -0.482 . . . . 0.0 109.697 179.199 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.445 ' HA ' ' O ' ' A' ' 26' ' ' VAL . 34.5 mt-10 -87.55 108.62 19.14 Favored 'General case' 0 CA--C 1.509 -0.61 0 CA-C-O 121.164 0.507 . . . . 0.0 110.42 179.187 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.437 HG21 ' HA ' ' A' ' 51' ' ' TYR . 38.9 mm -97.88 137.69 24.76 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.589 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 179.206 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 12.4 m170 -115.97 136.56 52.92 Favored 'General case' 0 C--N 1.315 -0.918 0 N-CA-C 109.3 -0.63 . . . . 0.0 109.3 -179.045 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.511 ' HZ ' HG23 ' A' ' 26' ' ' VAL . 0.5 OUTLIER -147.28 155.66 42.24 Favored 'General case' 0 C--N 1.308 -1.196 0 CA-C-O 121.309 0.576 . . . . 0.0 111.275 -178.501 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 93.4 mttt -113.67 113.37 24.92 Favored 'General case' 0 C--N 1.31 -1.13 0 CA-C-N 115.723 -0.672 . . . . 0.0 109.999 -179.177 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.416 HG21 HD12 ' A' ' 47' ' ' LEU . 28.2 m -134.91 158.18 41.28 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.768 0 CA-C-O 120.87 0.367 . . . . 0.0 110.069 -179.792 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.533 ' O ' HG22 ' A' ' 42' ' ' THR . 80.8 tttt -90.33 165.13 14.05 Favored 'General case' 0 C--N 1.311 -1.066 0 O-C-N 121.822 -0.549 . . . . 0.0 110.683 -179.021 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -70.14 -37.02 75.16 Favored 'General case' 0 N--CA 1.463 0.224 0 O-C-N 121.969 -0.457 . . . . 0.0 111.854 -177.771 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 14.5 t -97.13 19.09 13.51 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-O 120.939 0.4 . . . . 0.0 111.93 -176.471 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . 0.533 HG22 ' O ' ' A' ' 39' ' ' LYS . 3.4 t -100.24 167.64 10.3 Favored 'General case' 0 C--N 1.323 -0.561 0 O-C-N 121.797 -0.564 . . . . 0.0 109.72 178.855 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 37.3 m170 -82.16 141.77 32.78 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 121.576 0.703 . . . . 0.0 111.459 179.903 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.645 HD13 ' HB3' ' A' ' 47' ' ' LEU . 0.2 OUTLIER -70.84 -13.88 62.2 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.459 -0.791 . . . . 0.0 109.731 -179.741 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.728 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -54.59 -43.65 72.34 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 115.787 -0.642 . . . . 0.0 112.009 -179.31 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.434 ' N ' ' HD3' ' A' ' 45' ' ' LYS . 21.9 ptmt -69.23 -28.4 66.31 Favored 'General case' 0 C--O 1.201 -1.451 0 CA-C-O 120.911 0.386 . . . . 0.0 110.462 -179.158 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.645 ' HB3' HD13 ' A' ' 44' ' ' LEU . 8.4 tt -74.36 -49.34 23.14 Favored 'General case' 0 C--N 1.302 -1.459 0 CA-C-O 120.994 0.426 . . . . 0.0 110.631 -178.855 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.453 ' HA ' ' CD2' ' A' ' 51' ' ' TYR . 6.8 ptmm? -62.6 -43.17 99.47 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.328 -0.397 . . . . 0.0 111.404 -177.555 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.728 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 8.1 pt-20 -70.8 -33.47 70.76 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-O 121.021 0.439 . . . . 0.0 110.626 178.139 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . 0.673 ' O ' ' HG2' ' A' ' 54' ' ' ARG . 10.5 m -67.81 -41.87 82.42 Favored 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 -178.122 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.505 ' CD1' HG11 ' A' ' 26' ' ' VAL . 3.4 p90 -76.68 -33.09 58.27 Favored 'General case' 0 C--N 1.32 -0.707 0 C-N-CA 119.129 -1.029 . . . . 0.0 110.392 -178.532 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . 0.593 ' SG ' HD11 ' A' ' 62' ' ' LEU . 90.6 m -62.42 -44.89 95.34 Favored 'General case' 0 CA--C 1.509 -0.625 0 CA-C-O 121.296 0.57 . . . . 0.0 110.465 179.419 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . 0.438 ' HG2' ' O ' ' A' ' 50' ' ' SER . 13.8 pt20 -67.23 -33.83 76.19 Favored 'General case' 0 N--CA 1.44 -0.953 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.743 -179.392 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.673 ' HG2' ' O ' ' A' ' 50' ' ' SER . 40.4 mmt180 -56.59 -44.4 81.04 Favored 'General case' 0 C--N 1.351 0.638 0 CA-C-O 121.368 0.604 . . . . 0.0 110.434 177.002 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.415 HE21 ' HB2' ' A' ' 55' ' ' GLN . 4.0 mt-30 -73.38 -20.82 60.66 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.736 -0.666 . . . . 0.0 111.462 -179.555 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 79.66 33.37 34.5 Favored Glycine 0 N--CA 1.448 -0.547 0 C-N-CA 120.675 -0.774 . . . . 0.0 111.765 -179.758 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 29.1 m -132.93 151.28 77.72 Favored Pre-proline 0 C--O 1.24 0.565 0 O-C-N 122.532 -0.393 . . . . 0.0 110.518 -179.298 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . 0.463 ' HG2' ' OG ' ' A' ' 61' ' ' SER . 40.9 Cg_endo -69.62 148.93 67.08 Favored 'Trans proline' 0 N--CA 1.459 -0.555 0 C-N-CA 122.506 2.138 . . . . 0.0 112.307 179.065 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.526 ' HG2' ' SG ' ' A' ' 52' ' ' CYS . 72.8 mtp -71.22 -11.28 60.84 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.602 -0.726 . . . . 0.0 111.637 -177.382 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 24.7 p30 -88.02 -12.2 45.09 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-O 121.311 0.577 . . . . 0.0 111.461 -179.191 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.463 ' OG ' ' HG2' ' A' ' 58' ' ' PRO . 66.4 m -90.49 -20.85 22.23 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-O 120.928 0.394 . . . . 0.0 111.951 -179.585 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.593 HD11 ' SG ' ' A' ' 52' ' ' CYS . 2.0 pp -123.32 164.99 17.75 Favored 'General case' 0 C--N 1.313 -0.986 0 N-CA-C 113.031 0.752 . . . . 0.0 113.031 -177.796 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.532 ' O ' ' HA ' ' A' ' 90' ' ' VAL . 5.8 mtp180 -114.47 123.13 48.64 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.538 -0.755 . . . . 0.0 110.585 -178.691 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.461 ' HB3' ' OH ' ' A' ' 51' ' ' TYR . 0.2 OUTLIER -104.27 113.48 27.06 Favored 'General case' 0 C--N 1.307 -1.278 0 CA-C-O 120.986 0.422 . . . . 0.0 110.145 176.53 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.446 ' C ' HD22 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -142.79 165.13 28.21 Favored 'General case' 0 N--CA 1.438 -1.068 0 CA-C-O 121.634 0.73 . . . . 0.0 111.88 -179.144 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 92.3 t80 -145.44 134.76 23.0 Favored 'General case' 0 C--N 1.305 -1.361 0 N-CA-C 108.542 -0.91 . . . . 0.0 108.542 178.537 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.448 ' HG2' HE21 ' A' ' 69' ' ' GLN . 5.3 pt-20 50.24 26.7 2.3 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 124.359 1.064 . . . . 0.0 112.204 -177.927 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 86.79 17.5 59.72 Favored Glycine 0 CA--C 1.519 0.287 0 C-N-CA 120.781 -0.723 . . . . 0.0 113.314 -178.803 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . 0.448 HE21 ' HG2' ' A' ' 67' ' ' GLU . 2.9 pt20 -124.39 134.65 53.06 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 -179.74 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -70.25 146.7 50.47 Favored 'General case' 0 C--N 1.312 -1.032 0 CA-C-O 121.376 0.608 . . . . 0.0 110.301 178.017 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.501 HG21 HD12 ' A' ' 44' ' ' LEU . 22.7 mm -94.36 122.76 46.11 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.55 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.283 -178.557 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -98.79 166.75 11.16 Favored 'General case' 0 N--CA 1.439 -0.978 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 -179.499 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -67.55 -26.0 66.09 Favored 'General case' 0 C--N 1.313 -1.001 0 CA-C-O 121.265 0.555 . . . . 0.0 111.259 -178.421 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 8.1 m-80 -97.23 4.99 50.79 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-O 121.327 0.584 . . . . 0.0 110.097 -177.799 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . 0.603 ' O ' ' HB2' ' A' ' 44' ' ' LEU . 2.5 m170 -83.68 145.94 28.51 Favored 'General case' 0 CA--C 1.507 -0.71 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 179.232 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.42 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 43.7 p -122.81 158.76 56.12 Favored Pre-proline 0 C--N 1.31 -1.119 0 C-N-CA 121.012 -0.275 . . . . 0.0 110.742 179.003 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_exo -60.81 -40.54 53.09 Favored 'Trans proline' 0 N--CA 1.457 -0.627 0 C-N-CA 122.538 2.159 . . . . 0.0 111.604 179.054 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . 0.521 ' HG3' ' N ' ' A' ' 79' ' ' GLU . 20.7 pttt -68.99 -36.75 78.18 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.947 0.404 . . . . 0.0 110.992 -177.935 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . 0.521 ' N ' ' HG3' ' A' ' 78' ' ' LYS . 52.5 mm-40 -69.84 -40.56 75.74 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-O 120.921 0.391 . . . . 0.0 110.636 -179.243 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.42 ' HG ' ' O ' ' A' ' 76' ' ' THR . 5.4 mt -79.74 -6.71 57.78 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.25 0.548 . . . . 0.0 110.864 -178.985 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 80.45 45.14 8.17 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.967 -0.635 . . . . 0.0 113.01 177.794 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 59.5 mtt -102.7 163.33 12.28 Favored 'General case' 0 C--N 1.317 -0.806 0 N-CA-C 109.755 -0.461 . . . . 0.0 109.755 178.388 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -136.93 -172.45 3.19 Favored 'General case' 0 C--N 1.312 -1.045 0 CA-C-O 120.884 0.373 . . . . 0.0 110.01 179.113 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.4 ' HA ' ' HB ' ' A' ' 22' ' ' ILE . 12.6 pt-20 -70.43 141.47 52.1 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 177.738 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 73.78 1.93 4.07 Favored 'General case' 0 CA--C 1.552 1.05 0 C-N-CA 123.826 0.851 . . . . 0.0 111.283 179.868 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -63.91 161.77 15.03 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-O 121.269 0.557 . . . . 0.0 110.97 179.123 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . 0.421 ' HA ' ' O ' ' A' ' 25' ' ' LYS . 8.6 p -127.64 142.88 42.43 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.079 0 CA-C-O 121.418 0.627 . . . . 0.0 111.505 -176.302 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 3.7 mp -112.57 152.93 14.27 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.855 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 178.667 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . 0.407 ' O ' HD13 ' A' ' 65' ' ' LEU . 7.2 tp10 -105.43 137.49 43.17 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-O 120.969 0.414 . . . . 0.0 110.484 -175.785 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . 0.532 ' HA ' ' O ' ' A' ' 63' ' ' ARG . 78.4 t -128.75 135.7 61.64 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.887 0 CA-C-O 121.259 0.552 . . . . 0.0 110.793 179.16 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 91.8 m-85 -122.71 177.84 5.28 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.201 179.155 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 9.6 tp60 -108.44 121.32 44.7 Favored 'General case' 0 C--N 1.312 -1.051 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 179.553 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' GLU . . . . . 0.466 ' HB3' ' CG ' ' A' ' 63' ' ' ARG . 9.3 pt-20 . . . . . 0 C--O 1.236 0.349 0 CA-C-O 121.022 0.439 . . . . 0.0 111.068 179.991 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . 0.418 HD13 ' HG2' ' A' ' 40' ' ' MET . 23.0 pt . . . . . 0 N--CA 1.444 -0.744 0 CA-C-O 121.39 0.614 . . . . 0.0 110.446 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.414 ' HE3' ' HB2' ' A' ' 23' ' ' LYS . 40.8 mtmt -119.11 142.07 48.23 Favored 'General case' 0 C--N 1.304 -1.406 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 -179.367 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.5 mp -136.04 164.11 28.77 Favored 'General case' 0 C--N 1.304 -1.411 0 CA-C-O 121.268 0.556 . . . . 0.0 110.811 176.097 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.42 ' HE2' ' HB3' ' A' ' 25' ' ' LYS . 5.6 tmmm? -136.45 145.06 44.79 Favored 'General case' 0 C--N 1.311 -1.107 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.448 -179.271 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.55 ' O ' ' HA ' ' A' ' 33' ' ' GLU . 0.9 OUTLIER -115.73 142.44 28.93 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.291 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.968 -179.768 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.434 ' CD1' ' HG2' ' A' ' 33' ' ' GLU . 45.4 mm -109.17 98.15 6.66 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.874 0 N-CA-C 108.498 -0.927 . . . . 0.0 108.498 175.884 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . 0.545 ' HA2' ' HB ' ' A' ' 90' ' ' VAL . . . -67.12 166.04 41.66 Favored Glycine 0 N--CA 1.436 -1.339 0 C-N-CA 120.45 -0.881 . . . . 0.0 112.764 178.321 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.43 -16.9 40.47 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 121.129 0.49 . . . . 0.0 112.311 179.209 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -102.76 18.1 22.25 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 121.487 0.66 . . . . 0.0 109.69 178.754 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 7.3 m 69.72 17.21 7.79 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.376 -179.134 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 12.8 t -73.46 108.48 6.35 Favored 'General case' 0 N--CA 1.444 -0.766 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.698 -178.458 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.55 ' HA ' ' O ' ' A' ' 26' ' ' VAL . 40.6 mt-10 -87.09 104.29 16.19 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-O 121.111 0.481 . . . . 0.0 110.479 178.287 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 40.2 mm -97.21 136.86 26.55 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.426 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 178.103 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 12.8 m170 -114.78 134.48 55.08 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 -178.148 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.524 ' HZ ' HG23 ' A' ' 26' ' ' VAL . 1.1 p90 -147.15 158.37 43.92 Favored 'General case' 0 C--N 1.309 -1.193 0 CA-C-O 121.397 0.618 . . . . 0.0 111.061 -178.919 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 7.3 ptpt -120.1 120.74 37.13 Favored 'General case' 0 C--N 1.307 -1.26 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.289 -178.913 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 33.4 m -139.87 162.0 25.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-O 121.352 0.596 . . . . 0.0 110.962 -178.514 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.58 ' O ' HG22 ' A' ' 42' ' ' THR . 19.1 mmmt -80.8 156.03 26.35 Favored 'General case' 0 C--N 1.312 -1.025 0 CA-C-O 121.027 0.442 . . . . 0.0 110.851 177.488 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . 0.443 ' O ' ' HG2' ' A' ' 78' ' ' LYS . 0.0 OUTLIER -70.55 -35.51 73.15 Favored 'General case' 0 CA--C 1.506 -0.746 0 CA-C-O 121.404 0.621 . . . . 0.0 109.903 177.521 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 12.9 t -91.98 18.48 7.85 Favored 'General case' 0 N--CA 1.438 -1.035 0 CA-C-N 115.724 -0.671 . . . . 0.0 112.284 -176.396 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . 0.58 HG22 ' O ' ' A' ' 39' ' ' LYS . 3.7 t -105.51 169.93 8.18 Favored 'General case' 0 C--N 1.323 -0.579 0 O-C-N 121.876 -0.515 . . . . 0.0 110.157 -179.705 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 40.2 m170 -81.65 141.65 33.46 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 121.561 0.696 . . . . 0.0 111.487 179.79 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.6 HD13 ' HB3' ' A' ' 47' ' ' LEU . 0.2 OUTLIER -70.96 -12.14 61.37 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 115.303 -0.862 . . . . 0.0 109.596 179.702 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.813 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -55.65 -50.24 70.75 Favored 'General case' 0 N--CA 1.441 -0.884 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.802 -179.186 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.521 ' O ' ' HB2' ' A' ' 50' ' ' SER . 20.7 ptmt -63.31 -29.14 70.51 Favored 'General case' 0 C--O 1.218 -0.576 0 CA-C-O 121.318 0.58 . . . . 0.0 110.688 -177.928 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.6 ' HB3' HD13 ' A' ' 44' ' ' LEU . 8.4 tt -72.63 -50.86 22.36 Favored 'General case' 0 C--N 1.307 -1.265 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.766 -179.072 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.482 ' HA ' ' CD2' ' A' ' 51' ' ' TYR . 7.2 ptmm? -62.97 -41.28 99.49 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.923 0.392 . . . . 0.0 111.764 -177.537 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.813 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 7.0 pt-20 -72.25 -30.06 64.51 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-O 121.104 0.478 . . . . 0.0 110.528 177.828 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . 0.684 ' O ' ' HG2' ' A' ' 54' ' ' ARG . 15.7 t -68.58 -45.69 71.37 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.414 -179.151 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.482 ' CD2' ' HA ' ' A' ' 48' ' ' LYS . 2.7 p90 -74.74 -32.93 62.25 Favored 'General case' 0 N--CA 1.448 -0.538 0 C-N-CA 119.772 -0.771 . . . . 0.0 110.48 -177.266 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . 0.497 ' SG ' HD11 ' A' ' 62' ' ' LEU . 98.6 m -60.93 -44.27 97.47 Favored 'General case' 0 C--O 1.239 0.541 0 CA-C-O 120.879 0.371 . . . . 0.0 110.822 179.048 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 10.6 pt20 -70.52 -31.57 68.7 Favored 'General case' 0 N--CA 1.444 -0.742 0 C-N-CA 120.368 -0.533 . . . . 0.0 110.966 -179.274 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.684 ' HG2' ' O ' ' A' ' 50' ' ' SER . 34.0 mmt180 -57.41 -36.3 71.15 Favored 'General case' 0 C--N 1.351 0.64 0 CA-C-O 121.237 0.541 . . . . 0.0 110.496 176.616 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.416 HE21 ' HB2' ' A' ' 55' ' ' GLN . 2.9 mt-30 -83.61 -20.82 33.01 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.844 179.797 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 80.88 33.09 30.92 Favored Glycine 0 N--CA 1.446 -0.666 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.47 178.933 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 35.1 m -132.33 148.65 70.53 Favored Pre-proline 0 C--N 1.322 -0.594 0 O-C-N 122.481 -0.423 . . . . 0.0 110.46 -179.8 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . 0.474 ' HG2' ' OG ' ' A' ' 61' ' ' SER . 28.8 Cg_endo -65.18 149.29 88.99 Favored 'Trans proline' 0 N--CA 1.458 -0.582 0 C-N-CA 122.31 2.007 . . . . 0.0 111.705 178.136 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.485 ' HG2' ' SG ' ' A' ' 52' ' ' CYS . 66.8 mtp -71.55 -9.32 58.04 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.524 -176.312 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 33.2 p30 -87.75 -10.25 51.61 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-O 121.404 0.621 . . . . 0.0 111.029 -178.959 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.474 ' OG ' ' HG2' ' A' ' 58' ' ' PRO . 74.3 m -90.11 -24.66 21.04 Favored 'General case' 0 N--CA 1.434 -1.245 0 CA-C-N 115.936 -0.575 . . . . 0.0 112.1 -177.579 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.497 HD11 ' SG ' ' A' ' 52' ' ' CYS . 1.5 pp -123.53 167.41 13.94 Favored 'General case' 0 C--N 1.307 -1.276 0 N-CA-C 112.538 0.57 . . . . 0.0 112.538 -177.483 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.483 ' O ' ' HA ' ' A' ' 90' ' ' VAL . 74.2 mtm180 -119.18 119.27 33.65 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.095 -176.949 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -100.9 116.08 31.92 Favored 'General case' 0 C--N 1.31 -1.113 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.847 178.587 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.449 ' C ' HD22 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -144.29 164.2 31.45 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.342 0.591 . . . . 0.0 110.918 -179.925 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 87.7 t80 -145.92 134.09 21.63 Favored 'General case' 0 C--N 1.309 -1.187 0 N-CA-C 109.219 -0.66 . . . . 0.0 109.219 178.388 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.425 ' HG2' HE21 ' A' ' 69' ' ' GLN . 7.9 pt-20 49.69 27.13 2.07 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 124.291 1.036 . . . . 0.0 112.563 -179.825 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 90.15 16.91 55.01 Favored Glycine 0 CA--C 1.521 0.411 0 C-N-CA 121.033 -0.603 . . . . 0.0 113.391 179.255 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . 0.425 HE21 ' HG2' ' A' ' 67' ' ' GLU . 2.7 pt20 -127.97 133.92 49.24 Favored 'General case' 0 C--N 1.317 -0.842 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 -179.986 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -72.36 146.85 46.79 Favored 'General case' 0 C--N 1.309 -1.193 0 CA-C-O 121.588 0.709 . . . . 0.0 110.705 178.807 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.472 HG21 HD12 ' A' ' 44' ' ' LEU . 20.7 mm -93.81 117.28 37.02 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.482 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.3 -178.611 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.409 ' O ' ' HB2' ' A' ' 75' ' ' HIS . . . -97.73 162.78 13.11 Favored 'General case' 0 N--CA 1.436 -1.141 0 N-CA-C 109.872 -0.418 . . . . 0.0 109.872 -179.761 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . 0.485 ' O ' ' HB3' ' A' ' 45' ' ' LYS . 7.4 p-10 -65.82 -22.46 66.56 Favored 'General case' 0 C--N 1.312 -1.039 0 CA-C-O 121.168 0.509 . . . . 0.0 111.7 -179.347 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 10.7 m-80 -96.03 2.86 53.65 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-O 121.382 0.61 . . . . 0.0 110.135 179.53 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . 0.595 ' O ' ' HB2' ' A' ' 44' ' ' LEU . 3.4 m170 -83.83 146.56 28.04 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 109.597 -0.519 . . . . 0.0 109.597 178.565 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.52 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 72.4 p -122.54 156.18 61.56 Favored Pre-proline 0 C--N 1.31 -1.147 0 O-C-N 122.307 -0.246 . . . . 0.0 111.062 178.555 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 25.0 Cg_exo -62.07 -37.45 64.01 Favored 'Trans proline' 0 C--N 1.351 0.676 0 C-N-CA 122.319 2.013 . . . . 0.0 110.999 179.243 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . 0.443 ' HG2' ' O ' ' A' ' 40' ' ' MET . 14.6 ptmt -67.26 -40.84 86.28 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.577 -179.165 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 47.4 mm-40 -75.33 -35.45 61.19 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 120.936 0.398 . . . . 0.0 111.355 -178.356 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.52 ' HG ' ' O ' ' A' ' 76' ' ' THR . 5.9 mt -79.27 -4.0 48.63 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-O 121.074 0.464 . . . . 0.0 110.688 179.762 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 74.04 47.85 17.51 Favored Glycine 0 N--CA 1.445 -0.759 0 C-N-CA 120.815 -0.707 . . . . 0.0 112.622 178.229 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 64.4 mtt -103.6 165.5 10.99 Favored 'General case' 0 C--N 1.313 -0.982 0 N-CA-C 109.516 -0.55 . . . . 0.0 109.516 178.204 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . 0.475 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 12.9 pt-20 -139.62 -172.88 3.47 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-O 120.842 0.354 . . . . 0.0 110.465 178.838 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -72.7 137.84 46.23 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-O 121.234 0.54 . . . . 0.0 111.152 -179.216 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 26.0 tt0 77.34 3.43 3.16 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.791 1.237 . . . . 0.0 111.052 179.495 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . 0.475 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 0.5 OUTLIER -60.62 162.45 6.5 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 121.366 0.603 . . . . 0.0 111.212 178.135 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 13.5 p -128.18 146.63 33.4 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.176 0 CA-C-O 121.207 0.527 . . . . 0.0 110.675 -177.677 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 3.8 mp -114.75 152.16 16.41 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.99 0 N-CA-C 108.844 -0.799 . . . . 0.0 108.844 178.536 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -104.9 138.77 40.63 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 109.931 -0.396 . . . . 0.0 109.931 -176.52 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . 0.545 ' HB ' ' HA2' ' A' ' 28' ' ' GLY . 85.5 t -128.91 134.72 63.75 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.834 0 CA-C-O 121.439 0.638 . . . . 0.0 111.302 179.312 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 75.1 m-85 -118.22 -179.73 3.86 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.93 -0.577 . . . . 0.0 109.578 179.08 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 8.5 tp60 -107.13 142.4 36.88 Favored 'General case' 0 C--N 1.313 -0.992 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 177.364 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' GLU . . . . . 0.466 ' OE2' ' HG2' ' A' ' 63' ' ' ARG . 11.1 pt-20 . . . . . 0 C--N 1.326 -0.414 0 CA-C-O 121.325 0.583 . . . . 0.0 111.117 176.497 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 23.8 ptt? . . . . . 0 N--CA 1.474 0.756 0 CA-C-O 120.572 0.225 . . . . 0.0 111.258 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 8.7 m -64.6 -16.03 62.05 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-O 121.602 0.715 . . . . 0.0 110.703 178.273 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 14.5 p-10 -89.75 38.6 0.92 Allowed 'General case' 0 C--N 1.318 -0.765 0 CA-C-O 121.856 0.836 . . . . 0.0 109.654 179.073 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.405 ' HG2' ' H ' ' A' ' 4' ' ' GLN . 8.8 pt20 -90.49 14.53 12.82 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.226 -0.897 . . . . 0.0 111.358 -176.206 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -87.97 155.61 19.75 Favored 'General case' 0 C--N 1.3 -1.561 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.17 179.683 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -162.2 174.42 12.92 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-O 120.957 0.408 . . . . 0.0 110.196 -177.938 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.76 156.91 62.54 Favored Pre-proline 0 C--N 1.311 -1.101 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.158 177.56 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -66.0 108.3 1.28 Allowed 'Trans proline' 0 N--CA 1.463 -0.276 0 C-N-CA 122.341 2.027 . . . . 0.0 112.801 -177.862 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 64.2 m -137.45 36.88 2.48 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-O 121.276 0.56 . . . . 0.0 109.632 178.34 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 24.3 p -55.92 147.05 20.4 Favored 'General case' 0 C--O 1.241 0.643 0 CA-C-O 121.453 0.644 . . . . 0.0 112.051 -179.703 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -81.85 106.2 13.59 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.594 -179.31 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -84.65 -40.0 17.94 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-O 121.678 0.752 . . . . 0.0 109.791 178.116 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 2.6 pp -149.77 173.06 14.15 Favored 'General case' 0 N--CA 1.436 -1.165 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.339 -177.799 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -134.72 38.79 1.77 Allowed Glycine 0 N--CA 1.436 -1.325 0 N-CA-C 111.234 -0.746 . . . . 0.0 111.234 179.748 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -101.56 96.29 7.02 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-O 121.045 0.45 . . . . 0.0 109.864 -178.802 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -164.85 166.09 19.94 Favored 'General case' 0 C--N 1.312 -1.029 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 -179.046 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -93.49 156.09 16.96 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-O 121.057 0.456 . . . . 0.0 110.452 -179.69 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.608 ' HA ' ' CE2' ' A' ' 21' ' ' TYR . 4.7 pt-20 -87.22 176.6 7.49 Favored 'General case' 0 C--N 1.314 -0.935 0 CA-C-N 116.508 -0.315 . . . . 0.0 110.23 177.215 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -164.3 -92.95 0.09 OUTLIER Glycine 0 N--CA 1.433 -1.527 0 C-N-CA 119.715 -1.231 . . . . 0.0 112.77 -177.12 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -124.08 6.86 8.56 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-O 121.048 0.451 . . . . 0.0 110.649 -178.856 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.608 ' CE2' ' HA ' ' A' ' 18' ' ' GLU . 47.9 p90 -88.69 152.8 21.58 Favored 'General case' 0 N--CA 1.447 -0.624 0 CA-C-O 121.381 0.61 . . . . 0.0 111.682 -179.019 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.427 ' HB ' ' HA ' ' A' ' 84' ' ' GLU . 18.3 pt -113.42 171.52 3.83 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.2 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.356 -179.192 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.56 ' HG2' ' HG2' ' A' ' 37' ' ' LYS . 50.9 mtmt -111.1 146.31 37.03 Favored 'General case' 0 C--N 1.305 -1.335 0 N-CA-C 109.726 -0.472 . . . . 0.0 109.726 179.756 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.9 mp -139.4 159.44 42.15 Favored 'General case' 0 C--N 1.295 -1.774 0 CA-C-O 121.095 0.474 . . . . 0.0 110.381 173.233 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.45 ' HE2' ' HB3' ' A' ' 25' ' ' LYS . 5.0 tmmm? -129.9 142.67 50.62 Favored 'General case' 0 N--CA 1.437 -1.083 0 CA-C-O 121.325 0.583 . . . . 0.0 110.426 -179.349 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.616 ' O ' ' HA ' ' A' ' 33' ' ' GLU . 0.9 OUTLIER -114.6 142.53 27.01 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.384 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.592 -179.163 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.473 HD13 ' HG2' ' A' ' 33' ' ' GLU . 47.4 mm -105.79 113.83 43.62 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.987 0 N-CA-C 107.243 -1.391 . . . . 0.0 107.243 174.691 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . 0.488 ' HA2' ' HB ' ' A' ' 90' ' ' VAL . . . -83.39 171.64 50.06 Favored Glycine 0 N--CA 1.425 -2.089 0 C-N-CA 119.998 -1.096 . . . . 0.0 111.804 -176.622 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.86 -23.61 65.28 Favored 'General case' 0 C--N 1.305 -1.363 0 CA-C-O 121.438 0.637 . . . . 0.0 111.03 178.108 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -103.34 15.32 29.42 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-O 121.578 0.704 . . . . 0.0 109.642 178.931 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 32.4 m 73.91 23.34 2.26 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-O 122.635 1.207 . . . . 0.0 108.192 -178.907 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.1 m -66.6 95.58 0.34 Allowed 'General case' 0 N--CA 1.428 -1.548 0 CA-C-N 113.285 -1.78 . . . . 0.0 111.106 -179.17 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.616 ' HA ' ' O ' ' A' ' 26' ' ' VAL . 38.6 mt-10 -83.71 106.89 15.78 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 121.533 0.682 . . . . 0.0 111.127 179.424 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.437 HG21 ' HA ' ' A' ' 51' ' ' TYR . 40.1 mm -103.62 140.42 21.83 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.431 0 CA-C-N 115.7 -0.682 . . . . 0.0 109.57 179.393 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 13.0 m170 -115.97 132.48 56.64 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 -179.625 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.557 ' HZ ' HG23 ' A' ' 26' ' ' VAL . 1.0 OUTLIER -147.24 159.33 43.77 Favored 'General case' 0 C--N 1.312 -1.031 0 CA-C-O 121.445 0.64 . . . . 0.0 112.003 -178.904 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.56 ' HG2' ' HG2' ' A' ' 23' ' ' LYS . 28.6 mtmt -120.92 119.11 31.65 Favored 'General case' 0 C--N 1.312 -1.053 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.363 -179.109 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 20.5 m -138.38 159.48 31.9 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-O 121.172 0.51 . . . . 0.0 110.947 -178.516 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.524 ' O ' HG22 ' A' ' 42' ' ' THR . 0.9 OUTLIER -74.85 154.56 38.2 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-O 121.058 0.456 . . . . 0.0 111.193 178.625 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -69.85 -37.31 76.11 Favored 'General case' 0 CA--C 1.507 -0.691 0 CA-C-O 121.22 0.533 . . . . 0.0 110.458 178.49 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 11.8 t -99.8 25.59 7.1 Favored 'General case' 0 N--CA 1.436 -1.169 0 CA-C-O 121.375 0.607 . . . . 0.0 112.424 -175.462 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . 0.524 HG22 ' O ' ' A' ' 39' ' ' LYS . 6.1 t -108.17 168.26 9.43 Favored 'General case' 0 C--N 1.32 -0.713 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 176.995 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 14.8 m170 -78.26 140.35 38.87 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 121.734 0.778 . . . . 0.0 111.885 -179.125 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.65 ' HB2' ' O ' ' A' ' 75' ' ' HIS . 0.2 OUTLIER -64.98 -18.44 65.28 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.051 -0.977 . . . . 0.0 109.813 -179.911 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.722 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -51.25 -45.84 62.14 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.734 -179.212 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.446 ' HA ' ' CG ' ' A' ' 49' ' ' GLU . 21.4 ptmt -66.47 -31.82 72.81 Favored 'General case' 0 C--O 1.22 -0.498 0 CA-C-O 121.427 0.632 . . . . 0.0 110.933 -177.647 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.559 ' HB3' HD13 ' A' ' 44' ' ' LEU . 8.1 tt -67.97 -47.84 67.5 Favored 'General case' 0 C--N 1.308 -1.202 0 CA-C-O 121.6 0.714 . . . . 0.0 109.259 178.025 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.504 ' HA ' ' CE2' ' A' ' 51' ' ' TYR . 40.5 mtpt -60.63 -45.2 94.93 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.066 -0.97 . . . . 0.0 111.535 -178.763 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.722 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 3.7 pt-20 -71.03 -33.85 70.72 Favored 'General case' 0 C--N 1.312 -1.05 0 CA-C-O 120.958 0.408 . . . . 0.0 110.376 178.639 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.594 ' O ' ' HG2' ' A' ' 54' ' ' ARG . 21.9 t -64.19 -44.91 90.53 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-O 120.881 0.372 . . . . 0.0 111.257 -178.744 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.504 ' CE2' ' HA ' ' A' ' 48' ' ' LYS . 3.6 p90 -75.73 -32.39 60.0 Favored 'General case' 0 N--CA 1.443 -0.81 0 C-N-CA 119.639 -0.824 . . . . 0.0 110.659 -178.618 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . 0.614 ' SG ' ' HG2' ' A' ' 59' ' ' MET . 69.3 m -62.77 -43.55 98.5 Favored 'General case' 0 C--O 1.238 0.451 0 CA-C-O 120.868 0.366 . . . . 0.0 110.822 178.667 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.404 ' HG2' ' O ' ' A' ' 49' ' ' GLU . 6.6 pt20 -66.49 -36.06 81.79 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 120.649 -0.421 . . . . 0.0 110.284 178.997 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.594 ' HG2' ' O ' ' A' ' 50' ' ' SER . 29.7 mmt180 -53.76 -45.77 70.73 Favored 'General case' 0 C--N 1.351 0.668 0 CA-C-O 121.233 0.54 . . . . 0.0 110.594 176.667 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.41 ' NE2' ' HA ' ' A' ' 52' ' ' CYS . 2.2 mt-30 -76.73 -23.43 53.05 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.881 -179.609 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 83.27 29.34 33.83 Favored Glycine 0 N--CA 1.445 -0.716 0 C-N-CA 120.565 -0.826 . . . . 0.0 112.086 178.464 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 26.6 m -128.49 153.45 79.3 Favored Pre-proline 0 C--N 1.327 -0.393 0 O-C-N 122.659 -0.318 . . . . 0.0 110.326 -178.725 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -69.01 149.14 71.31 Favored 'Trans proline' 0 C--O 1.239 0.571 0 C-N-CA 122.334 2.022 . . . . 0.0 112.188 178.226 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.614 ' HG2' ' SG ' ' A' ' 52' ' ' CYS . 75.3 mtp -71.46 -9.23 57.85 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.791 -0.64 . . . . 0.0 112.112 -176.06 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 21.0 p30 -89.72 -13.41 36.91 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-O 121.115 0.483 . . . . 0.0 111.529 -178.64 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.422 ' HB3' ' CG ' ' A' ' 94' ' ' GLN . 67.6 m -88.36 -16.1 33.88 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-O 121.164 0.507 . . . . 0.0 112.162 -179.204 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.547 HD11 ' SG ' ' A' ' 52' ' ' CYS . 1.5 pp -126.66 168.47 14.31 Favored 'General case' 0 C--N 1.309 -1.172 0 N-CA-C 112.817 0.673 . . . . 0.0 112.817 -178.457 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.555 ' O ' ' HA ' ' A' ' 90' ' ' VAL . 14.4 mtp180 -121.14 127.09 51.24 Favored 'General case' 0 CA--C 1.506 -0.73 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.658 -177.814 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -106.91 113.9 27.67 Favored 'General case' 0 C--N 1.305 -1.338 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.643 178.147 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.462 ' C ' HD22 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -141.23 162.12 36.24 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.361 0.6 . . . . 0.0 111.056 179.541 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 86.1 t80 -142.89 135.16 27.36 Favored 'General case' 0 C--N 1.311 -1.068 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 178.964 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.494 ' HG2' HE21 ' A' ' 69' ' ' GLN . 6.2 pt-20 48.96 29.32 2.32 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 124.23 1.012 . . . . 0.0 112.405 -179.729 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 81.77 27.65 45.63 Favored Glycine 0 N--CA 1.445 -0.709 0 C-N-CA 120.72 -0.752 . . . . 0.0 113.131 -179.273 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . 0.494 HE21 ' HG2' ' A' ' 67' ' ' GLU . 3.5 pt20 -132.61 136.47 46.54 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 109.217 -0.661 . . . . 0.0 109.217 178.018 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.91 145.74 49.98 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-O 121.638 0.732 . . . . 0.0 110.672 178.292 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.448 HG12 ' HA ' ' A' ' 65' ' ' LEU . 16.8 mm -99.74 121.27 50.21 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.592 0 CA-C-O 121.161 0.505 . . . . 0.0 109.989 -179.632 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -95.86 164.58 12.68 Favored 'General case' 0 C--N 1.309 -1.153 0 N-CA-C 109.946 -0.391 . . . . 0.0 109.946 -179.382 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -65.49 -21.75 66.66 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-O 121.287 0.565 . . . . 0.0 110.584 179.411 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 6.5 m-80 -97.93 2.31 48.94 Favored 'General case' 0 CA--C 1.508 -0.653 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.162 -179.61 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . 0.65 ' O ' ' HB2' ' A' ' 44' ' ' LEU . 1.6 m170 -82.33 146.18 29.54 Favored 'General case' 0 CA--C 1.505 -0.786 0 C-N-CA 119.96 -0.696 . . . . 0.0 109.305 -179.832 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.497 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 82.1 p -120.7 155.53 56.97 Favored Pre-proline 0 C--N 1.308 -1.198 0 C-N-CA 120.961 -0.296 . . . . 0.0 111.27 179.514 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_exo -61.85 -38.71 57.23 Favored 'Trans proline' 0 C--N 1.348 0.516 0 C-N-CA 122.459 2.106 . . . . 0.0 111.161 179.335 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . 0.521 ' HG3' ' N ' ' A' ' 79' ' ' GLU . 47.0 pttt -67.22 -39.58 86.3 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.801 -178.835 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.521 ' N ' ' HG3' ' A' ' 78' ' ' LYS . 4.3 mm-40 -75.26 -33.57 61.3 Favored 'General case' 0 N--CA 1.44 -0.974 0 CA-C-O 120.947 0.404 . . . . 0.0 111.614 -177.31 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.497 ' HG ' ' O ' ' A' ' 76' ' ' THR . 6.5 mt -82.8 -1.32 51.43 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.214 0.53 . . . . 0.0 110.78 179.573 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 76.3 46.43 12.61 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 121.133 -0.556 . . . . 0.0 113.114 177.248 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 60.7 mtt -107.04 167.72 9.7 Favored 'General case' 0 C--N 1.313 -1.021 0 N-CA-C 109.627 -0.509 . . . . 0.0 109.627 178.569 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -148.42 -171.3 3.81 Favored 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 109.938 -0.393 . . . . 0.0 109.938 178.168 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.427 ' HA ' ' HB ' ' A' ' 22' ' ' ILE . 7.0 pt-20 -66.29 135.31 54.23 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.531 0.681 . . . . 0.0 111.659 -178.48 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 74.63 6.74 4.48 Favored 'General case' 0 C--N 1.324 -0.539 0 C-N-CA 124.816 1.246 . . . . 0.0 112.558 178.746 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -62.27 162.54 9.64 Favored 'General case' 0 C--O 1.238 0.491 0 CA-C-O 121.093 0.473 . . . . 0.0 110.081 175.87 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.438 ' HA ' ' O ' ' A' ' 25' ' ' LYS . 7.3 p -127.56 142.19 44.3 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.264 0 CA-C-O 121.537 0.684 . . . . 0.0 111.925 -176.392 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 3.7 mp -114.4 153.62 15.89 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 179.699 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -104.67 135.53 45.9 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 121.046 0.451 . . . . 0.0 109.994 -176.401 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . 0.555 ' HA ' ' O ' ' A' ' 63' ' ' ARG . 96.7 t -128.57 134.74 64.03 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.904 0 CA-C-O 121.268 0.556 . . . . 0.0 110.825 179.039 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 80.7 m-85 -121.24 179.07 4.53 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-N 116.213 -0.449 . . . . 0.0 109.858 179.43 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 8.7 tp60 -108.22 128.23 54.53 Favored 'General case' 0 C--N 1.313 -1.005 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 179.54 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . 0.403 ' HB3' ' CD ' ' A' ' 63' ' ' ARG . 9.8 pt-20 -117.84 21.42 12.9 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.316 0.579 . . . . 0.0 111.037 178.209 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . 0.422 ' CG ' ' HB3' ' A' ' 61' ' ' SER . 98.9 mt-30 -63.43 -159.42 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.515 175.375 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 8.8 t -144.37 138.35 27.74 Favored 'General case' 0 C--N 1.306 -1.287 0 O-C-N 121.195 -0.94 . . . . 0.0 110.871 -178.042 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -96.75 3.28 62.75 Favored Glycine 0 N--CA 1.44 -1.09 0 C-N-CA 120.701 -0.761 . . . . 0.0 111.349 178.558 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.436 -1.348 0 CA-C-O 118.943 -0.92 . . . . 0.0 111.222 -179.499 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 92.7 mmm . . . . . 0 N--CA 1.479 0.997 0 CA-C-O 121.42 0.628 . . . . 0.0 110.257 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 16.0 m -107.53 31.21 5.6 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.853 -176.867 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 13.2 m-20 72.23 33.82 1.48 Allowed 'General case' 0 N--CA 1.48 1.026 0 CA-C-O 121.652 0.739 . . . . 0.0 110.541 178.626 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -115.72 -19.09 10.65 Favored 'General case' 0 C--N 1.309 -1.166 0 CA-C-O 122.426 1.108 . . . . 0.0 108.372 -179.656 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -127.75 148.73 50.43 Favored 'General case' 0 N--CA 1.423 -1.802 0 CA-C-N 114.292 -1.322 . . . . 0.0 109.533 -175.71 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -165.89 179.66 5.76 Favored 'General case' 0 C--N 1.312 -1.044 0 CA-C-O 121.241 0.543 . . . . 0.0 111.21 -178.178 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.414 ' HD3' ' O ' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -143.5 150.62 51.76 Favored Pre-proline 0 N--CA 1.442 -0.856 0 CA-C-N 115.636 -0.711 . . . . 0.0 109.696 178.277 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.528 ' HB2' HG22 ' A' ' 10' ' ' THR . 7.9 Cg_endo -49.83 132.22 31.21 Favored 'Trans proline' 0 CA--C 1.538 0.694 0 C-N-CA 123.29 2.66 . . . . 0.0 113.19 -178.649 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 50.1 m -60.74 -31.58 70.89 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.699 -178.859 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . 0.528 HG22 ' HB2' ' A' ' 8' ' ' PRO . 12.8 t -53.01 -20.35 3.39 Favored 'General case' 0 CA--C 1.543 0.706 0 N-CA-C 112.059 0.392 . . . . 0.0 112.059 176.864 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 28.2 tt0 -81.08 131.0 35.28 Favored 'General case' 0 N--CA 1.448 -0.535 0 N-CA-C 108.415 -0.958 . . . . 0.0 108.415 175.854 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -50.94 -48.08 60.92 Favored 'General case' 0 N--CA 1.476 0.846 0 N-CA-C 116.039 1.866 . . . . 0.0 116.039 -170.613 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 71.2 mt -102.37 -173.53 2.36 Favored 'General case' 0 C--N 1.315 -0.915 0 O-C-N 121.221 -0.924 . . . . 0.0 111.365 -174.094 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 75.81 49.75 8.57 Favored Glycine 0 N--CA 1.441 -0.971 0 C-N-CA 120.606 -0.807 . . . . 0.0 111.424 -179.128 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 3.8 p-10 -85.23 149.96 25.13 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-O 121.124 0.487 . . . . 0.0 110.605 -179.06 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 3.4 mppt? -122.47 154.66 37.51 Favored 'General case' 0 C--N 1.316 -0.85 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 178.81 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -86.89 178.76 6.87 Favored 'General case' 0 C--N 1.312 -1.053 0 C-N-CA 120.428 -0.509 . . . . 0.0 111.602 179.415 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.457 ' H ' ' HG2' ' A' ' 18' ' ' GLU . 5.8 pt-20 -108.79 166.41 10.83 Favored 'General case' 0 C--N 1.312 -1.056 0 CA-C-O 121.238 0.542 . . . . 0.0 112.094 -172.852 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 173.7 -47.63 0.15 Allowed Glycine 0 N--CA 1.448 -0.503 0 N-CA-C 111.072 -0.811 . . . . 0.0 111.072 -177.952 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -43.99 -29.46 0.59 Allowed 'General case' 0 N--CA 1.481 1.097 0 N-CA-C 113.632 0.975 . . . . 0.0 113.632 176.285 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.483 ' CE2' ' HD3' ' A' ' 37' ' ' LYS . 44.1 p90 -66.95 172.07 4.82 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-O 121.469 0.652 . . . . 0.0 111.255 179.851 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.457 ' HB ' ' HA ' ' A' ' 84' ' ' GLU . 22.3 pt -124.42 172.18 12.3 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.814 0 CA-C-O 121.569 0.699 . . . . 0.0 110.25 177.833 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 14.2 mtmt -117.63 146.69 43.49 Favored 'General case' 0 C--N 1.298 -1.636 0 N-CA-C 109.058 -0.719 . . . . 0.0 109.058 -179.071 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.6 mp -141.35 161.48 37.79 Favored 'General case' 0 C--N 1.303 -1.434 0 CA-C-O 121.337 0.589 . . . . 0.0 111.473 174.957 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.415 ' HE2' ' HB3' ' A' ' 25' ' ' LYS . 5.5 tmmm? -133.34 142.88 48.65 Favored 'General case' 0 N--CA 1.436 -1.16 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.463 -178.993 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.498 HG23 ' HZ ' ' A' ' 36' ' ' PHE . 0.9 OUTLIER -114.46 141.72 29.83 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.341 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.247 -179.701 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.436 ' O ' ' HB ' ' A' ' 90' ' ' VAL . 45.5 mm -105.11 117.74 51.31 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.971 0 N-CA-C 107.685 -1.228 . . . . 0.0 107.685 175.652 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . 0.415 ' HA2' ' HB ' ' A' ' 90' ' ' VAL . . . -87.56 168.1 37.75 Favored Glycine 0 N--CA 1.421 -2.359 0 C-N-CA 120.372 -0.918 . . . . 0.0 111.845 -177.316 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.04 -22.59 66.96 Favored 'General case' 0 C--N 1.305 -1.348 0 CA-C-O 121.592 0.711 . . . . 0.0 110.704 178.832 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -97.99 12.18 35.07 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.663 -0.699 . . . . 0.0 109.555 179.672 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 15.1 m 71.54 16.56 5.86 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.337 -178.961 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 9.6 t -76.09 115.94 16.3 Favored 'General case' 0 N--CA 1.444 -0.737 0 CA-C-N 115.551 -0.749 . . . . 0.0 110.234 -179.731 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.478 ' HA ' ' O ' ' A' ' 26' ' ' VAL . 40.9 mt-10 -89.15 112.68 23.74 Favored 'General case' 0 CA--C 1.509 -0.598 0 CA-C-O 120.942 0.401 . . . . 0.0 110.415 178.678 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 30.6 mm -99.48 135.53 34.45 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.515 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 177.193 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 11.9 m170 -116.13 132.74 56.57 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 109.549 -0.537 . . . . 0.0 109.549 -178.52 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.498 ' HZ ' HG23 ' A' ' 26' ' ' VAL . 1.4 p90 -147.22 166.77 26.0 Favored 'General case' 0 C--N 1.314 -0.972 0 CA-C-O 121.424 0.63 . . . . 0.0 111.6 -178.164 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.483 ' HD3' ' CE2' ' A' ' 21' ' ' TYR . 89.9 mttt -125.17 121.34 33.91 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.835 -178.79 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 28.1 m -139.15 156.97 28.08 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 CA-C-O 120.949 0.404 . . . . 0.0 110.165 179.455 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.528 ' O ' HG22 ' A' ' 42' ' ' THR . 80.4 tttt -84.21 167.25 16.85 Favored 'General case' 0 C--N 1.311 -1.072 0 O-C-N 121.98 -0.45 . . . . 0.0 110.654 179.832 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -73.39 -36.28 66.02 Favored 'General case' 0 N--CA 1.464 0.269 0 N-CA-C 112.907 0.706 . . . . 0.0 112.907 -176.931 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 11.3 t -96.18 15.72 20.16 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 112.02 0.378 . . . . 0.0 112.02 -177.182 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . 0.528 HG22 ' O ' ' A' ' 39' ' ' LYS . 5.3 t -93.58 171.62 8.78 Favored 'General case' 0 C--N 1.319 -0.742 0 O-C-N 121.627 -0.67 . . . . 0.0 109.917 -179.604 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . 0.405 ' O ' ' HG2' ' A' ' 46' ' ' LYS . 51.6 m170 -88.39 141.23 28.71 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 121.381 0.61 . . . . 0.0 111.188 -179.535 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.631 ' HB2' ' O ' ' A' ' 75' ' ' HIS . 0.2 OUTLIER -69.49 -15.22 63.22 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.571 -0.74 . . . . 0.0 110.033 -179.815 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.778 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -54.75 -44.98 74.1 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-N 115.756 -0.656 . . . . 0.0 111.934 -179.225 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.459 ' N ' ' HD3' ' A' ' 45' ' ' LYS . 21.4 ptmt -69.49 -29.12 66.7 Favored 'General case' 0 C--O 1.218 -0.602 0 CA-C-O 121.286 0.565 . . . . 0.0 110.482 -178.233 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.579 ' HB3' HD13 ' A' ' 44' ' ' LEU . 8.0 tt -72.55 -49.83 29.89 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.498 -179.653 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.501 ' HG2' ' O ' ' A' ' 44' ' ' LEU . 8.3 ptmm? -61.76 -41.76 98.1 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.418 -178.306 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.778 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 8.2 pt-20 -72.16 -30.49 65.05 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-O 121.021 0.439 . . . . 0.0 110.716 177.841 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.594 ' O ' ' HG2' ' A' ' 53' ' ' GLN . 29.3 t -68.57 -43.7 76.01 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.431 -0.35 . . . . 0.0 111.5 -178.75 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.462 ' CD1' HG11 ' A' ' 26' ' ' VAL . 2.5 p90 -75.66 -32.46 60.19 Favored 'General case' 0 N--CA 1.446 -0.658 0 C-N-CA 119.531 -0.868 . . . . 0.0 110.206 -178.619 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . 0.512 ' SG ' HD11 ' A' ' 62' ' ' LEU . 98.9 m -65.14 -42.75 93.55 Favored 'General case' 0 CA--C 1.504 -0.807 0 CA-C-O 121.236 0.541 . . . . 0.0 110.601 179.765 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.594 ' HG2' ' O ' ' A' ' 50' ' ' SER . 25.4 pt20 -67.37 -35.89 80.25 Favored 'General case' 0 N--CA 1.434 -1.271 0 CA-C-N 115.97 -0.559 . . . . 0.0 109.596 -179.728 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.41 ' HA ' ' NE ' ' A' ' 54' ' ' ARG . 1.0 OUTLIER -56.91 -39.35 74.28 Favored 'General case' 0 C--N 1.355 0.832 0 CA-C-O 121.315 0.578 . . . . 0.0 111.279 178.831 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.44 ' NE2' ' HA ' ' A' ' 52' ' ' CYS . 3.5 mt-30 -77.7 -20.91 52.81 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.888 179.964 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 80.86 33.63 29.57 Favored Glycine 0 N--CA 1.447 -0.615 0 C-N-CA 120.787 -0.721 . . . . 0.0 111.88 179.899 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 31.2 m -133.8 150.67 75.27 Favored Pre-proline 0 C--O 1.238 0.488 0 O-C-N 122.606 -0.349 . . . . 0.0 110.743 -178.685 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . 0.546 ' HG2' ' OG ' ' A' ' 61' ' ' SER . 29.9 Cg_endo -65.37 149.57 88.03 Favored 'Trans proline' 0 N--CA 1.455 -0.739 0 C-N-CA 122.558 2.172 . . . . 0.0 111.479 176.829 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.483 ' HG2' ' SG ' ' A' ' 52' ' ' CYS . 68.5 mtp -73.5 -8.38 55.69 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 121.246 0.546 . . . . 0.0 111.52 -176.686 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . 0.423 ' OD1' ' HB2' ' A' ' 58' ' ' PRO . 2.0 p-10 -90.82 -10.19 43.67 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-O 121.272 0.558 . . . . 0.0 111.046 -179.124 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.546 ' OG ' ' HG2' ' A' ' 58' ' ' PRO . 67.1 m -87.59 -19.22 28.12 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 121.08 0.467 . . . . 0.0 111.59 179.766 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.512 HD11 ' SG ' ' A' ' 52' ' ' CYS . 1.8 pp -127.66 170.31 12.83 Favored 'General case' 0 C--N 1.317 -0.829 0 N-CA-C 112.948 0.721 . . . . 0.0 112.948 -177.949 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.443 ' O ' ' HA ' ' A' ' 90' ' ' VAL . 44.2 mtm180 -120.18 119.4 33.14 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.606 -0.724 . . . . 0.0 110.824 -176.686 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.449 ' HB3' ' OH ' ' A' ' 51' ' ' TYR . 0.2 OUTLIER -102.33 116.11 31.96 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-O 121.085 0.469 . . . . 0.0 111.034 178.458 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.467 ' C ' HD22 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -143.3 162.52 35.45 Favored 'General case' 0 N--CA 1.444 -0.755 0 CA-C-O 121.395 0.616 . . . . 0.0 111.285 179.412 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.417 ' CB ' HD11 ' A' ' 71' ' ' ILE . 90.2 t80 -143.64 134.48 25.29 Favored 'General case' 0 C--N 1.306 -1.287 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 179.432 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.445 ' HG2' HE21 ' A' ' 69' ' ' GLN . 6.4 pt-20 49.34 27.34 1.9 Allowed 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 124.006 0.923 . . . . 0.0 112.354 -179.071 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 87.19 19.94 54.02 Favored Glycine 0 N--CA 1.449 -0.463 0 C-N-CA 121.079 -0.582 . . . . 0.0 113.687 -179.541 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . 0.445 HE21 ' HG2' ' A' ' 67' ' ' GLU . 3.3 pt20 -128.68 137.3 51.55 Favored 'General case' 0 C--N 1.319 -0.737 0 O-C-N 122.058 -0.672 . . . . 0.0 109.486 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -68.8 146.64 52.72 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-O 121.292 0.567 . . . . 0.0 110.225 178.241 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.508 HG21 HD12 ' A' ' 44' ' ' LEU . 24.5 mm -93.15 119.09 40.3 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.54 0 CA-C-O 120.931 0.396 . . . . 0.0 110.161 -179.613 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -96.96 163.54 12.91 Favored 'General case' 0 N--CA 1.437 -1.095 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 -179.505 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . 0.463 ' CA ' ' HB3' ' A' ' 45' ' ' LYS . 13.8 m-20 -65.02 -28.17 69.31 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-O 121.563 0.697 . . . . 0.0 110.769 -178.901 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 6.2 m-80 -95.36 4.13 53.7 Favored 'General case' 0 C--N 1.313 -0.981 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.994 -176.443 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . 0.631 ' O ' ' HB2' ' A' ' 44' ' ' LEU . 1.7 m170 -80.29 141.69 35.25 Favored 'General case' 0 CA--C 1.509 -0.629 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 179.974 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.418 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 69.7 p -116.57 154.11 49.1 Favored Pre-proline 0 C--N 1.308 -1.236 0 C-N-CA 120.829 -0.348 . . . . 0.0 111.286 178.942 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -58.64 -40.6 72.02 Favored 'Trans proline' 0 C--N 1.349 0.594 0 C-N-CA 122.624 2.216 . . . . 0.0 111.602 179.264 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . 0.483 ' HG3' ' N ' ' A' ' 79' ' ' GLU . 17.3 pttt -68.66 -35.52 77.36 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.05 0.452 . . . . 0.0 111.114 -178.146 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.483 ' N ' ' HG3' ' A' ' 78' ' ' LYS . 32.8 mm-40 -76.24 -32.74 59.04 Favored 'General case' 0 CA--C 1.508 -0.672 0 CA-C-O 120.854 0.359 . . . . 0.0 111.233 -179.29 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.469 HD21 ' CG ' ' A' ' 75' ' ' HIS . 5.5 mt -83.27 -2.76 56.43 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.417 0.627 . . . . 0.0 110.361 178.954 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 75.06 44.52 23.28 Favored Glycine 0 N--CA 1.449 -0.456 0 CA-C-N 115.852 -0.613 . . . . 0.0 112.552 177.696 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 63.0 mtt -101.65 162.02 13.21 Favored 'General case' 0 C--N 1.316 -0.874 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 178.745 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -139.85 -172.76 3.46 Favored 'General case' 0 C--N 1.309 -1.181 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 178.471 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.457 ' HA ' ' HB ' ' A' ' 22' ' ' ILE . 10.0 pt-20 -73.34 136.23 44.41 Favored 'General case' 0 N--CA 1.443 -0.813 0 C-N-CA 119.843 -0.743 . . . . 0.0 110.836 179.443 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . 0.405 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 42.9 mt-10 76.04 5.06 3.8 Favored 'General case' 0 C--N 1.321 -0.644 0 C-N-CA 124.612 1.165 . . . . 0.0 111.557 -179.114 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 1.8 t0 -63.22 163.84 9.69 Favored 'General case' 0 C--O 1.238 0.488 0 CA-C-O 121.007 0.432 . . . . 0.0 110.309 176.435 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 9.1 p -126.92 143.14 41.37 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.267 0 CA-C-O 121.421 0.629 . . . . 0.0 111.713 -175.934 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 3.4 mp -113.2 152.19 14.96 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.746 0 N-CA-C 108.611 -0.885 . . . . 0.0 108.611 178.134 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -105.42 137.24 43.55 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-O 121.182 0.515 . . . . 0.0 110.754 -175.89 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . 0.443 ' HA ' ' O ' ' A' ' 63' ' ' ARG . 58.3 t -130.02 134.97 62.01 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.843 0 CA-C-O 121.398 0.618 . . . . 0.0 110.74 178.68 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 95.7 m-85 -123.33 -178.79 4.09 Favored 'General case' 0 C--N 1.307 -1.276 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 178.645 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 8.0 tp60 -104.65 152.75 22.09 Favored 'General case' 0 C--N 1.305 -1.344 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 179.332 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -141.7 20.78 2.17 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.424 0.63 . . . . 0.0 110.329 175.207 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 98.8 mt-30 -59.92 -164.56 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.79 0 CA-C-N 115.507 -0.77 . . . . 0.0 112.396 178.275 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 7.4 t -126.12 -32.25 2.76 Favored 'General case' 0 C--N 1.32 -0.697 0 O-C-N 121.711 -0.618 . . . . 0.0 111.151 -176.43 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -147.05 -168.79 14.08 Favored Glycine 0 N--CA 1.44 -1.09 0 C-N-CA 120.632 -0.794 . . . . 0.0 111.896 -179.794 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.438 -1.213 0 CA-C-O 118.875 -0.958 . . . . 0.0 111.442 -179.976 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.4 ptm . . . . . 0 N--CA 1.484 1.238 0 CA-C-O 120.877 0.37 . . . . 0.0 111.763 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 39.6 m -160.54 14.39 0.12 Allowed 'General case' 0 N--CA 1.479 1.015 0 CA-C-O 122.014 0.911 . . . . 0.0 109.413 -177.755 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -106.93 0.22 23.64 Favored 'General case' 0 C--N 1.31 -1.141 0 CA-C-N 114.921 -1.036 . . . . 0.0 109.915 -175.688 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -70.43 -16.75 62.98 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.267 -0.879 . . . . 0.0 110.45 178.91 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -114.53 147.05 39.98 Favored 'General case' 0 N--CA 1.438 -1.069 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.414 -179.634 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -141.4 128.28 20.55 Favored 'General case' 0 C--N 1.303 -1.444 0 N-CA-C 108.218 -1.03 . . . . 0.0 108.218 175.862 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 14.3 mmmm -123.99 154.01 67.78 Favored Pre-proline 0 C--N 1.303 -1.45 0 C-N-CA 120.752 -0.379 . . . . 0.0 110.503 -176.441 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -77.24 105.49 2.07 Favored 'Trans proline' 0 N--CA 1.446 -1.281 0 C-N-CA 122.057 1.838 . . . . 0.0 110.635 177.135 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 12.0 p -83.0 93.67 7.61 Favored 'General case' 0 N--CA 1.433 -1.278 0 CA-C-O 121.52 0.676 . . . . 0.0 110.835 -177.752 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 22.5 p -94.62 142.19 27.74 Favored 'General case' 0 N--CA 1.433 -1.297 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.376 179.642 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 24.5 tt0 -139.11 95.08 2.88 Favored 'General case' 0 C--N 1.31 -1.123 0 N-CA-C 108.594 -0.891 . . . . 0.0 108.594 178.7 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 33.2 m-20 -90.26 11.55 20.84 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.768 -173.563 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 50.4 mt -48.08 -54.55 12.79 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.94 177.208 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 80.44 -34.78 2.24 Favored Glycine 0 N--CA 1.453 -0.208 0 C-N-CA 121.178 -0.534 . . . . 0.0 112.694 178.63 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -76.51 103.9 6.75 Favored 'General case' 0 CA--C 1.502 -0.886 0 CA-C-O 121.223 0.535 . . . . 0.0 110.659 -179.674 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 66.9 mttm -149.43 144.16 26.17 Favored 'General case' 0 CA--C 1.499 -0.995 0 CA-C-N 115.626 -0.716 . . . . 0.0 110.939 -179.369 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 84.3 tttt -141.76 165.8 26.48 Favored 'General case' 0 N--CA 1.414 -2.258 0 N-CA-C 108.25 -1.019 . . . . 0.0 108.25 179.041 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 50.8 mt-10 -144.66 83.22 1.7 Allowed 'General case' 0 C--N 1.318 -0.793 0 CA-C-O 121.506 0.669 . . . . 0.0 110.675 -176.879 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -111.63 -83.68 1.36 Allowed Glycine 0 C--N 1.301 -1.412 0 C-N-CA 120.738 -0.744 . . . . 0.0 111.309 176.696 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -82.45 68.94 9.09 Favored 'General case' 0 C--N 1.312 -1.044 0 CA-C-O 121.405 0.622 . . . . 0.0 110.941 176.631 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 34.8 p90 -104.63 178.07 4.67 Favored 'General case' 0 C--N 1.308 -1.229 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.872 178.041 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.422 ' HB ' ' HA ' ' A' ' 84' ' ' GLU . 21.1 pt -123.99 172.23 11.76 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.93 0 CA-C-O 121.261 0.553 . . . . 0.0 110.391 -177.026 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -117.17 143.0 46.32 Favored 'General case' 0 C--N 1.303 -1.427 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 -179.68 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.4 mp -135.21 162.02 33.71 Favored 'General case' 0 C--N 1.309 -1.177 0 CA-C-O 121.202 0.525 . . . . 0.0 110.863 176.778 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.569 ' HG3' ' NE2' ' A' ' 35' ' ' HIS . 2.9 tmmt? -133.22 144.02 49.52 Favored 'General case' 0 N--CA 1.439 -1.002 0 CA-C-O 121.391 0.615 . . . . 0.0 111.186 -178.648 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.561 HG23 ' HZ ' ' A' ' 36' ' ' PHE . 1.0 OUTLIER -118.54 139.03 47.31 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.314 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.231 178.904 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.442 ' CD1' ' HG2' ' A' ' 33' ' ' GLU . 40.1 mm -107.19 99.13 7.95 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.01 0 N-CA-C 108.525 -0.917 . . . . 0.0 108.525 175.039 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . 0.59 ' HA2' ' HB ' ' A' ' 90' ' ' VAL . . . -69.8 161.9 52.68 Favored Glycine 0 N--CA 1.42 -2.396 0 C-N-CA 120.27 -0.966 . . . . 0.0 112.943 178.382 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.417 ' HG3' ' H ' ' A' ' 29' ' ' GLN . 0.0 OUTLIER -54.62 -28.55 47.54 Favored 'General case' 0 C--N 1.306 -1.293 0 C-N-CA 123.675 0.79 . . . . 0.0 112.01 176.914 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -88.49 14.88 8.82 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-O 121.249 0.547 . . . . 0.0 110.362 179.597 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 55.6 m 67.62 14.56 9.57 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-O 121.76 0.791 . . . . 0.0 110.353 -177.639 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 2.2 t -72.82 101.48 3.15 Favored 'General case' 0 N--CA 1.438 -1.07 0 CA-C-N 115.238 -0.892 . . . . 0.0 110.4 -179.664 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.442 ' HG2' ' CD1' ' A' ' 27' ' ' ILE . 23.9 mt-10 -79.7 103.61 9.72 Favored 'General case' 0 N--CA 1.444 -0.749 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 177.569 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.417 HG21 ' HA ' ' A' ' 51' ' ' TYR . 23.0 mm -97.33 130.97 45.21 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.587 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 -178.918 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . 0.569 ' NE2' ' HG3' ' A' ' 25' ' ' LYS . 12.1 m170 -115.95 123.77 48.87 Favored 'General case' 0 CA--C 1.505 -0.768 0 N-CA-C 109.646 -0.501 . . . . 0.0 109.646 -178.953 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.561 ' HZ ' HG23 ' A' ' 26' ' ' VAL . 1.3 p90 -138.15 147.28 43.73 Favored 'General case' 0 C--N 1.301 -1.534 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.763 -177.156 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 96.2 mttt -109.7 117.92 35.17 Favored 'General case' 0 C--N 1.311 -1.068 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.022 -179.333 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.412 HG21 HD12 ' A' ' 47' ' ' LEU . 24.6 m -137.17 167.04 24.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.351 -178.433 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.423 ' HG2' ' N ' ' A' ' 40' ' ' MET . 81.7 tttt -90.76 160.03 16.01 Favored 'General case' 0 C--N 1.318 -0.8 0 O-C-N 121.782 -0.574 . . . . 0.0 110.695 -179.769 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . 0.423 ' N ' ' HG2' ' A' ' 39' ' ' LYS . 0.0 OUTLIER -66.21 -37.85 86.56 Favored 'General case' 0 CA--C 1.517 -0.317 0 N-CA-C 112.594 0.591 . . . . 0.0 112.594 -177.466 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 11.0 t -98.84 17.87 18.44 Favored 'General case' 0 C--N 1.312 -1.032 0 CA-C-O 120.952 0.406 . . . . 0.0 111.741 -175.739 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 1.1 t -95.16 165.73 12.26 Favored 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 120.205 -0.598 . . . . 0.0 109.788 179.069 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 18.3 m170 -81.28 137.52 35.79 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-O 121.498 0.666 . . . . 0.0 112.029 -179.917 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.598 ' HB2' ' O ' ' A' ' 75' ' ' HIS . 0.4 OUTLIER -65.71 -14.39 61.19 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.034 -0.984 . . . . 0.0 110.968 179.784 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.748 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -51.01 -54.45 24.45 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.505 0.557 . . . . 0.0 112.505 -178.432 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.432 ' HD3' ' N ' ' A' ' 47' ' ' LEU . 0.1 OUTLIER -66.85 -25.27 66.34 Favored 'General case' 0 C--O 1.218 -0.573 0 CA-C-O 121.289 0.566 . . . . 0.0 111.491 -178.192 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.463 ' HB3' HD13 ' A' ' 44' ' ' LEU . 8.2 tt -73.51 -51.34 17.4 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.708 178.93 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.49 ' HG2' ' O ' ' A' ' 44' ' ' LEU . 8.7 ptmm? -62.39 -40.27 95.95 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.904 0.383 . . . . 0.0 111.522 -177.566 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.748 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 11.5 pt-20 -72.57 -31.29 65.12 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-O 120.909 0.385 . . . . 0.0 110.632 177.838 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.408 ' HB2' ' O ' ' A' ' 46' ' ' LYS . 38.1 t -65.86 -44.33 85.73 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-O 120.932 0.396 . . . . 0.0 111.226 -179.292 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.54 ' CD1' HG11 ' A' ' 26' ' ' VAL . 1.2 p90 -76.49 -33.17 58.66 Favored 'General case' 0 N--CA 1.443 -0.78 0 C-N-CA 119.676 -0.81 . . . . 0.0 110.266 -177.78 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 84.5 m -61.81 -44.75 96.24 Favored 'General case' 0 CA--C 1.512 -0.513 0 CA-C-O 121.174 0.512 . . . . 0.0 110.57 179.727 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 12.9 pt20 -69.63 -32.5 71.23 Favored 'General case' 0 N--CA 1.444 -0.727 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.552 -179.022 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.557 ' HA ' ' NE ' ' A' ' 54' ' ' ARG . 6.9 mmp_? -59.61 -29.41 67.97 Favored 'General case' 0 C--N 1.344 0.337 0 CA-C-O 121.13 0.491 . . . . 0.0 111.465 177.319 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.436 HE21 ' HB2' ' A' ' 55' ' ' GLN . 3.4 mt-30 -89.36 -21.09 23.27 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-O 121.04 0.448 . . . . 0.0 111.046 179.57 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 84.8 28.58 31.48 Favored Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 120.855 -0.688 . . . . 0.0 112.272 179.476 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 27.3 m -133.05 153.37 80.88 Favored Pre-proline 0 C--N 1.324 -0.542 0 O-C-N 122.375 -0.486 . . . . 0.0 110.948 -178.656 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . 0.433 ' HB2' ' OD1' ' A' ' 60' ' ' ASN . 59.1 Cg_endo -77.6 164.57 28.14 Favored 'Trans proline' 0 N--CA 1.457 -0.63 0 C-N-CA 122.631 2.221 . . . . 0.0 112.417 177.864 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 42.0 mtt -69.75 -8.67 49.99 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-N 116.184 -0.462 . . . . 0.0 112.111 -177.415 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . 0.433 ' OD1' ' HB2' ' A' ' 58' ' ' PRO . 1.4 p-10 -92.7 -11.74 33.26 Favored 'General case' 0 C--N 1.312 -1.037 0 CA-C-O 121.319 0.581 . . . . 0.0 111.023 -177.649 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 50.0 m -88.43 -22.67 23.6 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-O 121.275 0.56 . . . . 0.0 111.314 -179.114 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -135.27 165.09 26.23 Favored 'General case' 0 C--N 1.307 -1.257 0 CA-C-O 121.372 0.606 . . . . 0.0 112.401 -176.954 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.568 ' O ' ' HA ' ' A' ' 90' ' ' VAL . 9.8 mtp180 -116.27 118.88 33.99 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.256 -178.123 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.501 ' HB3' ' OH ' ' A' ' 51' ' ' TYR . 0.2 OUTLIER -96.72 112.36 24.14 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-O 121.064 0.459 . . . . 0.0 110.671 177.515 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.455 ' C ' HD22 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -143.12 164.7 29.44 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-O 121.614 0.721 . . . . 0.0 111.928 -179.258 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 91.8 t80 -145.41 135.14 23.46 Favored 'General case' 0 C--N 1.31 -1.116 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 179.056 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.466 ' HG2' HE21 ' A' ' 69' ' ' GLN . 6.8 pt-20 49.19 27.81 1.95 Allowed 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 124.214 1.006 . . . . 0.0 112.292 -179.19 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 85.59 23.21 47.78 Favored Glycine 0 CA--C 1.523 0.591 0 C-N-CA 120.885 -0.674 . . . . 0.0 113.312 -178.817 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . 0.466 HE21 ' HG2' ' A' ' 67' ' ' GLU . 3.0 pt20 -131.75 134.27 45.68 Favored 'General case' 0 C--N 1.321 -0.655 0 O-C-N 122.191 -0.594 . . . . 0.0 109.452 179.341 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.499 ' CD ' ' H ' ' A' ' 70' ' ' ARG . 0.1 OUTLIER -73.58 145.03 45.78 Favored 'General case' 0 C--N 1.31 -1.131 0 CA-C-O 121.695 0.76 . . . . 0.0 110.497 178.113 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 23.0 mm -91.58 126.82 44.19 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.516 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.78 -176.671 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -102.15 165.49 11.12 Favored 'General case' 0 N--CA 1.44 -0.934 0 N-CA-C 109.891 -0.411 . . . . 0.0 109.891 179.906 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -69.22 -21.66 63.93 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-O 121.288 0.566 . . . . 0.0 111.562 -178.951 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 12.0 m-80 -98.26 1.45 47.23 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-O 121.369 0.604 . . . . 0.0 109.863 -179.803 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . 0.598 ' O ' ' HB2' ' A' ' 44' ' ' LEU . 5.2 m170 -79.85 142.32 35.36 Favored 'General case' 0 CA--C 1.505 -0.765 0 CA-C-N 116.14 -0.482 . . . . 0.0 109.948 179.933 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.447 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 66.7 p -118.51 154.5 52.36 Favored Pre-proline 0 C--N 1.304 -1.391 0 CA-C-N 116.751 -0.204 . . . . 0.0 110.637 178.514 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 24.9 Cg_exo -62.33 -37.51 60.51 Favored 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 122.429 2.086 . . . . 0.0 110.917 179.457 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . 0.544 ' HG3' ' N ' ' A' ' 79' ' ' GLU . 41.3 pttt -65.56 -43.22 90.51 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.794 -179.501 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.544 ' N ' ' HG3' ' A' ' 78' ' ' LYS . 5.9 mm-40 -70.59 -40.32 73.33 Favored 'General case' 0 CA--C 1.509 -0.628 0 CA-C-O 120.902 0.382 . . . . 0.0 111.475 -177.919 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.447 ' HG ' ' O ' ' A' ' 76' ' ' THR . 5.2 mt -74.63 -10.47 59.57 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.328 0.585 . . . . 0.0 110.282 179.971 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 81.78 44.18 7.91 Favored Glycine 0 N--CA 1.45 -0.417 0 CA-C-N 115.887 -0.597 . . . . 0.0 113.246 176.698 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 57.2 mtt -100.99 166.31 10.88 Favored 'General case' 0 C--N 1.314 -0.94 0 N-CA-C 109.489 -0.559 . . . . 0.0 109.489 178.514 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.445 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 12.8 pt-20 -135.31 -169.76 2.45 Favored 'General case' 0 C--N 1.311 -1.066 0 N-CA-C 109.662 -0.496 . . . . 0.0 109.662 177.162 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.422 ' HA ' ' HB ' ' A' ' 22' ' ' ILE . 11.3 pt-20 -73.64 143.29 46.35 Favored 'General case' 0 N--CA 1.445 -0.717 0 C-N-CA 120.306 -0.557 . . . . 0.0 110.156 179.183 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 70.25 8.91 6.84 Favored 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 123.437 0.695 . . . . 0.0 111.497 -179.935 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . 0.445 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 3.2 t0 -65.71 162.11 19.24 Favored 'General case' 0 C--O 1.24 0.562 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.155 175.893 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 11.6 p -127.54 142.81 42.59 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.443 0 CA-C-O 121.653 0.739 . . . . 0.0 111.48 -177.049 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . 0.48 ' HB ' HG22 ' A' ' 26' ' ' VAL . 3.6 mp -112.63 149.82 15.02 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.213 0 N-CA-C 107.885 -1.154 . . . . 0.0 107.885 178.288 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 20.3 tp10 -106.84 141.38 38.17 Favored 'General case' 0 C--N 1.308 -1.205 0 CA-C-O 120.958 0.409 . . . . 0.0 110.39 -175.144 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . 0.59 ' HB ' ' HA2' ' A' ' 28' ' ' GLY . 77.4 t -130.93 133.82 62.5 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.188 0 CA-C-O 120.986 0.422 . . . . 0.0 110.413 178.811 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 82.2 m-85 -117.86 173.29 6.84 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-O 120.753 0.311 . . . . 0.0 110.376 -178.566 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . 0.407 ' NE2' ' HG2' ' A' ' 29' ' ' GLN . 7.5 tp60 -103.41 133.39 48.55 Favored 'General case' 0 C--N 1.311 -1.074 0 CA-C-O 120.915 0.388 . . . . 0.0 110.966 -179.752 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -131.51 23.17 4.73 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 121.481 0.658 . . . . 0.0 110.201 176.137 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . 0.402 ' HB3' ' H ' ' A' ' 95' ' ' THR . 99.4 mt-30 -61.44 -160.92 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.813 0 CA-C-N 115.339 -0.846 . . . . 0.0 112.167 176.641 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . 0.402 ' H ' ' HB3' ' A' ' 94' ' ' GLN . 9.9 t -158.31 163.6 37.21 Favored 'General case' 0 N--CA 1.439 -0.983 0 N-CA-C 109.743 -0.466 . . . . 0.0 109.743 -177.338 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -137.28 39.65 1.6 Allowed Glycine 0 N--CA 1.441 -1.007 0 C-N-CA 120.953 -0.642 . . . . 0.0 111.88 179.419 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.44 -1.073 0 CA-C-O 118.599 -1.112 . . . . 0.0 111.475 179.257 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 19.1 ttt . . . . . 0 N--CA 1.478 0.97 0 CA-C-O 121.127 0.489 . . . . 0.0 110.573 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 69.6 m -100.02 -35.42 9.71 Favored 'General case' 0 C--N 1.328 -0.364 0 O-C-N 121.675 -0.641 . . . . 0.0 111.216 -178.782 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 10.2 p-10 -86.95 29.86 0.79 Allowed 'General case' 0 C--N 1.319 -0.736 0 CA-C-O 121.135 0.493 . . . . 0.0 110.494 -178.753 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 9.9 pt20 -160.1 152.39 20.72 Favored 'General case' 0 N--CA 1.443 -0.823 0 CA-C-O 121.243 0.544 . . . . 0.0 110.818 -175.259 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -161.51 159.65 28.15 Favored 'General case' 0 C--N 1.309 -1.189 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 176.964 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -136.64 123.83 21.76 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-O 121.101 0.477 . . . . 0.0 110.245 -178.842 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -165.26 150.5 8.23 Favored Pre-proline 0 C--N 1.312 -1.059 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.316 -178.254 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -78.16 164.79 26.64 Favored 'Trans proline' 0 N--CA 1.452 -0.933 0 C-N-CA 122.365 2.043 . . . . 0.0 111.945 179.566 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 50.0 m 46.06 78.75 0.06 Allowed 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 123.326 0.65 . . . . 0.0 112.007 -177.343 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 15.0 t -91.54 -14.08 30.96 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-O 121.371 0.605 . . . . 0.0 110.595 179.796 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -86.06 172.25 10.76 Favored 'General case' 0 N--CA 1.446 -0.67 0 N-CA-C 109.638 -0.504 . . . . 0.0 109.638 177.714 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -119.52 125.61 49.28 Favored 'General case' 0 C--N 1.31 -1.137 0 O-C-N 122.132 -0.355 . . . . 0.0 110.152 -179.333 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 2.5 pp -141.52 158.89 43.27 Favored 'General case' 0 C--N 1.308 -1.231 0 CA-C-O 121.027 0.441 . . . . 0.0 110.889 179.172 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 139.51 56.06 0.04 OUTLIER Glycine 0 C--N 1.307 -1.06 0 C-N-CA 121.018 -0.611 . . . . 0.0 112.298 178.926 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -99.17 101.47 12.81 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 121.411 0.624 . . . . 0.0 111.525 179.728 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.431 ' N ' ' HD3' ' A' ' 16' ' ' LYS . 0.0 OUTLIER -105.93 146.68 29.7 Favored 'General case' 0 C--N 1.312 -1.047 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 177.728 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.434 ' HD3' ' H ' ' A' ' 17' ' ' LYS . 0.0 OUTLIER -66.0 169.38 6.88 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 120.822 -0.351 . . . . 0.0 110.462 179.937 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -97.02 -173.98 2.84 Favored 'General case' 0 C--N 1.314 -0.951 0 N-CA-C 109.614 -0.513 . . . . 0.0 109.614 -177.692 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 179.59 -98.98 0.12 Allowed Glycine 0 N--CA 1.437 -1.287 0 C-N-CA 119.416 -1.373 . . . . 0.0 112.75 -176.768 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.483 ' O ' ' HG3' ' A' ' 39' ' ' LYS . 65.5 mm-40 -95.29 14.33 22.69 Favored 'General case' 0 C--N 1.31 -1.13 0 CA-C-O 120.785 0.326 . . . . 0.0 111.242 -177.248 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.451 ' CE1' ' HB3' ' A' ' 37' ' ' LYS . 51.6 p90 -133.13 162.57 31.38 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 112.781 0.66 . . . . 0.0 112.781 -177.63 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 22.4 pt -107.95 173.96 1.68 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.221 -0.899 . . . . 0.0 110.607 -179.168 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.421 ' HE3' ' HB2' ' A' ' 23' ' ' LYS . 31.5 mtmt -117.83 139.0 51.71 Favored 'General case' 0 C--N 1.308 -1.203 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.328 -178.106 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.4 mp -134.94 163.74 29.17 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-O 121.163 0.506 . . . . 0.0 110.816 176.704 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.478 ' NZ ' HD11 ' A' ' 27' ' ' ILE . 2.3 tmmt? -132.94 144.88 50.44 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-O 121.164 0.507 . . . . 0.0 110.344 179.878 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.615 HG23 ' HZ ' ' A' ' 36' ' ' PHE . 0.9 OUTLIER -114.83 142.3 28.16 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.286 0 CA-C-O 121.091 0.472 . . . . 0.0 111.351 179.121 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.478 HD11 ' NZ ' ' A' ' 25' ' ' LYS . 45.9 mm -104.89 112.69 39.55 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.213 0 N-CA-C 107.634 -1.247 . . . . 0.0 107.634 175.274 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -79.28 171.87 55.01 Favored Glycine 0 N--CA 1.424 -2.158 0 C-N-CA 120.447 -0.882 . . . . 0.0 112.565 -176.198 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.75 ' H ' ' NE2' ' A' ' 29' ' ' GLN . 0.0 OUTLIER -67.5 -23.01 65.42 Favored 'General case' 0 C--N 1.309 -1.183 0 CA-C-O 121.739 0.78 . . . . 0.0 109.573 179.082 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -97.83 12.42 34.01 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.315 -0.857 . . . . 0.0 109.362 177.465 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 49.5 m 70.24 15.81 7.42 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.809 -178.906 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 21.9 t -71.19 116.3 11.34 Favored 'General case' 0 N--CA 1.445 -0.677 0 CA-C-N 115.416 -0.811 . . . . 0.0 109.846 178.901 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.443 ' HA ' ' O ' ' A' ' 26' ' ' VAL . 32.4 mt-10 -89.4 108.69 19.78 Favored 'General case' 0 N--CA 1.445 -0.725 0 CA-C-O 121.226 0.536 . . . . 0.0 109.988 179.268 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 34.4 mm -97.79 138.79 21.59 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.371 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 179.4 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 13.3 m170 -116.95 129.6 56.15 Favored 'General case' 0 C--N 1.317 -0.829 0 N-CA-C 109.511 -0.551 . . . . 0.0 109.511 -178.387 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.615 ' HZ ' HG23 ' A' ' 26' ' ' VAL . 1.9 p90 -147.02 158.02 43.8 Favored 'General case' 0 C--N 1.307 -1.25 0 CA-C-O 121.477 0.656 . . . . 0.0 110.603 -179.158 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.451 ' HB3' ' CE1' ' A' ' 21' ' ' TYR . 47.1 mtmt -126.17 116.31 21.14 Favored 'General case' 0 C--N 1.301 -1.502 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.652 -178.593 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.426 HG21 HD12 ' A' ' 47' ' ' LEU . 17.6 m -132.81 163.85 36.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.525 -176.74 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.483 ' HG3' ' O ' ' A' ' 20' ' ' GLU . 84.9 tttt -85.67 160.33 19.59 Favored 'General case' 0 C--N 1.316 -0.857 0 O-C-N 121.923 -0.486 . . . . 0.0 111.413 -178.279 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -70.39 -37.18 74.45 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.031 0.444 . . . . 0.0 112.154 -177.625 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 14.5 t -90.51 9.35 29.69 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.531 -177.79 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . 0.455 HG22 ' O ' ' A' ' 39' ' ' LYS . 1.2 t -92.06 167.73 11.87 Favored 'General case' 0 C--N 1.322 -0.591 0 C-N-CA 120.03 -0.668 . . . . 0.0 110.298 -178.482 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . 0.53 ' HB3' ' HG2' ' A' ' 45' ' ' LYS . 31.9 m170 -87.93 141.65 28.41 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-O 121.51 0.671 . . . . 0.0 111.589 -179.26 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.515 ' HB2' ' O ' ' A' ' 75' ' ' HIS . 0.6 OUTLIER -65.68 -19.26 65.83 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.554 -0.748 . . . . 0.0 111.515 179.944 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.53 ' HG2' ' HB3' ' A' ' 43' ' ' HIS . 7.5 ptpt -50.82 -49.24 59.08 Favored 'General case' 0 N--CA 1.463 0.188 0 N-CA-C 112.018 0.377 . . . . 0.0 112.018 -179.167 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.6 -29.67 69.06 Favored 'General case' 0 C--O 1.207 -1.162 0 CA-C-O 120.893 0.378 . . . . 0.0 111.239 -178.847 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.426 HD12 HG21 ' A' ' 38' ' ' VAL . 8.3 tt -70.71 -47.83 57.76 Favored 'General case' 0 C--N 1.311 -1.106 0 CA-C-O 121.3 0.571 . . . . 0.0 109.608 178.29 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.519 ' HD3' ' HA ' ' A' ' 45' ' ' LYS . 30.9 mtpt -58.82 -45.9 88.88 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.204 -179.718 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.87 -30.56 65.54 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 121.282 0.563 . . . . 0.0 110.713 -179.383 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 5.6 m -68.67 -44.43 74.09 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-N 115.984 -0.553 . . . . 0.0 112.089 -179.754 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.464 ' CE2' ' HA ' ' A' ' 48' ' ' LYS . 3.0 p90 -74.59 -33.55 62.66 Favored 'General case' 0 C--N 1.324 -0.541 0 C-N-CA 119.551 -0.86 . . . . 0.0 110.178 -178.936 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . 0.586 ' SG ' HD11 ' A' ' 62' ' ' LEU . 84.2 m -59.22 -46.87 87.31 Favored 'General case' 0 C--O 1.238 0.454 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.09 178.658 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 7.1 pt20 -68.06 -32.68 73.19 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 120.526 -0.469 . . . . 0.0 110.95 -179.217 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 1.6 mmp_? -59.42 -34.58 72.66 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-O 121.062 0.458 . . . . 0.0 111.662 177.669 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.405 ' NE2' ' HA ' ' A' ' 52' ' ' CYS . 3.2 mt-30 -81.81 -20.4 39.18 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-O 121.372 0.606 . . . . 0.0 110.286 179.034 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 82.2 28.9 39.04 Favored Glycine 0 N--CA 1.443 -0.872 0 CA-C-N 115.823 -0.626 . . . . 0.0 112.02 -179.994 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 33.9 m -131.45 145.95 59.83 Favored Pre-proline 0 C--N 1.326 -0.443 0 O-C-N 122.548 -0.384 . . . . 0.0 110.74 -179.313 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . 0.446 ' HG2' ' OG ' ' A' ' 61' ' ' SER . 28.0 Cg_endo -65.05 150.49 87.88 Favored 'Trans proline' 0 C--O 1.24 0.599 0 C-N-CA 122.513 2.142 . . . . 0.0 112.228 178.505 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.524 ' HG2' ' SG ' ' A' ' 52' ' ' CYS . 77.8 mtp -66.16 -13.66 60.57 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.851 -177.849 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 30.7 p30 -84.39 -12.78 53.85 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 121.507 0.67 . . . . 0.0 110.929 -178.456 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.446 ' OG ' ' HG2' ' A' ' 58' ' ' PRO . 70.6 m -87.79 -20.42 26.15 Favored 'General case' 0 C--N 1.309 -1.176 0 N-CA-C 112.407 0.521 . . . . 0.0 112.407 -178.072 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.586 HD11 ' SG ' ' A' ' 52' ' ' CYS . 1.4 pp -127.05 171.98 10.9 Favored 'General case' 0 C--N 1.309 -1.187 0 N-CA-C 113.487 0.921 . . . . 0.0 113.487 -176.327 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.468 ' O ' ' HA ' ' A' ' 90' ' ' VAL . 46.6 mtm180 -122.88 122.45 38.66 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.25 -0.886 . . . . 0.0 110.55 -177.358 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -105.5 118.63 37.07 Favored 'General case' 0 C--N 1.313 -1.007 0 CA-C-O 121.173 0.511 . . . . 0.0 111.248 179.561 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.464 ' HA ' HG12 ' A' ' 71' ' ' ILE . 0.0 OUTLIER -146.26 164.58 31.87 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 121.41 0.624 . . . . 0.0 111.034 179.613 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 88.1 t80 -142.88 134.92 27.12 Favored 'General case' 0 C--N 1.31 -1.143 0 N-CA-C 108.978 -0.749 . . . . 0.0 108.978 179.455 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.469 ' HG2' HE21 ' A' ' 69' ' ' GLN . 5.6 pt-20 49.95 26.94 2.19 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 123.96 0.904 . . . . 0.0 112.268 -178.968 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 85.1 21.5 55.02 Favored Glycine 0 CA--C 1.523 0.534 0 C-N-CA 120.99 -0.624 . . . . 0.0 113.57 -178.598 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . 0.469 HE21 ' HG2' ' A' ' 67' ' ' GLU . 3.2 pt20 -128.23 134.91 49.07 Favored 'General case' 0 C--N 1.322 -0.622 0 O-C-N 122.245 -0.562 . . . . 0.0 109.548 179.69 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -64.52 145.01 56.78 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-O 121.677 0.751 . . . . 0.0 111.09 177.473 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.464 HG12 ' HA ' ' A' ' 65' ' ' LEU . 22.3 mm -97.15 118.11 42.99 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.29 0 CA-C-O 121.142 0.496 . . . . 0.0 110.117 179.634 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -89.67 162.55 15.54 Favored 'General case' 0 N--CA 1.437 -1.116 0 N-CA-C 109.457 -0.572 . . . . 0.0 109.457 -179.83 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . 0.441 ' HB3' ' HB3' ' A' ' 45' ' ' LYS . 67.4 m-20 -65.47 -25.43 67.49 Favored 'General case' 0 C--N 1.313 -0.993 0 CA-C-O 121.609 0.719 . . . . 0.0 110.318 179.093 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 7.4 m-80 -97.46 9.21 42.99 Favored 'General case' 0 C--N 1.312 -1.041 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.178 -179.254 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . 0.515 ' O ' ' HB2' ' A' ' 44' ' ' LEU . 2.2 m170 -84.54 141.2 30.9 Favored 'General case' 0 CA--C 1.504 -0.798 0 N-CA-C 109.398 -0.593 . . . . 0.0 109.398 179.234 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.411 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 70.7 p -118.65 154.64 52.65 Favored Pre-proline 0 C--N 1.306 -1.324 0 C-N-CA 121.099 -0.24 . . . . 0.0 110.435 -179.891 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_exo -59.99 -39.47 70.34 Favored 'Trans proline' 0 N--CA 1.457 -0.637 0 C-N-CA 122.37 2.047 . . . . 0.0 111.459 179.861 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . 0.511 ' HG3' ' N ' ' A' ' 79' ' ' GLU . 37.6 pttt -68.96 -38.53 79.45 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 120.974 0.416 . . . . 0.0 111.163 -178.463 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.511 ' N ' ' HG3' ' A' ' 78' ' ' LYS . 11.1 mm-40 -72.4 -34.07 67.61 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-O 120.994 0.426 . . . . 0.0 110.896 -178.266 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.437 HD21 ' CG ' ' A' ' 75' ' ' HIS . 5.8 mt -84.63 2.11 43.07 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.24 0.543 . . . . 0.0 111.021 179.624 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 73.84 41.2 42.5 Favored Glycine 0 C--O 1.237 0.335 0 C-N-CA 120.99 -0.624 . . . . 0.0 112.964 177.199 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 63.9 mtt -100.01 164.88 11.8 Favored 'General case' 0 C--N 1.313 -1.012 0 N-CA-C 109.233 -0.654 . . . . 0.0 109.233 178.857 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.413 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 11.5 pt-20 -144.23 -170.4 3.35 Favored 'General case' 0 C--N 1.31 -1.12 0 N-CA-C 110.096 -0.335 . . . . 0.0 110.096 178.606 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -64.44 141.53 58.74 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 120.707 0.289 . . . . 0.0 110.372 178.926 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 73.42 1.2 3.9 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 123.558 0.743 . . . . 0.0 112.211 176.814 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . 0.413 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 1.5 t70 -61.89 160.87 11.35 Favored 'General case' 0 N--CA 1.476 0.871 0 CA-C-O 121.364 0.602 . . . . 0.0 111.521 -179.546 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.411 ' HA ' ' O ' ' A' ' 25' ' ' LYS . 7.8 p -128.45 143.91 39.57 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.953 0 CA-C-O 121.429 0.633 . . . . 0.0 111.494 -177.09 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . 0.436 ' HB ' HG22 ' A' ' 26' ' ' VAL . 3.7 mp -113.2 151.92 15.0 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.802 0 N-CA-C 109.245 -0.65 . . . . 0.0 109.245 179.144 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.424 ' O ' HD13 ' A' ' 65' ' ' LEU . 6.2 tp10 -104.69 137.06 43.07 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.947 0.403 . . . . 0.0 110.47 -176.531 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . 0.468 ' HA ' ' O ' ' A' ' 63' ' ' ARG . 95.2 t -128.54 132.45 67.9 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.852 0 CA-C-O 121.282 0.563 . . . . 0.0 111.482 179.088 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 77.1 m-85 -115.0 179.17 4.03 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 178.663 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 7.9 tp60 -106.65 144.61 33.06 Favored 'General case' 0 C--N 1.311 -1.096 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 178.614 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . 0.416 ' HB3' ' HG3' ' A' ' 63' ' ' ARG . 7.4 pt-20 -131.88 17.44 4.68 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.103 0.478 . . . . 0.0 110.706 176.253 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . 0.421 HE21 ' HB3' ' A' ' 61' ' ' SER . 98.6 mt-30 -62.32 -167.92 0.02 OUTLIER 'General case' 0 C--O 1.238 0.494 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.805 177.179 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 14.8 t -170.14 -179.32 3.09 Favored 'General case' 0 N--CA 1.439 -0.986 0 O-C-N 121.406 -0.809 . . . . 0.0 110.184 -175.807 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -156.93 -36.7 0.02 OUTLIER Glycine 0 N--CA 1.441 -1.013 0 N-CA-C 110.831 -0.908 . . . . 0.0 110.831 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.431 -1.633 0 N-CA-C 110.68 -0.968 . . . . 0.0 110.68 179.303 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.6 ptm . . . . . 0 N--CA 1.484 1.232 0 CA-C-O 120.925 0.393 . . . . 0.0 111.388 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 22.7 t -72.61 -72.02 0.26 Allowed 'General case' 0 C--N 1.318 -0.796 0 O-C-N 122.254 -0.279 . . . . 0.0 111.586 -178.008 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -117.23 -25.68 7.01 Favored 'General case' 0 C--N 1.326 -0.422 0 O-C-N 121.769 -0.582 . . . . 0.0 112.275 -177.355 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.548 ' C ' HE21 ' A' ' 4' ' ' GLN . 0.0 OUTLIER -96.07 177.41 5.75 Favored 'General case' 0 C--N 1.308 -1.233 0 CA-C-O 120.959 0.409 . . . . 0.0 111.979 -178.535 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -64.47 -176.48 0.24 Allowed 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 123.326 0.651 . . . . 0.0 112.288 -179.126 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -162.31 151.03 15.0 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.127 -178.283 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.458 ' HA ' ' HD3' ' A' ' 8' ' ' PRO . 75.5 mmtt -126.06 130.91 23.85 Favored Pre-proline 0 N--CA 1.445 -0.723 0 O-C-N 122.294 -0.254 . . . . 0.0 110.452 179.32 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.458 ' HD3' ' HA ' ' A' ' 7' ' ' LYS . 6.9 Cg_exo -71.11 -63.18 0.04 OUTLIER 'Trans proline' 0 N--CA 1.462 -0.328 0 C-N-CA 122.823 2.349 . . . . 0.0 111.514 178.334 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 40.1 m -139.5 -175.88 4.35 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 178.9 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 23.6 m -49.58 107.18 0.13 Allowed 'General case' 0 CA--C 1.529 0.172 0 CA-C-O 121.066 0.46 . . . . 0.0 110.884 177.419 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . 0.405 ' O ' ' HB2' ' A' ' 15' ' ' ASP . 12.8 tt0 -73.42 117.02 14.67 Favored 'General case' 0 N--CA 1.444 -0.738 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.107 -178.585 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -80.19 -72.78 0.39 Allowed 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 112.803 0.668 . . . . 0.0 112.803 -175.462 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.476 HD12 ' N ' ' A' ' 14' ' ' GLY . 4.0 pp -71.74 -29.0 64.04 Favored 'General case' 0 CA--C 1.51 -0.56 0 N-CA-C 112.537 0.569 . . . . 0.0 112.537 -177.023 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.476 ' N ' HD12 ' A' ' 13' ' ' LEU . . . -99.91 34.04 5.8 Favored Glycine 0 C--N 1.302 -1.359 0 C-N-CA 120.304 -0.95 . . . . 0.0 112.736 -179.561 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.405 ' HB2' ' O ' ' A' ' 11' ' ' GLU . 18.4 t70 -78.42 140.16 38.69 Favored 'General case' 0 C--N 1.319 -0.749 0 O-C-N 122.309 -0.524 . . . . 0.0 111.538 -179.092 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 2.8 mptp? -120.72 172.61 7.75 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.083 0.468 . . . . 0.0 110.082 177.741 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 14.2 ptmm? -161.33 174.99 12.73 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-O 121.065 0.459 . . . . 0.0 110.178 177.821 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.541 ' HB2' ' CE1' ' A' ' 21' ' ' TYR . 0.1 OUTLIER -96.33 -172.26 2.49 Favored 'General case' 0 C--N 1.311 -1.078 0 N-CA-C 109.708 -0.478 . . . . 0.0 109.708 178.753 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 127.44 119.55 2.25 Favored Glycine 0 N--CA 1.446 -0.686 0 C-N-CA 120.619 -0.8 . . . . 0.0 112.466 179.417 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.456 ' O ' ' HG3' ' A' ' 39' ' ' LYS . 44.6 mt-10 68.28 48.17 0.92 Allowed 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 121.445 0.64 . . . . 0.0 110.708 178.27 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.541 ' CE1' ' HB2' ' A' ' 18' ' ' GLU . 30.9 p90 -126.03 161.33 27.81 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-O 121.534 0.683 . . . . 0.0 111.497 -178.332 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.408 ' HB ' ' HA ' ' A' ' 84' ' ' GLU . 18.5 pt -118.45 172.59 5.64 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.041 0 CA-C-N 115.419 -0.809 . . . . 0.0 110.427 -179.395 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 31.5 mtmt -116.98 142.37 47.03 Favored 'General case' 0 C--N 1.299 -1.618 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 -179.04 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.0 mp -136.79 164.71 27.63 Favored 'General case' 0 C--N 1.308 -1.198 0 CA-C-O 121.187 0.518 . . . . 0.0 110.713 175.218 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.407 ' HE2' ' HB3' ' A' ' 25' ' ' LYS . 5.3 tmmm? -136.79 143.18 43.05 Favored 'General case' 0 C--N 1.313 -1.003 0 CA-C-O 121.254 0.55 . . . . 0.0 110.544 -178.982 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.558 HG23 ' HZ ' ' A' ' 36' ' ' PHE . 1.0 OUTLIER -114.62 142.16 28.42 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.251 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.651 -179.647 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.45 HD13 ' HG2' ' A' ' 33' ' ' GLU . 32.9 mm -111.05 97.59 5.94 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.007 0 N-CA-C 108.117 -1.068 . . . . 0.0 108.117 175.752 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . 0.592 ' HA2' ' HB ' ' A' ' 90' ' ' VAL . . . -65.86 167.74 33.76 Favored Glycine 0 N--CA 1.437 -1.286 0 C-N-CA 120.506 -0.854 . . . . 0.0 113.127 178.924 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.22 -18.8 28.8 Favored 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 112.586 0.587 . . . . 0.0 112.586 177.753 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -102.76 13.49 34.28 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-O 121.519 0.676 . . . . 0.0 109.932 179.861 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 49.7 m 73.68 21.38 2.81 Favored 'General case' 0 CA--C 1.509 -0.617 0 CA-C-O 122.629 1.204 . . . . 0.0 108.39 -178.508 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -67.68 96.14 0.53 Allowed 'General case' 0 N--CA 1.424 -1.745 0 CA-C-N 113.362 -1.744 . . . . 0.0 111.474 -178.641 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.483 ' HA ' ' O ' ' A' ' 26' ' ' VAL . 15.0 mt-10 -78.74 104.32 9.28 Favored 'General case' 0 CA--C 1.496 -1.107 0 CA-C-O 121.138 0.494 . . . . 0.0 110.69 177.447 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.532 HG21 ' HA ' ' A' ' 51' ' ' TYR . 33.1 mm -97.67 132.58 42.14 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.319 0 N-CA-C 108.159 -1.052 . . . . 0.0 108.159 175.457 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 12.4 m170 -116.92 121.95 42.91 Favored 'General case' 0 C--N 1.317 -0.823 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 -176.958 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.558 ' HZ ' HG23 ' A' ' 26' ' ' VAL . 1.5 p90 -137.93 162.26 34.5 Favored 'General case' 0 C--N 1.308 -1.225 0 CA-C-O 121.379 0.609 . . . . 0.0 111.292 -177.38 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.42 ' HE2' ' HE2' ' A' ' 21' ' ' TYR . 15.5 mtpt -124.38 115.84 21.61 Favored 'General case' 0 C--N 1.313 -0.979 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.646 -178.793 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 32.8 m -134.03 166.48 28.75 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.435 0 CA-C-O 121.073 0.463 . . . . 0.0 110.735 -178.296 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.515 ' O ' HG22 ' A' ' 42' ' ' THR . 84.2 tttt -89.65 167.85 12.59 Favored 'General case' 0 C--N 1.313 -1.021 0 O-C-N 122.035 -0.416 . . . . 0.0 110.538 -178.541 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -79.11 -37.12 39.48 Favored 'General case' 0 N--CA 1.464 0.26 0 N-CA-C 112.626 0.602 . . . . 0.0 112.626 -178.131 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 13.5 t -93.84 19.86 8.36 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-O 121.079 0.466 . . . . 0.0 111.688 -176.682 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . 0.515 HG22 ' O ' ' A' ' 39' ' ' LYS . 6.7 t -99.76 173.28 6.77 Favored 'General case' 0 C--N 1.32 -0.708 0 O-C-N 122.006 -0.434 . . . . 0.0 109.961 179.844 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 29.8 m170 -88.04 142.31 27.88 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-O 121.491 0.662 . . . . 0.0 111.354 179.116 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.599 ' O ' ' HG3' ' A' ' 48' ' ' LYS . 0.2 OUTLIER -69.92 -18.34 63.37 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.54 -0.755 . . . . 0.0 109.725 -179.19 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.676 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -53.89 -44.71 70.71 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-N 115.849 -0.614 . . . . 0.0 112.305 -177.932 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.484 ' N ' ' HD3' ' A' ' 45' ' ' LYS . 21.8 ptmt -67.41 -28.17 67.69 Favored 'General case' 0 CA--C 1.517 -0.29 0 CA-C-O 121.449 0.643 . . . . 0.0 110.538 -178.156 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.538 ' HB3' HD13 ' A' ' 44' ' ' LEU . 7.9 tt -72.08 -47.44 51.39 Favored 'General case' 0 C--N 1.313 -1.01 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.886 179.083 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.599 ' HG3' ' O ' ' A' ' 44' ' ' LEU . 29.5 mtpt -58.69 -48.3 81.59 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.419 -179.233 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.676 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 5.6 pt-20 -68.83 -31.9 71.21 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.709 -179.281 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.401 ' O ' ' HG2' ' A' ' 54' ' ' ARG . 28.8 t -67.44 -46.11 74.07 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-O 121.028 0.442 . . . . 0.0 111.234 -178.998 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.532 ' HA ' HG21 ' A' ' 34' ' ' ILE . 2.0 p90 -75.83 -32.78 59.95 Favored 'General case' 0 N--CA 1.445 -0.683 0 C-N-CA 119.801 -0.76 . . . . 0.0 110.544 -177.217 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . 0.547 ' SG ' ' HG2' ' A' ' 59' ' ' MET . 86.8 m -62.58 -44.41 96.38 Favored 'General case' 0 C--O 1.238 0.489 0 CA-C-O 120.85 0.357 . . . . 0.0 110.792 179.163 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 11.8 pt20 -67.96 -32.97 73.77 Favored 'General case' 0 N--CA 1.447 -0.585 0 C-N-CA 120.668 -0.413 . . . . 0.0 110.527 -179.828 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.401 ' HG2' ' O ' ' A' ' 50' ' ' SER . 15.9 mmt180 -57.78 -45.07 86.49 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-O 121.292 0.568 . . . . 0.0 111.115 177.433 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.449 ' NE2' ' HA ' ' A' ' 52' ' ' CYS . 3.2 mt-30 -71.36 -20.62 62.14 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.629 179.441 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 79.98 30.51 42.52 Favored Glycine 0 N--CA 1.441 -1.03 0 C-N-CA 120.861 -0.685 . . . . 0.0 111.558 -179.774 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 25.9 m -129.21 152.79 80.01 Favored Pre-proline 0 C--N 1.323 -0.555 0 O-C-N 122.502 -0.411 . . . . 0.0 110.723 -178.592 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . 0.431 ' HG2' ' OG ' ' A' ' 61' ' ' SER . 43.2 Cg_endo -71.45 150.61 58.27 Favored 'Trans proline' 0 N--CA 1.455 -0.772 0 C-N-CA 122.347 2.031 . . . . 0.0 111.903 177.538 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.547 ' HG2' ' SG ' ' A' ' 52' ' ' CYS . 79.8 mtp -70.37 -9.93 57.63 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.451 -177.443 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 33.6 p30 -84.52 -16.4 42.46 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.241 0.543 . . . . 0.0 111.365 -179.244 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.431 ' OG ' ' HG2' ' A' ' 58' ' ' PRO . 69.2 m -89.72 -20.63 23.36 Favored 'General case' 0 C--N 1.311 -1.101 0 N-CA-C 112.877 0.695 . . . . 0.0 112.877 -175.367 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.475 HD11 ' SG ' ' A' ' 52' ' ' CYS . 1.4 pp -124.09 170.95 10.17 Favored 'General case' 0 C--N 1.306 -1.309 0 N-CA-C 112.945 0.72 . . . . 0.0 112.945 -177.446 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.479 ' O ' ' HA ' ' A' ' 90' ' ' VAL . 47.2 mtm180 -121.66 120.76 35.67 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.674 -0.693 . . . . 0.0 110.844 -177.099 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -102.64 115.33 30.36 Favored 'General case' 0 C--N 1.311 -1.105 0 CA-C-O 121.084 0.469 . . . . 0.0 111.024 179.166 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.462 ' C ' HD22 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -144.38 164.15 31.67 Favored 'General case' 0 N--CA 1.445 -0.688 0 CA-C-O 121.469 0.652 . . . . 0.0 111.238 -179.769 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 83.2 t80 -143.62 134.15 24.88 Favored 'General case' 0 C--N 1.309 -1.192 0 N-CA-C 109.565 -0.532 . . . . 0.0 109.565 179.192 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.417 ' HG2' HE21 ' A' ' 69' ' ' GLN . 6.9 pt-20 49.91 26.86 2.13 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 124.214 1.006 . . . . 0.0 112.75 -179.99 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 87.45 20.89 50.44 Favored Glycine 0 N--CA 1.447 -0.613 0 C-N-CA 120.949 -0.643 . . . . 0.0 113.211 -179.596 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . 0.417 HE21 ' HG2' ' A' ' 67' ' ' GLU . 2.9 pt20 -128.55 134.34 48.62 Favored 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 108.766 -0.827 . . . . 0.0 108.766 179.181 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.443 ' HE ' ' HB2' ' A' ' 70' ' ' ARG . 0.0 OUTLIER -72.44 144.95 47.94 Favored 'General case' 0 C--N 1.309 -1.157 0 O-C-N 121.66 -0.65 . . . . 0.0 110.706 179.349 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.417 HG21 HD12 ' A' ' 44' ' ' LEU . 22.3 mm -91.44 121.61 42.06 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.243 0 CA-C-O 121.321 0.582 . . . . 0.0 110.791 -178.276 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.423 ' O ' ' HB2' ' A' ' 75' ' ' HIS . . . -94.47 162.2 13.91 Favored 'General case' 0 N--CA 1.435 -1.18 0 N-CA-C 109.384 -0.598 . . . . 0.0 109.384 179.185 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 46.4 m-20 -69.42 -26.28 64.54 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-O 121.435 0.636 . . . . 0.0 110.558 -178.986 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 5.5 m-80 -93.19 4.72 53.52 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-O 121.311 0.577 . . . . 0.0 109.655 -178.763 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . 0.598 ' O ' ' HB2' ' A' ' 44' ' ' LEU . 8.4 m170 -83.13 146.22 28.78 Favored 'General case' 0 CA--C 1.496 -1.099 0 CA-C-N 116.222 -0.444 . . . . 0.0 109.906 -179.349 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 57.3 p -120.86 154.42 57.58 Favored Pre-proline 0 C--N 1.304 -1.412 0 C-N-CA 120.815 -0.354 . . . . 0.0 111.209 178.894 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -58.93 -39.72 78.38 Favored 'Trans proline' 0 C--N 1.348 0.508 0 C-N-CA 122.673 2.249 . . . . 0.0 111.758 179.334 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . 0.493 ' HG3' ' N ' ' A' ' 79' ' ' GLU . 29.0 pttt -68.92 -36.37 77.92 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.208 0.528 . . . . 0.0 110.792 -178.301 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.493 ' N ' ' HG3' ' A' ' 78' ' ' LYS . 33.5 mm-40 -72.38 -41.16 66.64 Favored 'General case' 0 N--CA 1.444 -0.74 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.903 -179.124 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 5.5 mt -78.35 -3.51 43.43 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.084 0.468 . . . . 0.0 111.402 -179.011 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 78.14 45.0 10.63 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 121.001 -0.619 . . . . 0.0 112.858 177.153 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 61.0 mtt -105.05 164.98 11.4 Favored 'General case' 0 C--N 1.313 -1.019 0 N-CA-C 110.008 -0.367 . . . . 0.0 110.008 179.162 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -145.21 -169.64 3.25 Favored 'General case' 0 C--N 1.314 -0.97 0 N-CA-C 109.915 -0.402 . . . . 0.0 109.915 177.54 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.408 ' HA ' ' HB ' ' A' ' 22' ' ' ILE . 13.9 pt-20 -70.54 139.67 51.6 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 121.117 0.484 . . . . 0.0 110.98 -179.63 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 75.43 2.46 3.84 Favored 'General case' 0 C--O 1.239 0.531 0 C-N-CA 124.487 1.115 . . . . 0.0 111.266 179.969 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 7.9 t0 -62.34 157.54 19.57 Favored 'General case' 0 C--O 1.239 0.51 0 CA-C-O 121.37 0.605 . . . . 0.0 110.639 177.9 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 7.7 p -125.45 142.94 40.7 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.231 0 CA-C-O 121.457 0.646 . . . . 0.0 111.533 -176.485 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 3.6 mp -113.15 152.05 14.93 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.924 0 N-CA-C 108.809 -0.811 . . . . 0.0 108.809 178.704 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.4 ' O ' HD13 ' A' ' 65' ' ' LEU . 13.8 tp10 -106.61 139.3 41.28 Favored 'General case' 0 C--N 1.314 -0.962 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 -176.4 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . 0.592 ' HB ' ' HA2' ' A' ' 28' ' ' GLY . 88.0 t -130.61 136.08 59.07 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.084 0 CA-C-O 121.358 0.599 . . . . 0.0 110.747 178.694 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 88.2 m-85 -120.39 -178.9 3.8 Favored 'General case' 0 C--N 1.311 -1.099 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 178.813 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 7.5 tp60 -105.76 148.96 26.89 Favored 'General case' 0 C--N 1.307 -1.247 0 N-CA-C 109.512 -0.551 . . . . 0.0 109.512 178.559 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -137.37 17.91 2.94 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-O 121.053 0.454 . . . . 0.0 111.076 175.975 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . 0.411 HE21 ' HB3' ' A' ' 61' ' ' SER . 98.6 mt-30 -60.57 -164.01 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.732 0 CA-C-O 121.747 0.784 . . . . 0.0 112.588 178.647 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 10.4 t -158.41 165.53 34.46 Favored 'General case' 0 N--CA 1.444 -0.763 0 O-C-N 121.766 -0.584 . . . . 0.0 109.847 -175.444 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -113.27 111.11 2.63 Favored Glycine 0 N--CA 1.441 -0.972 0 C-N-CA 120.682 -0.77 . . . . 0.0 111.852 179.235 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.442 -0.943 0 CA-C-O 119.044 -0.864 . . . . 0.0 111.591 179.977 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 28.4 ttt . . . . . 0 N--CA 1.474 0.735 0 CA-C-O 121.323 0.582 . . . . 0.0 110.984 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 45.8 m -123.97 -59.68 1.49 Allowed 'General case' 0 C--N 1.315 -0.917 0 CA-C-O 121.188 0.518 . . . . 0.0 110.022 177.068 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -109.87 -40.95 4.63 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 121.865 0.84 . . . . 0.0 109.356 177.401 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 9.0 pt20 -66.22 136.85 56.45 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-N 114.743 -1.117 . . . . 0.0 112.684 -176.592 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -121.36 160.42 24.07 Favored 'General case' 0 C--N 1.313 -1.001 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 174.695 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -138.9 125.61 20.8 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-O 121.25 0.548 . . . . 0.0 110.989 -179.022 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.426 ' HD3' ' O ' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -158.6 134.55 6.15 Favored Pre-proline 0 C--N 1.314 -0.958 0 CA-C-N 115.791 -0.641 . . . . 0.0 110.624 -179.056 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_exo -56.17 119.94 7.46 Favored 'Trans proline' 0 C--O 1.235 0.365 0 C-N-CA 122.892 2.395 . . . . 0.0 112.774 179.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 48.2 m -163.03 151.91 14.64 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.226 178.935 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 40.5 m 62.9 88.56 0.09 Allowed 'General case' 0 CA--C 1.536 0.42 0 CA-C-O 121.652 0.739 . . . . 0.0 111.824 179.112 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -110.12 115.27 29.44 Favored 'General case' 0 C--N 1.308 -1.198 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 178.427 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -119.95 105.11 10.75 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-O 120.986 0.422 . . . . 0.0 110.552 -178.893 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.425 ' O ' HD12 ' A' ' 13' ' ' LEU . 4.0 pp -151.5 150.74 30.73 Favored 'General case' 0 N--CA 1.437 -1.107 0 CA-C-O 121.296 0.569 . . . . 0.0 110.78 176.757 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 116.83 13.04 8.11 Favored Glycine 0 C--N 1.302 -1.312 0 CA-C-N 115.478 -0.783 . . . . 0.0 111.871 178.402 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 37.6 t70 -76.52 130.56 38.1 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-O 121.158 0.504 . . . . 0.0 109.962 179.344 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 12.5 ptpt -155.16 -164.74 1.85 Allowed 'General case' 0 C--N 1.307 -1.269 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.335 -176.311 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 7.9 ptpt -53.9 159.52 1.7 Allowed 'General case' 0 C--O 1.236 0.382 0 CA-C-O 122.206 1.003 . . . . 0.0 112.642 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.486 ' HB2' ' CE1' ' A' ' 21' ' ' TYR . 7.3 pt-20 -77.54 95.32 4.49 Favored 'General case' 0 C--N 1.305 -1.364 0 CA-C-N 114.66 -1.154 . . . . 0.0 112.947 -178.878 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -144.06 132.55 4.91 Favored Glycine 0 C--N 1.309 -0.946 0 N-CA-C 111.531 -0.628 . . . . 0.0 111.531 174.351 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 63.04 38.08 11.18 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-O 121.803 0.811 . . . . 0.0 110.063 -179.302 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.486 ' CE1' ' HB2' ' A' ' 18' ' ' GLU . 39.5 p90 -106.62 177.05 4.97 Favored 'General case' 0 C--N 1.311 -1.084 0 CA-C-N 115.256 -0.884 . . . . 0.0 110.028 -178.66 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.455 ' HB ' ' HA ' ' A' ' 84' ' ' GLU . 18.6 pt -126.34 171.75 14.53 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.279 0 CA-C-O 121.305 0.574 . . . . 0.0 109.775 178.334 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 9.1 mtmt -118.27 140.57 49.61 Favored 'General case' 0 C--N 1.298 -1.667 0 N-CA-C 109.152 -0.684 . . . . 0.0 109.152 -178.387 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.5 mp -137.04 162.28 33.75 Favored 'General case' 0 C--N 1.305 -1.36 0 CA-C-O 121.354 0.597 . . . . 0.0 110.827 176.375 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.47 ' HG3' ' CD2' ' A' ' 35' ' ' HIS . 3.7 tmmt? -134.68 143.73 47.39 Favored 'General case' 0 C--N 1.308 -1.235 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.396 179.974 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.608 HG11 ' CD1' ' A' ' 51' ' ' TYR . 0.9 OUTLIER -114.29 141.13 31.71 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.538 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.3 178.576 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 32.0 mm -111.43 99.22 8.24 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.025 0 N-CA-C 108.403 -0.962 . . . . 0.0 108.403 175.414 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . 0.56 ' HA2' ' HB ' ' A' ' 90' ' ' VAL . . . -66.0 164.24 40.11 Favored Glycine 0 N--CA 1.424 -2.162 0 C-N-CA 120.63 -0.795 . . . . 0.0 113.625 179.124 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.41 ' HG3' ' H ' ' A' ' 29' ' ' GLN . 0.0 OUTLIER -62.06 -23.72 66.65 Favored 'General case' 0 C--N 1.308 -1.207 0 C-N-CA 123.785 0.834 . . . . 0.0 110.528 177.902 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -91.78 11.55 24.31 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.279 -0.873 . . . . 0.0 109.518 179.197 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 48.0 m 70.17 14.98 7.63 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-O 121.785 0.802 . . . . 0.0 110.319 -179.254 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 8.4 t -73.34 103.86 4.16 Favored 'General case' 0 N--CA 1.443 -0.801 0 CA-C-N 115.082 -0.963 . . . . 0.0 110.469 179.397 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.46 ' HA ' ' O ' ' A' ' 26' ' ' VAL . 1.3 mp0 -85.11 107.47 17.21 Favored 'General case' 0 CA--C 1.511 -0.543 0 CA-C-O 121.246 0.546 . . . . 0.0 109.981 178.834 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.423 HG21 ' HA ' ' A' ' 51' ' ' TYR . 29.8 mm -100.42 138.75 23.71 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.283 0 N-CA-C 109.72 -0.474 . . . . 0.0 109.72 -179.194 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . 0.47 ' CD2' ' HG3' ' A' ' 25' ' ' LYS . 11.6 m170 -118.38 131.38 56.3 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 -179.305 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.508 ' HZ ' HG23 ' A' ' 26' ' ' VAL . 1.1 p90 -146.91 151.08 36.46 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-O 121.207 0.527 . . . . 0.0 111.305 -177.38 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 41.9 mmtm -108.78 119.61 40.05 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 -179.558 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 35.6 m -137.37 161.04 35.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-O 121.397 0.618 . . . . 0.0 111.331 -179.167 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.481 ' O ' HG22 ' A' ' 42' ' ' THR . 10.5 mmmt -83.28 161.12 21.56 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.78 178.896 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -74.71 -36.27 62.71 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-O 121.001 0.429 . . . . 0.0 111.319 179.833 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 8.5 t -94.19 10.76 32.65 Favored 'General case' 0 N--CA 1.443 -0.803 0 CA-C-O 121.405 0.621 . . . . 0.0 111.766 -177.085 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . 0.481 HG22 ' O ' ' A' ' 39' ' ' LYS . 2.0 t -92.48 169.09 10.82 Favored 'General case' 0 C--N 1.323 -0.55 0 O-C-N 121.688 -0.633 . . . . 0.0 109.862 -178.857 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 27.9 m170 -82.77 141.89 32.0 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-O 121.483 0.659 . . . . 0.0 111.821 -179.795 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.645 ' O ' ' HG3' ' A' ' 48' ' ' LYS . 0.2 OUTLIER -70.48 -18.14 62.97 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 115.421 -0.808 . . . . 0.0 109.922 -179.662 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.669 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -52.32 -45.31 65.55 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.068 -0.514 . . . . 0.0 112.117 -178.467 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.42 ' N ' ' HD3' ' A' ' 45' ' ' LYS . 16.3 ptmt -65.63 -29.59 70.18 Favored 'General case' 0 C--O 1.218 -0.581 0 CA-C-O 121.42 0.629 . . . . 0.0 110.47 -178.066 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.599 ' HB3' HD13 ' A' ' 44' ' ' LEU . 7.9 tt -73.86 -45.7 49.42 Favored 'General case' 0 C--N 1.309 -1.188 0 CA-C-N 115.481 -0.781 . . . . 0.0 109.716 179.939 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.645 ' HG3' ' O ' ' A' ' 44' ' ' LEU . 26.9 mtpt -58.7 -50.17 74.86 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-O 121.38 0.609 . . . . 0.0 110.156 -179.15 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.669 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 8.3 pt-20 -68.33 -33.76 74.89 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.865 -178.294 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 31.3 t -65.46 -46.74 78.65 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-O 121.201 0.524 . . . . 0.0 111.341 -178.674 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.608 ' CD1' HG11 ' A' ' 26' ' ' VAL . 1.6 p90 -76.43 -33.14 58.79 Favored 'General case' 0 N--CA 1.441 -0.878 0 C-N-CA 120.061 -0.656 . . . . 0.0 110.541 -176.836 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . 0.502 ' SG ' HD11 ' A' ' 62' ' ' LEU . 88.1 m -62.36 -45.36 93.53 Favored 'General case' 0 CA--C 1.509 -0.609 0 CA-C-O 121.098 0.475 . . . . 0.0 110.674 -179.97 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 13.5 pt20 -69.49 -32.36 71.19 Favored 'General case' 0 N--CA 1.441 -0.908 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.545 -179.269 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 30.8 mmt180 -57.2 -40.48 77.52 Favored 'General case' 0 C--N 1.342 0.278 0 CA-C-O 121.25 0.548 . . . . 0.0 110.834 176.937 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 3.0 mt-30 -78.25 -21.04 50.5 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.874 179.616 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 80.73 34.03 28.94 Favored Glycine 0 N--CA 1.443 -0.883 0 C-N-CA 120.946 -0.645 . . . . 0.0 112.163 179.705 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 34.7 m -134.25 150.44 74.07 Favored Pre-proline 0 C--N 1.325 -0.469 0 O-C-N 122.567 -0.373 . . . . 0.0 110.553 -179.918 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . 0.49 ' HG2' ' OG ' ' A' ' 61' ' ' SER . 37.1 Cg_endo -66.8 150.18 83.37 Favored 'Trans proline' 0 C--O 1.239 0.56 0 C-N-CA 122.496 2.131 . . . . 0.0 112.354 179.243 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.469 ' HG2' ' SG ' ' A' ' 52' ' ' CYS . 78.2 mtp -70.39 -14.32 62.51 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.396 -177.163 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 2.0 p-10 -88.73 -9.16 52.91 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-O 121.031 0.443 . . . . 0.0 111.899 -178.547 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.49 ' OG ' ' HG2' ' A' ' 58' ' ' PRO . 73.1 m -94.2 -16.51 23.61 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 112.195 0.442 . . . . 0.0 112.195 179.67 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.502 HD11 ' SG ' ' A' ' 52' ' ' CYS . 1.3 pp -125.44 162.49 24.72 Favored 'General case' 0 C--N 1.315 -0.896 0 N-CA-C 113.056 0.762 . . . . 0.0 113.056 -178.796 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.555 ' HB2' ' HB2' ' A' ' 91' ' ' TYR . 3.2 mmp_? -109.19 118.4 36.64 Favored 'General case' 0 C--N 1.311 -1.07 0 CA-C-N 115.078 -0.965 . . . . 0.0 110.801 -177.876 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.432 ' HB3' ' OH ' ' A' ' 51' ' ' TYR . 0.2 OUTLIER -102.54 113.05 26.08 Favored 'General case' 0 C--N 1.304 -1.372 0 CA-C-O 121.102 0.477 . . . . 0.0 110.388 176.044 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.454 ' C ' HD22 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -142.67 163.6 32.38 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-O 121.555 0.693 . . . . 0.0 111.231 -179.226 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 89.7 t80 -143.41 134.48 25.64 Favored 'General case' 0 C--N 1.309 -1.173 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 179.323 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.457 ' HG2' HE21 ' A' ' 69' ' ' GLN . 8.4 pt-20 49.25 27.59 1.92 Allowed 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 124.04 0.936 . . . . 0.0 112.421 -179.51 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 85.64 22.28 50.88 Favored Glycine 0 CA--C 1.521 0.461 0 C-N-CA 121.069 -0.586 . . . . 0.0 113.167 -179.676 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . 0.457 HE21 ' HG2' ' A' ' 67' ' ' GLU . 2.9 pt20 -129.81 135.67 48.69 Favored 'General case' 0 C--N 1.323 -0.556 0 O-C-N 122.235 -0.567 . . . . 0.0 109.697 179.887 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -64.8 148.31 51.51 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-O 121.55 0.691 . . . . 0.0 110.988 177.764 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.459 HG21 HD12 ' A' ' 44' ' ' LEU . 22.6 mm -100.0 117.3 44.98 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.407 0 CA-C-O 121.101 0.476 . . . . 0.0 109.954 178.435 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.432 ' O ' ' HB2' ' A' ' 75' ' ' HIS . . . -93.79 163.77 13.39 Favored 'General case' 0 N--CA 1.436 -1.137 0 N-CA-C 109.755 -0.461 . . . . 0.0 109.755 -179.898 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 26.4 m-20 -69.82 -24.52 63.48 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-O 121.354 0.597 . . . . 0.0 111.064 -178.141 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 7.1 m-80 -95.38 5.56 51.31 Favored 'General case' 0 C--N 1.313 -1.001 0 CA-C-O 121.414 0.626 . . . . 0.0 109.42 -179.802 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . 0.56 ' O ' ' HB2' ' A' ' 44' ' ' LEU . 2.3 m170 -84.08 147.28 27.46 Favored 'General case' 0 CA--C 1.503 -0.853 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 -179.874 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.466 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 68.7 p -123.07 155.15 64.7 Favored Pre-proline 0 C--N 1.306 -1.316 0 CA-C-O 120.548 0.213 . . . . 0.0 110.949 179.255 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_exo -59.96 -38.62 77.43 Favored 'Trans proline' 0 N--CA 1.458 -0.581 0 C-N-CA 122.435 2.09 . . . . 0.0 111.277 178.724 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . 0.519 ' HG3' ' N ' ' A' ' 79' ' ' GLU . 33.7 pttt -67.09 -40.1 86.89 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.232 -178.663 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.519 ' N ' ' HG3' ' A' ' 78' ' ' LYS . 65.7 mm-40 -72.88 -36.85 67.43 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-O 121.178 0.513 . . . . 0.0 110.937 -178.763 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.466 ' HG ' ' O ' ' A' ' 76' ' ' THR . 5.4 mt -79.64 -3.02 45.31 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.198 0.523 . . . . 0.0 110.895 -179.651 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 75.51 42.16 27.97 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 121.145 -0.55 . . . . 0.0 112.9 177.635 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 64.0 mtt -99.78 162.75 12.81 Favored 'General case' 0 C--N 1.312 -1.054 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 179.111 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.525 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 11.3 pt-20 -142.42 -170.42 3.18 Favored 'General case' 0 C--N 1.31 -1.115 0 N-CA-C 109.975 -0.38 . . . . 0.0 109.975 177.641 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.455 ' HA ' ' HB ' ' A' ' 22' ' ' ILE . 11.3 pt-20 -70.65 143.84 51.29 Favored 'General case' 0 N--CA 1.441 -0.886 0 C-N-CA 120.121 -0.631 . . . . 0.0 110.644 -179.132 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 74.51 3.0 4.22 Favored 'General case' 0 C--N 1.322 -0.587 0 C-N-CA 124.078 0.951 . . . . 0.0 111.192 178.818 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . 0.525 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 1.8 t0 -63.11 158.48 19.64 Favored 'General case' 0 CA--C 1.513 -0.463 0 CA-C-O 121.325 0.584 . . . . 0.0 110.727 178.452 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 9.3 p -127.66 144.25 38.1 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.539 0 CA-C-O 121.351 0.595 . . . . 0.0 111.077 -177.496 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . 0.444 ' HB ' HG22 ' A' ' 26' ' ' VAL . 3.6 mp -112.24 149.91 14.66 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.066 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 178.129 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.419 ' O ' HD13 ' A' ' 65' ' ' LEU . 8.9 tp10 -104.72 137.52 42.41 Favored 'General case' 0 C--N 1.312 -1.041 0 N-CA-C 109.611 -0.514 . . . . 0.0 109.611 -176.001 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . 0.56 ' HB ' ' HA2' ' A' ' 28' ' ' GLY . 65.3 t -126.12 131.9 71.13 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.895 0 CA-C-O 121.186 0.517 . . . . 0.0 111.08 178.81 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . 0.555 ' HB2' ' HB2' ' A' ' 63' ' ' ARG . 67.3 m-85 -114.18 176.15 5.16 Favored 'General case' 0 C--N 1.315 -0.909 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 179.644 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 10.4 tp60 -109.19 130.49 55.49 Favored 'General case' 0 C--N 1.304 -1.392 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 179.513 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -118.49 17.52 13.71 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 121.207 0.527 . . . . 0.0 110.45 178.038 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . 0.455 ' CG ' ' HB3' ' A' ' 61' ' ' SER . 99.5 mt-30 -64.36 -168.66 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.592 177.416 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 12.8 t -174.98 -174.64 0.79 Allowed 'General case' 0 C--N 1.317 -0.818 0 O-C-N 121.373 -0.829 . . . . 0.0 109.938 -174.711 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -103.53 -35.73 3.48 Favored Glycine 0 N--CA 1.437 -1.29 0 C-N-CA 121.03 -0.605 . . . . 0.0 111.603 179.783 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.439 -1.134 0 CA-C-O 118.466 -1.186 . . . . 0.0 111.335 -179.676 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.545 ' HA ' ' NE2' ' A' ' 4' ' ' GLN . 11.9 mmt . . . . . 0 N--CA 1.484 1.264 0 CA-C-O 120.94 0.4 . . . . 0.0 111.712 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 31.4 t -107.97 -15.62 14.49 Favored 'General case' 0 C--N 1.309 -1.187 0 CA-C-O 121.193 0.52 . . . . 0.0 111.492 -177.99 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -119.3 -9.87 9.83 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.911 0.862 . . . . 0.0 110.202 -178.499 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.545 ' NE2' ' HA ' ' A' ' 1' ' ' MET . 0.0 OUTLIER -83.61 -51.46 7.28 Favored 'General case' 0 C--N 1.306 -1.285 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.59 -178.581 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -78.2 149.27 33.72 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-O 121.308 0.575 . . . . 0.0 111.933 -176.755 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -75.06 130.71 39.76 Favored 'General case' 0 C--N 1.317 -0.809 0 N-CA-C 109.224 -0.658 . . . . 0.0 109.224 175.267 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 14.2 ptmm? -129.79 138.76 33.82 Favored Pre-proline 0 C--N 1.31 -1.147 0 O-C-N 122.172 -0.33 . . . . 0.0 110.628 -177.815 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -52.31 111.8 0.71 Allowed 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 123.046 2.497 . . . . 0.0 112.882 -178.195 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 15.0 m -104.64 -0.03 28.01 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.782 179.742 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 36.5 m -64.05 133.05 52.34 Favored 'General case' 0 C--O 1.234 0.249 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 177.972 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . 0.447 ' HA ' ' NZ ' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -92.71 162.9 13.96 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 121.72 0.771 . . . . 0.0 112.451 -175.321 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 27.2 m-20 -126.05 81.95 2.03 Favored 'General case' 0 CA--C 1.507 -0.688 0 CA-C-N 115.218 -0.901 . . . . 0.0 108.657 177.907 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.473 ' H ' HD12 ' A' ' 13' ' ' LEU . 5.6 mp -65.9 -56.98 8.96 Favored 'General case' 0 C--N 1.307 -1.252 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.378 -178.874 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 59.02 61.31 7.49 Favored Glycine 0 N--CA 1.448 -0.516 0 N-CA-C 110.113 -1.195 . . . . 0.0 110.113 -176.656 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -54.95 123.87 14.88 Favored 'General case' 0 C--O 1.239 0.551 0 C-N-CA 123.097 0.559 . . . . 0.0 112.063 -175.255 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 21.8 ptmt -159.61 -172.88 3.87 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.43 -0.804 . . . . 0.0 109.193 -179.67 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 56.0 mtpt -90.37 -172.66 3.52 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 121.197 0.522 . . . . 0.0 111.431 179.036 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 -85.1 -175.52 5.78 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-O 121.406 0.622 . . . . 0.0 112.013 -176.529 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 102.69 140.31 10.91 Favored Glycine 0 N--CA 1.445 -0.749 0 CA-C-N 115.891 -0.595 . . . . 0.0 112.507 179.325 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.614 ' O ' ' HG3' ' A' ' 39' ' ' LYS . 52.9 mm-40 71.31 27.24 3.19 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 123.188 0.595 . . . . 0.0 112.148 176.25 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 42.6 p90 -126.2 164.97 19.79 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-O 121.615 0.721 . . . . 0.0 112.091 -177.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.426 ' HB ' ' HA ' ' A' ' 84' ' ' GLU . 23.4 pt -119.33 171.94 6.98 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.012 0 CA-C-N 115.372 -0.831 . . . . 0.0 110.13 177.612 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.5 ' HD3' ' N ' ' A' ' 23' ' ' LYS . 0.0 OUTLIER -121.14 143.07 49.3 Favored 'General case' 0 C--N 1.305 -1.35 0 N-CA-C 108.815 -0.809 . . . . 0.0 108.815 -178.751 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.5 mp -136.28 159.34 42.06 Favored 'General case' 0 C--N 1.3 -1.559 0 CA-C-O 121.194 0.521 . . . . 0.0 110.982 176.662 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.42 ' O ' ' HA ' ' A' ' 87' ' ' VAL . 5.3 tmmm? -126.82 142.45 51.54 Favored 'General case' 0 N--CA 1.439 -0.999 0 CA-C-O 121.513 0.673 . . . . 0.0 110.458 -179.404 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.501 HG11 ' CD1' ' A' ' 51' ' ' TYR . 0.9 OUTLIER -117.57 142.23 32.72 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.458 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.975 -179.581 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.506 ' O ' ' HB ' ' A' ' 90' ' ' VAL . 48.5 mm -103.68 118.63 51.07 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.289 0 N-CA-C 107.164 -1.421 . . . . 0.0 107.164 174.318 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . 0.444 ' HA2' ' HB ' ' A' ' 90' ' ' VAL . . . -90.71 162.94 29.37 Favored Glycine 0 N--CA 1.419 -2.462 0 C-N-CA 120.049 -1.072 . . . . 0.0 111.717 -176.021 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.87 -25.32 64.97 Favored 'General case' 0 C--N 1.309 -1.153 0 CA-C-O 121.653 0.74 . . . . 0.0 110.72 176.356 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -82.0 1.44 35.57 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.199 177.451 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 9.7 m 73.52 13.18 4.53 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 122.216 1.008 . . . . 0.0 109.017 -175.413 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 2.9 t -76.91 116.46 17.59 Favored 'General case' 0 N--CA 1.44 -0.93 0 CA-C-N 114.46 -1.246 . . . . 0.0 110.475 -178.978 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.407 ' HG2' ' CD1' ' A' ' 27' ' ' ILE . 45.1 mt-10 -89.49 110.78 21.58 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.286 0.565 . . . . 0.0 109.857 177.638 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.416 HG21 ' HA ' ' A' ' 51' ' ' TYR . 39.1 mm -99.8 137.76 26.28 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.44 0 N-CA-C 109.724 -0.472 . . . . 0.0 109.724 -178.928 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 12.5 m170 -117.91 132.41 56.41 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 108.648 -0.871 . . . . 0.0 108.648 179.514 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.472 ' HZ ' HG23 ' A' ' 26' ' ' VAL . 1.3 p90 -145.39 168.0 21.56 Favored 'General case' 0 C--N 1.31 -1.11 0 CA-C-O 121.025 0.441 . . . . 0.0 111.026 -178.485 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 88.9 mttt -126.93 115.86 19.92 Favored 'General case' 0 N--CA 1.445 -0.677 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.542 -177.013 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 33.1 m -134.54 162.52 38.74 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 CA-C-O 120.964 0.411 . . . . 0.0 110.153 179.517 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.614 ' HG3' ' O ' ' A' ' 20' ' ' GLU . 81.6 tttt -89.01 165.78 14.33 Favored 'General case' 0 C--N 1.31 -1.128 0 O-C-N 122.011 -0.431 . . . . 0.0 110.859 -179.155 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -73.45 -36.79 65.94 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 112.675 0.62 . . . . 0.0 112.675 -177.156 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 10.1 t -93.34 13.64 20.84 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 120.926 0.393 . . . . 0.0 111.814 -177.695 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . 0.547 HG22 ' O ' ' A' ' 39' ' ' LYS . 3.4 t -95.37 173.14 7.67 Favored 'General case' 0 C--N 1.321 -0.664 0 C-N-CA 120.11 -0.636 . . . . 0.0 110.366 -179.248 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 34.5 m170 -92.39 141.65 28.3 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-O 121.432 0.634 . . . . 0.0 111.699 -178.854 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.476 ' HB2' ' O ' ' A' ' 75' ' ' HIS . 0.8 OUTLIER -63.87 -18.27 64.01 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.437 -0.801 . . . . 0.0 111.279 179.31 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.461 ' HA ' ' HD3' ' A' ' 48' ' ' LYS . 0.0 OUTLIER -51.07 -40.43 58.32 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.801 -179.751 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.612 ' O ' ' HG3' ' A' ' 49' ' ' GLU . 19.2 mtpp -66.88 -46.0 76.3 Favored 'General case' 0 CA--C 1.488 -1.417 0 CA-C-O 121.95 0.881 . . . . 0.0 109.286 178.253 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.431 ' HB3' HD13 ' A' ' 44' ' ' LEU . 9.0 tt -60.14 -49.68 76.68 Favored 'General case' 0 C--N 1.291 -1.948 0 CA-C-N 114.616 -1.175 . . . . 0.0 110.11 -176.044 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.526 ' HA ' ' CE2' ' A' ' 51' ' ' TYR . 29.9 mtpt -59.26 -46.51 88.32 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.745 -0.661 . . . . 0.0 111.018 179.46 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.612 ' HG3' ' O ' ' A' ' 46' ' ' LYS . 1.4 pp20? -71.92 -30.68 65.59 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 121.336 0.589 . . . . 0.0 110.406 -178.346 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.406 ' O ' ' HG2' ' A' ' 53' ' ' GLN . 17.8 m -70.42 -42.64 71.35 Favored 'General case' 0 N--CA 1.44 -0.954 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.943 -179.338 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.526 ' CE2' ' HA ' ' A' ' 48' ' ' LYS . 3.0 p90 -76.3 -32.87 58.98 Favored 'General case' 0 C--N 1.321 -0.649 0 C-N-CA 119.3 -0.96 . . . . 0.0 110.102 179.182 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . 0.574 ' SG ' HD11 ' A' ' 62' ' ' LEU . 47.4 m -60.82 -44.08 97.39 Favored 'General case' 0 CA--C 1.512 -0.483 0 CA-C-O 120.975 0.417 . . . . 0.0 110.691 177.749 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.406 ' HG2' ' O ' ' A' ' 50' ' ' SER . 12.3 pt20 -66.76 -35.06 79.21 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.58 179.463 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 2.5 mmm180 -59.02 -30.12 67.77 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-O 121.006 0.432 . . . . 0.0 111.246 177.024 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.449 HE21 ' HB2' ' A' ' 55' ' ' GLN . 3.5 mt-30 -90.4 -21.74 21.8 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 120.953 0.406 . . . . 0.0 110.844 179.602 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 78.85 34.03 35.5 Favored Glycine 0 N--CA 1.444 -0.772 0 C-N-CA 120.492 -0.861 . . . . 0.0 111.897 179.722 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 33.4 m -134.02 150.18 73.64 Favored Pre-proline 0 C--N 1.327 -0.401 0 O-C-N 122.543 -0.386 . . . . 0.0 110.417 -179.213 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . 0.513 ' HG2' ' OG ' ' A' ' 61' ' ' SER . 28.6 Cg_endo -64.12 150.9 87.39 Favored 'Trans proline' 0 N--CA 1.46 -0.498 0 C-N-CA 122.681 2.254 . . . . 0.0 112.269 179.199 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.436 ' HG2' ' SG ' ' A' ' 52' ' ' CYS . 74.4 mtp -73.07 -10.32 59.67 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.12 -178.142 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . 0.421 ' OD1' ' HB2' ' A' ' 58' ' ' PRO . 2.2 p-10 -91.87 -9.68 42.43 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.232 -179.457 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.513 ' OG ' ' HG2' ' A' ' 58' ' ' PRO . 68.4 m -93.87 -12.89 27.94 Favored 'General case' 0 C--N 1.317 -0.807 0 N-CA-C 113.127 0.788 . . . . 0.0 113.127 -179.406 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.574 HD11 ' SG ' ' A' ' 52' ' ' CYS . 1.3 pp -128.26 165.56 20.28 Favored 'General case' 0 C--N 1.308 -1.213 0 O-C-N 121.638 -0.664 . . . . 0.0 112.726 -179.349 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.586 ' HB2' ' HB2' ' A' ' 91' ' ' TYR . 3.7 mmp_? -111.95 118.12 34.61 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.814 -177.361 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -103.06 113.75 27.48 Favored 'General case' 0 C--N 1.302 -1.461 0 CA-C-O 120.94 0.4 . . . . 0.0 110.559 176.026 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.461 ' C ' HD22 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -142.25 161.21 38.61 Favored 'General case' 0 N--CA 1.445 -0.685 0 CA-C-O 121.605 0.716 . . . . 0.0 111.438 -179.455 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 93.7 t80 -144.63 136.73 26.1 Favored 'General case' 0 C--N 1.311 -1.093 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 179.061 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.465 ' HG2' HE21 ' A' ' 69' ' ' GLN . 7.7 pt-20 48.88 27.06 1.48 Allowed 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 124.358 1.063 . . . . 0.0 112.631 -179.368 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 84.62 25.43 42.42 Favored Glycine 0 N--CA 1.447 -0.593 0 C-N-CA 120.806 -0.712 . . . . 0.0 113.025 -179.112 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . 0.465 HE21 ' HG2' ' A' ' 67' ' ' GLU . 3.4 pt20 -131.95 137.66 48.02 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 178.896 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -74.31 145.36 44.0 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-O 121.324 0.583 . . . . 0.0 109.747 178.492 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.403 HG21 HD12 ' A' ' 44' ' ' LEU . 23.6 mm -90.36 119.93 38.33 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.606 0 CA-C-O 121.15 0.5 . . . . 0.0 110.622 -178.508 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -90.64 163.46 14.53 Favored 'General case' 0 N--CA 1.437 -1.075 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 179.636 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . 0.446 ' HB3' ' HB3' ' A' ' 45' ' ' LYS . 59.6 m-20 -71.17 -21.38 62.17 Favored 'General case' 0 C--N 1.313 -1.007 0 CA-C-O 121.627 0.727 . . . . 0.0 110.362 -179.818 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 9.0 m-80 -97.73 6.83 47.4 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.735 -0.666 . . . . 0.0 109.504 179.528 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . 0.476 ' O ' ' HB2' ' A' ' 44' ' ' LEU . 3.4 m170 -82.81 140.74 32.78 Favored 'General case' 0 CA--C 1.508 -0.664 0 N-CA-C 109.538 -0.542 . . . . 0.0 109.538 178.858 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.425 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 67.0 p -117.73 154.77 51.08 Favored Pre-proline 0 C--N 1.309 -1.154 0 CA-C-O 120.45 0.166 . . . . 0.0 110.703 179.601 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -59.57 -39.79 71.74 Favored 'Trans proline' 0 N--CA 1.458 -0.576 0 C-N-CA 122.439 2.093 . . . . 0.0 111.43 179.129 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . 0.489 ' HG3' ' N ' ' A' ' 79' ' ' GLU . 28.2 pttt -67.77 -38.92 84.06 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.225 -178.013 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.489 ' N ' ' HG3' ' A' ' 78' ' ' LYS . 9.4 mm-40 -73.32 -36.26 66.18 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.929 0.395 . . . . 0.0 110.953 -178.291 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.447 HD21 ' CG ' ' A' ' 75' ' ' HIS . 5.8 mt -82.3 2.72 30.72 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.212 0.529 . . . . 0.0 110.996 -179.704 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 72.62 39.6 55.58 Favored Glycine 0 N--CA 1.453 -0.188 0 C-N-CA 120.962 -0.637 . . . . 0.0 112.618 177.745 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 65.0 mtt -98.55 162.5 13.11 Favored 'General case' 0 C--N 1.312 -1.046 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 179.514 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -143.59 -170.74 3.37 Favored 'General case' 0 C--N 1.306 -1.293 0 CA-C-O 120.803 0.335 . . . . 0.0 110.201 -179.563 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.426 ' HA ' ' HB ' ' A' ' 22' ' ' ILE . 5.6 pt-20 -70.84 136.01 48.44 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 120.994 0.426 . . . . 0.0 110.829 179.875 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 16.1 mm-40 74.25 5.58 4.64 Favored 'General case' 0 C--O 1.238 0.485 0 C-N-CA 124.008 0.923 . . . . 0.0 111.813 178.356 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 6.2 t0 -60.54 160.37 9.09 Favored 'General case' 0 C--O 1.238 0.453 0 CA-C-O 121.271 0.558 . . . . 0.0 110.874 176.109 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.42 ' HA ' ' O ' ' A' ' 25' ' ' LYS . 7.5 p -126.54 143.62 39.42 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.002 0 CA-C-O 121.255 0.55 . . . . 0.0 111.443 -177.238 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . 0.419 ' HB ' HG22 ' A' ' 26' ' ' VAL . 3.7 mp -116.1 153.72 17.68 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 179.063 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -106.11 138.76 41.73 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.923 0.392 . . . . 0.0 110.37 -176.737 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . 0.561 ' HA ' ' O ' ' A' ' 63' ' ' ARG . 89.4 t -128.33 134.38 64.96 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-O 121.389 0.614 . . . . 0.0 111.475 178.987 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . 0.586 ' HB2' ' HB2' ' A' ' 63' ' ' ARG . 70.4 m-85 -116.31 176.24 5.19 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.85 -0.614 . . . . 0.0 109.693 178.536 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . 0.428 ' HG3' ' H ' ' A' ' 94' ' ' GLN . 9.3 tp60 -108.41 129.58 55.25 Favored 'General case' 0 C--N 1.31 -1.109 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 178.429 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -119.26 20.77 12.5 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.079 0.466 . . . . 0.0 110.629 178.177 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . 0.441 ' CG ' ' HB3' ' A' ' 61' ' ' SER . 99.5 mt-30 -63.22 -162.05 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 121.412 0.625 . . . . 0.0 111.878 178.472 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 7.7 t -154.95 159.32 40.33 Favored 'General case' 0 C--N 1.309 -1.156 0 O-C-N 121.63 -0.669 . . . . 0.0 110.148 -175.632 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 159.6 -58.34 0.32 Allowed Glycine 0 N--CA 1.44 -1.071 0 N-CA-C 111.346 -0.701 . . . . 0.0 111.346 179.959 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.437 -1.279 0 CA-C-O 118.645 -1.086 . . . . 0.0 111.393 -179.755 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.7 ptm . . . . . 0 N--CA 1.481 1.111 0 CA-C-O 121.473 0.654 . . . . 0.0 110.805 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 66.4 m -164.9 -29.89 0.03 OUTLIER 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.864 -175.984 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 25.7 m-20 -75.02 3.19 8.82 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 116.568 -0.287 . . . . 0.0 111.764 -178.569 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 2.1 pt20 -165.37 173.9 10.65 Favored 'General case' 0 N--CA 1.444 -0.741 0 N-CA-C 108.514 -0.921 . . . . 0.0 108.514 -178.116 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -110.89 167.76 10.0 Favored 'General case' 0 C--N 1.311 -1.069 0 N-CA-C 109.897 -0.409 . . . . 0.0 109.897 177.83 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -155.65 133.04 10.95 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 109.726 -0.472 . . . . 0.0 109.726 179.698 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 16.7 ptpt -156.59 157.22 30.84 Favored Pre-proline 0 C--N 1.312 -1.022 0 CA-C-N 116.694 -0.23 . . . . 0.0 110.724 -178.793 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 36.0 Cg_endo -66.21 -172.88 0.3 Allowed 'Trans proline' 0 C--N 1.35 0.614 0 C-N-CA 122.599 2.199 . . . . 0.0 111.622 177.274 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 5.2 p -91.96 80.27 5.18 Favored 'General case' 0 C--N 1.312 -1.026 0 O-C-N 121.743 -0.598 . . . . 0.0 111.426 -178.407 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 5.8 m -50.35 -57.06 8.78 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-O 121.547 0.689 . . . . 0.0 109.99 176.941 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -104.11 135.18 46.09 Favored 'General case' 0 N--CA 1.437 -1.116 0 N-CA-C 107.657 -1.238 . . . . 0.0 107.657 176.713 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -128.13 138.53 52.55 Favored 'General case' 0 C--N 1.311 -1.084 0 CA-C-O 121.515 0.674 . . . . 0.0 112.434 -173.936 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.674 ' O ' ' HE3' ' A' ' 16' ' ' LYS . 80.2 mt -102.9 147.99 26.22 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.643 -179.459 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -89.58 -30.69 12.83 Favored Glycine 0 C--N 1.305 -1.146 0 C-N-CA 120.367 -0.92 . . . . 0.0 111.656 178.139 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -105.92 107.93 19.19 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-O 121.208 0.527 . . . . 0.0 109.966 178.651 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.674 ' HE3' ' O ' ' A' ' 13' ' ' LEU . 89.7 mttt -122.18 134.37 54.72 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-O 121.109 0.48 . . . . 0.0 111.955 -176.467 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.441 ' HE2' ' N ' ' A' ' 17' ' ' LYS . 0.0 OUTLIER 176.86 178.08 0.26 Allowed 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 177.856 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -161.43 149.02 14.97 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 121.174 0.511 . . . . 0.0 110.747 176.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 178.04 -177.47 48.38 Favored Glycine 0 N--CA 1.436 -1.318 0 N-CA-C 110.798 -0.921 . . . . 0.0 110.798 -179.671 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.4 ' O ' ' HE3' ' A' ' 39' ' ' LYS . 33.6 mm-40 66.26 43.69 2.7 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-O 121.389 0.614 . . . . 0.0 110.42 179.042 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 12.3 p90 -124.62 164.94 18.79 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-O 121.539 0.685 . . . . 0.0 111.805 -178.012 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.436 ' HB ' ' HA ' ' A' ' 84' ' ' GLU . 27.9 pt -112.58 173.19 2.79 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.976 0 CA-C-N 115.436 -0.802 . . . . 0.0 109.38 178.06 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 6.8 mtmt -112.37 145.9 39.28 Favored 'General case' 0 C--N 1.289 -2.055 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 -178.914 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.6 mp -140.84 160.29 40.37 Favored 'General case' 0 C--N 1.302 -1.459 0 CA-C-O 121.21 0.529 . . . . 0.0 110.797 173.799 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.407 ' O ' ' HA ' ' A' ' 87' ' ' VAL . 5.1 tmmm? -132.74 142.69 49.16 Favored 'General case' 0 C--N 1.312 -1.039 0 CA-C-O 121.391 0.615 . . . . 0.0 110.721 -179.088 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.556 HG23 ' HZ ' ' A' ' 36' ' ' PHE . 0.9 OUTLIER -117.27 141.18 36.94 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.439 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.608 -179.991 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.462 ' O ' ' HB ' ' A' ' 90' ' ' VAL . 43.7 mm -104.24 114.77 44.72 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.037 0 N-CA-C 107.409 -1.33 . . . . 0.0 107.409 174.378 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . 0.473 ' HA2' ' HB ' ' A' ' 90' ' ' VAL . . . -87.01 162.84 34.21 Favored Glycine 0 N--CA 1.423 -2.207 0 C-N-CA 119.856 -1.164 . . . . 0.0 111.241 -177.337 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.68 -30.07 30.02 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-O 121.116 0.484 . . . . 0.0 112.258 177.175 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -93.55 13.62 21.34 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-O 121.272 0.558 . . . . 0.0 110.193 -179.301 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 23.6 m 74.65 21.01 2.28 Favored 'General case' 0 CA--C 1.504 -0.811 0 CA-C-O 122.623 1.201 . . . . 0.0 108.396 -178.91 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 2.5 m -68.78 94.57 0.61 Allowed 'General case' 0 N--CA 1.425 -1.721 0 CA-C-N 113.295 -1.775 . . . . 0.0 111.763 -179.164 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.494 ' HA ' ' O ' ' A' ' 26' ' ' VAL . 37.9 mt-10 -82.33 104.08 12.38 Favored 'General case' 0 CA--C 1.506 -0.746 0 C-N-CA 120.369 -0.532 . . . . 0.0 110.265 176.968 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.478 HG21 ' HA ' ' A' ' 51' ' ' TYR . 36.8 mm -100.18 133.73 42.21 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.767 0 N-CA-C 108.963 -0.755 . . . . 0.0 108.963 178.419 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 12.5 m170 -113.34 128.81 56.58 Favored 'General case' 0 C--N 1.316 -0.854 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 -179.43 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.556 ' HZ ' HG23 ' A' ' 26' ' ' VAL . 1.1 p90 -140.91 149.08 41.43 Favored 'General case' 0 C--N 1.306 -1.301 0 CA-C-O 121.488 0.661 . . . . 0.0 111.311 -177.937 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 96.3 mttt -113.97 105.65 13.49 Favored 'General case' 0 C--N 1.31 -1.117 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.859 -178.691 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.496 ' HB ' HG21 ' A' ' 42' ' ' THR . 14.6 m -129.88 162.58 37.29 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.277 -177.592 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.4 ' HE3' ' O ' ' A' ' 20' ' ' GLU . 46.3 mtpt -79.46 178.32 8.2 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-O 121.731 0.777 . . . . 0.0 112.093 -178.779 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -87.59 -31.03 20.06 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.538 -0.756 . . . . 0.0 109.91 178.3 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 10.2 t -92.87 13.0 21.76 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 115.617 -0.719 . . . . 0.0 111.465 -177.631 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . 0.496 HG21 ' HB ' ' A' ' 38' ' ' VAL . 6.4 t -94.56 162.83 13.64 Favored 'General case' 0 C--N 1.318 -0.795 0 O-C-N 122.029 -0.419 . . . . 0.0 109.974 -178.371 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . 0.516 ' O ' ' HG3' ' A' ' 46' ' ' LYS . 24.5 m170 -85.37 141.15 30.21 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-O 121.033 0.444 . . . . 0.0 110.149 177.838 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.643 ' O ' ' HG3' ' A' ' 48' ' ' LYS . 0.5 OUTLIER -63.76 -20.28 65.64 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.888 -179.898 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.702 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -50.7 -47.29 59.04 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 112.173 0.435 . . . . 0.0 112.173 -178.476 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.516 ' HG3' ' O ' ' A' ' 43' ' ' HIS . 0.0 OUTLIER -68.84 -30.11 68.59 Favored 'General case' 0 C--O 1.222 -0.363 0 CA-C-O 121.165 0.507 . . . . 0.0 110.964 -178.872 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.462 HD12 HG21 ' A' ' 38' ' ' VAL . 7.8 tt -72.19 -48.53 42.53 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.549 178.559 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.643 ' HG3' ' O ' ' A' ' 44' ' ' LEU . 24.4 mtpt -57.16 -46.6 82.63 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-O 121.374 0.607 . . . . 0.0 110.46 -178.463 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.702 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 8.3 pt-20 -71.95 -32.94 67.79 Favored 'General case' 0 C--N 1.312 -1.052 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.692 -179.166 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.556 ' O ' ' HG2' ' A' ' 54' ' ' ARG . 23.2 t -62.18 -46.23 89.88 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-O 121.01 0.433 . . . . 0.0 110.699 -179.178 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.487 ' CD1' HG11 ' A' ' 26' ' ' VAL . 2.4 p90 -75.39 -33.0 60.96 Favored 'General case' 0 N--CA 1.441 -0.924 0 C-N-CA 119.744 -0.783 . . . . 0.0 110.701 -178.064 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . 0.552 ' SG ' ' HG2' ' A' ' 59' ' ' MET . 97.0 m -63.08 -45.89 90.0 Favored 'General case' 0 CA--C 1.509 -0.615 0 CA-C-O 121.08 0.467 . . . . 0.0 110.644 179.607 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -66.8 -34.45 77.85 Favored 'General case' 0 N--CA 1.442 -0.847 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.476 -179.499 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.556 ' HG2' ' O ' ' A' ' 50' ' ' SER . 40.0 mmt180 -57.23 -40.44 77.56 Favored 'General case' 0 C--N 1.349 0.572 0 CA-C-O 121.105 0.478 . . . . 0.0 111.153 176.813 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.507 ' NE2' ' HA ' ' A' ' 52' ' ' CYS . 2.8 mt-30 -77.24 -21.45 53.73 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.028 0.442 . . . . 0.0 110.982 -179.335 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 80.63 38.28 17.41 Favored Glycine 0 N--CA 1.443 -0.863 0 C-N-CA 120.674 -0.774 . . . . 0.0 111.793 -179.908 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 29.9 m -140.67 149.19 55.98 Favored Pre-proline 0 C--N 1.327 -0.392 0 N-CA-C 110.172 -0.307 . . . . 0.0 110.172 -179.952 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . 0.406 ' HG2' ' OG ' ' A' ' 61' ' ' SER . 30.3 Cg_endo -66.07 150.7 85.1 Favored 'Trans proline' 0 C--O 1.241 0.674 0 C-N-CA 122.325 2.016 . . . . 0.0 111.964 178.529 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.552 ' HG2' ' SG ' ' A' ' 52' ' ' CYS . 81.2 mtp -69.19 -8.87 49.66 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.95 -176.845 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 22.8 p30 -91.94 -12.46 33.36 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-O 121.134 0.492 . . . . 0.0 111.534 -178.476 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.444 ' HB3' HE21 ' A' ' 94' ' ' GLN . 75.3 m -84.28 -23.14 30.46 Favored 'General case' 0 N--CA 1.442 -0.831 0 CA-C-O 121.225 0.536 . . . . 0.0 111.391 179.848 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.532 HD11 ' SG ' ' A' ' 52' ' ' CYS . 2.0 pp -131.82 151.96 51.32 Favored 'General case' 0 C--N 1.309 -1.183 0 CA-C-O 121.549 0.69 . . . . 0.0 112.204 -178.231 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.441 ' HG3' ' HB2' ' A' ' 91' ' ' TYR . 1.1 ptp180 -109.97 139.96 44.51 Favored 'General case' 0 C--N 1.312 -1.06 0 CA-C-O 121.5 0.667 . . . . 0.0 112.657 -179.417 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -112.3 119.71 39.23 Favored 'General case' 0 C--N 1.311 -1.077 0 CA-C-N 114.96 -1.018 . . . . 0.0 110.726 -177.969 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.455 ' C ' HD22 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -142.79 164.23 30.65 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-O 121.327 0.584 . . . . 0.0 111.101 178.955 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 88.4 t80 -145.68 134.12 21.94 Favored 'General case' 0 C--N 1.312 -1.053 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 179.091 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.431 ' HG2' HE21 ' A' ' 69' ' ' GLN . 6.5 pt-20 49.1 28.08 1.98 Allowed 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 124.155 0.982 . . . . 0.0 112.102 -179.351 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 84.55 25.26 43.37 Favored Glycine 0 N--CA 1.447 -0.571 0 C-N-CA 120.848 -0.692 . . . . 0.0 113.195 -178.906 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . 0.431 HE21 ' HG2' ' A' ' 67' ' ' GLU . 3.0 pt20 -131.63 134.68 46.25 Favored 'General case' 0 C--N 1.32 -0.695 0 O-C-N 122.21 -0.582 . . . . 0.0 109.893 178.681 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.451 ' HD3' ' H ' ' A' ' 70' ' ' ARG . 0.0 OUTLIER -65.77 144.1 57.09 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-O 121.553 0.692 . . . . 0.0 110.43 176.767 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 23.3 mm -94.5 119.79 42.98 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.573 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 179.471 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -98.02 162.9 13.0 Favored 'General case' 0 N--CA 1.438 -1.031 0 CA-C-O 120.909 0.385 . . . . 0.0 110.0 -178.237 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . 0.488 ' HB3' ' HB3' ' A' ' 45' ' ' LYS . 62.0 m-20 -67.65 -23.75 65.37 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-O 121.375 0.607 . . . . 0.0 111.381 -178.511 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 3.1 m-80 -97.25 4.93 50.77 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-O 121.433 0.635 . . . . 0.0 109.69 -178.719 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . 0.527 ' O ' ' HB2' ' A' ' 44' ' ' LEU . 5.9 m170 -84.72 142.69 29.67 Favored 'General case' 0 CA--C 1.504 -0.826 0 CA-C-N 116.187 -0.46 . . . . 0.0 109.768 179.908 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 81.8 p -117.29 154.0 50.13 Favored Pre-proline 0 C--N 1.304 -1.401 0 CA-C-N 116.631 -0.259 . . . . 0.0 110.792 179.177 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_exo -60.33 -37.71 80.16 Favored 'Trans proline' 0 N--CA 1.456 -0.68 0 C-N-CA 122.435 2.09 . . . . 0.0 111.204 179.298 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . 0.464 ' HG3' ' N ' ' A' ' 79' ' ' GLU . 34.5 pttt -68.93 -35.88 77.32 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.14 -178.279 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.464 ' N ' ' HG3' ' A' ' 78' ' ' LYS . 14.4 mm-40 -76.61 -37.35 56.57 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-O 121.039 0.447 . . . . 0.0 111.322 -178.898 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.458 HD21 ' CG ' ' A' ' 75' ' ' HIS . 5.2 mt -78.72 -5.16 52.42 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.241 0.543 . . . . 0.0 110.627 179.626 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 78.73 43.43 11.72 Favored Glycine 0 N--CA 1.45 -0.368 0 CA-C-N 115.884 -0.598 . . . . 0.0 112.883 176.99 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 61.1 mtt -101.89 162.29 13.02 Favored 'General case' 0 C--N 1.312 -1.025 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 178.652 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -138.14 -170.98 2.92 Favored 'General case' 0 C--N 1.313 -1.016 0 N-CA-C 110.04 -0.356 . . . . 0.0 110.04 179.506 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.436 ' HA ' ' HB ' ' A' ' 22' ' ' ILE . 8.8 pt-20 -70.11 129.38 39.25 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-O 121.273 0.559 . . . . 0.0 111.049 179.755 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 76.25 11.98 2.78 Favored 'General case' 0 C--N 1.316 -0.865 0 C-N-CA 124.312 1.045 . . . . 0.0 112.399 178.216 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -66.11 167.24 10.34 Favored 'General case' 0 C--O 1.239 0.551 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.107 174.332 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.407 ' HA ' ' O ' ' A' ' 25' ' ' LYS . 8.8 p -129.39 145.27 35.99 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.105 0 CA-C-O 121.298 0.57 . . . . 0.0 111.751 -176.928 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 3.8 mp -115.82 153.71 17.37 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.741 0 N-CA-C 108.63 -0.878 . . . . 0.0 108.63 178.824 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -106.35 137.66 43.92 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 120.981 0.42 . . . . 0.0 110.491 -176.149 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . 0.473 ' HB ' ' HA2' ' A' ' 28' ' ' GLY . 97.9 t -129.61 135.89 60.43 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.909 0 CA-C-O 121.254 0.55 . . . . 0.0 110.821 178.971 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . 0.441 ' HB2' ' HG3' ' A' ' 63' ' ' ARG . 84.5 m-85 -122.77 171.75 8.95 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.065 179.853 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . 0.415 ' HG3' ' H ' ' A' ' 94' ' ' GLN . 9.0 tp60 -97.49 135.83 38.78 Favored 'General case' 0 C--N 1.308 -1.205 0 N-CA-C 109.779 -0.452 . . . . 0.0 109.779 179.482 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -126.58 19.94 7.29 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 121.306 0.574 . . . . 0.0 110.764 176.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . 0.444 HE21 ' HB3' ' A' ' 61' ' ' SER . 97.2 mt-30 -66.43 -155.16 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.736 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.241 175.042 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 8.2 t -166.17 101.74 0.63 Allowed 'General case' 0 C--N 1.318 -0.797 0 CA-C-O 122.287 1.041 . . . . 0.0 110.929 -178.597 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -146.11 95.41 0.17 Allowed Glycine 0 N--CA 1.437 -1.267 0 CA-C-N 115.078 -0.965 . . . . 0.0 112.191 179.388 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.12 0 CA-C-O 118.384 -1.231 . . . . 0.0 111.281 178.419 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 47.1 ttm . . . . . 0 N--CA 1.47 0.534 0 CA-C-O 120.859 0.361 . . . . 0.0 111.676 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 8.6 p -89.14 24.44 2.14 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 112.502 0.556 . . . . 0.0 112.502 -176.423 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 62.92 43.04 7.08 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-O 121.432 0.634 . . . . 0.0 110.768 179.693 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 40.3 mt-30 -57.62 106.44 0.34 Allowed 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.159 -0.928 . . . . 0.0 110.686 179.443 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.533 ' CD ' ' H ' ' A' ' 5' ' ' GLU . 0.1 OUTLIER -84.08 168.26 16.04 Favored 'General case' 0 C--N 1.309 -1.18 0 CA-C-N 115.532 -0.758 . . . . 0.0 111.416 -176.858 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -100.76 141.23 33.92 Favored 'General case' 0 N--CA 1.438 -1.044 0 CA-C-N 115.971 -0.559 . . . . 0.0 109.785 178.509 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 22.0 ptmt -139.59 152.36 68.5 Favored Pre-proline 0 C--N 1.31 -1.132 0 N-CA-C 109.406 -0.59 . . . . 0.0 109.406 -179.318 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 21.0 Cg_exo -62.54 104.86 0.38 Allowed 'Trans proline' 0 C--O 1.236 0.418 0 C-N-CA 122.399 2.066 . . . . 0.0 111.539 178.673 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 3.1 p -80.04 114.62 19.09 Favored 'General case' 0 C--N 1.305 -1.363 0 CA-C-N 115.839 -0.618 . . . . 0.0 111.046 179.929 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 7.7 m -80.6 84.04 6.26 Favored 'General case' 0 N--CA 1.442 -0.858 0 CA-C-O 121.638 0.732 . . . . 0.0 110.216 179.715 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 -143.75 139.21 29.31 Favored 'General case' 0 C--N 1.311 -1.107 0 CA-C-N 115.705 -0.68 . . . . 0.0 109.742 -179.203 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -78.64 -22.84 46.27 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 120.885 0.374 . . . . 0.0 111.683 -177.518 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 80.9 mt -63.18 -77.6 0.05 Allowed 'General case' 0 C--O 1.234 0.242 0 N-CA-C 111.976 0.362 . . . . 0.0 111.976 -178.732 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 68.17 77.35 0.36 Allowed Glycine 0 N--CA 1.446 -0.666 0 N-CA-C 110.465 -1.054 . . . . 0.0 110.465 -177.02 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -60.07 143.9 50.92 Favored 'General case' 0 C--O 1.238 0.478 0 CA-C-O 121.273 0.559 . . . . 0.0 111.234 -176.867 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 71.9 mmtt -89.69 -166.09 1.51 Allowed 'General case' 0 C--N 1.309 -1.176 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.172 -178.133 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 45.7 tttm -80.35 160.68 25.35 Favored 'General case' 0 N--CA 1.434 -1.254 0 O-C-N 122.036 -0.415 . . . . 0.0 111.146 -179.669 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.447 ' CD ' ' H ' ' A' ' 18' ' ' GLU . 1.9 mp0 -45.64 118.49 1.81 Allowed 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 115.56 -0.746 . . . . 0.0 111.603 -179.978 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -159.14 6.02 0.13 Allowed Glycine 0 C--N 1.317 -0.49 0 N-CA-C 111.547 -0.621 . . . . 0.0 111.547 178.879 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -122.58 35.17 4.94 Favored 'General case' 0 C--N 1.311 -1.073 0 CA-C-O 121.605 0.716 . . . . 0.0 109.799 -178.826 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.442 ' CE1' ' HB3' ' A' ' 37' ' ' LYS . 51.8 p90 -113.18 157.2 21.99 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.121 -178.027 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 29.0 pt -104.21 173.47 1.36 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.961 0 CA-C-O 121.785 0.803 . . . . 0.0 110.632 178.801 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.422 ' HE3' ' HG3' ' A' ' 85' ' ' GLU . 11.2 mtmt -115.57 145.86 42.28 Favored 'General case' 0 C--N 1.295 -1.781 0 CA-C-N 115.791 -0.641 . . . . 0.0 109.54 -178.356 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.0 mp -141.03 163.48 32.85 Favored 'General case' 0 C--N 1.306 -1.289 0 CA-C-O 121.213 0.53 . . . . 0.0 111.335 174.25 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.538 ' NZ ' HD11 ' A' ' 27' ' ' ILE . 3.1 tmmt? -135.52 144.26 46.21 Favored 'General case' 0 N--CA 1.445 -0.71 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.568 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.559 ' O ' ' HA ' ' A' ' 33' ' ' GLU . 0.9 OUTLIER -114.41 142.48 26.97 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.121 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.891 179.886 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.538 HD11 ' NZ ' ' A' ' 25' ' ' LYS . 41.4 mm -110.94 97.71 6.09 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.842 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 176.079 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . 0.565 ' HA2' ' HB ' ' A' ' 90' ' ' VAL . . . -66.21 165.06 39.71 Favored Glycine 0 N--CA 1.434 -1.476 0 C-N-CA 120.646 -0.787 . . . . 0.0 113.918 178.691 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.407 ' HG3' ' H ' ' A' ' 29' ' ' GLN . 0.0 OUTLIER -56.91 -19.48 18.04 Favored 'General case' 0 C--N 1.315 -0.933 0 C-N-CA 124.286 1.034 . . . . 0.0 112.411 178.906 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.406 ' O ' ' HB2' ' A' ' 31' ' ' SER . 23.4 t70 -106.9 13.4 27.76 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.521 0.677 . . . . 0.0 110.03 -179.039 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . 0.406 ' HB2' ' O ' ' A' ' 30' ' ' ASP . 62.6 m 74.72 23.6 1.78 Allowed 'General case' 0 CA--C 1.506 -0.742 0 CA-C-O 122.768 1.271 . . . . 0.0 108.076 -178.076 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 9.6 m -71.09 91.51 0.91 Allowed 'General case' 0 N--CA 1.426 -1.655 0 CA-C-N 113.384 -1.734 . . . . 0.0 110.411 179.096 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.559 ' HA ' ' O ' ' A' ' 26' ' ' VAL . 24.8 mt-10 -83.09 107.33 15.59 Favored 'General case' 0 CA--C 1.511 -0.555 0 CA-C-O 121.279 0.561 . . . . 0.0 110.887 -179.816 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 28.2 mm -103.65 138.12 29.43 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.242 0 N-CA-C 109.147 -0.686 . . . . 0.0 109.147 178.637 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . 0.42 ' CD2' ' HG3' ' A' ' 25' ' ' LYS . 12.3 m170 -115.45 133.64 55.84 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 -179.915 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.535 ' HZ ' HG23 ' A' ' 26' ' ' VAL . 0.9 OUTLIER -146.6 165.31 29.89 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-O 121.141 0.496 . . . . 0.0 111.035 -177.997 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.442 ' HB3' ' CE1' ' A' ' 21' ' ' TYR . 64.7 mmtt -123.79 115.33 21.18 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.14 -0.482 . . . . 0.0 109.912 -177.683 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.407 ' HB ' HG21 ' A' ' 42' ' ' THR . 20.3 m -136.79 154.5 31.85 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-O 120.91 0.386 . . . . 0.0 110.346 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.55 ' O ' HG22 ' A' ' 42' ' ' THR . 83.4 tttt -81.14 163.03 23.4 Favored 'General case' 0 C--N 1.314 -0.955 0 O-C-N 121.837 -0.54 . . . . 0.0 111.07 -178.663 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . 0.47 ' O ' ' HG2' ' A' ' 78' ' ' LYS . 0.0 OUTLIER -68.64 -39.59 80.68 Favored 'General case' 0 N--CA 1.466 0.327 0 O-C-N 121.905 -0.497 . . . . 0.0 111.986 -177.785 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 14.9 t -93.23 13.39 21.37 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-O 121.167 0.508 . . . . 0.0 111.742 -175.777 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . 0.55 HG22 ' O ' ' A' ' 39' ' ' LYS . 2.2 t -92.95 164.37 13.32 Favored 'General case' 0 C--N 1.323 -0.57 0 O-C-N 121.833 -0.542 . . . . 0.0 110.34 -179.031 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . 0.498 ' O ' ' HG2' ' A' ' 46' ' ' LYS . 17.2 m170 -77.12 139.55 39.99 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.42 0.628 . . . . 0.0 111.146 178.93 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.626 ' HB2' ' O ' ' A' ' 75' ' ' HIS . 0.2 OUTLIER -70.03 -17.6 63.27 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 115.68 -0.691 . . . . 0.0 109.516 -179.224 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.754 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -53.94 -45.64 71.31 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.963 -178.456 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.498 ' HG2' ' O ' ' A' ' 43' ' ' HIS . 13.6 ptmm? -63.5 -30.15 71.32 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 121.563 0.697 . . . . 0.0 110.61 -178.649 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.591 ' HB3' HD13 ' A' ' 44' ' ' LEU . 8.2 tt -72.44 -48.91 37.42 Favored 'General case' 0 C--N 1.31 -1.139 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.085 179.37 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.589 ' HD3' ' HA ' ' A' ' 45' ' ' LYS . 27.0 mtpt -58.57 -46.84 86.07 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 121.321 0.581 . . . . 0.0 110.619 -178.292 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.754 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 5.9 pt-20 -70.3 -31.55 68.94 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.683 -179.167 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 26.6 t -67.28 -45.85 75.39 Favored 'General case' 0 N--CA 1.455 -0.193 0 CA-C-O 121.102 0.477 . . . . 0.0 111.32 -179.129 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.453 ' CD1' HG11 ' A' ' 26' ' ' VAL . 2.1 p90 -76.03 -32.53 59.4 Favored 'General case' 0 N--CA 1.443 -0.784 0 C-N-CA 119.613 -0.835 . . . . 0.0 110.359 -176.992 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . 0.506 ' SG ' ' HG2' ' A' ' 59' ' ' MET . 85.1 m -63.01 -43.65 98.19 Favored 'General case' 0 CA--C 1.513 -0.449 0 CA-C-O 120.969 0.414 . . . . 0.0 110.864 178.878 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 12.7 pt20 -68.74 -33.58 74.15 Favored 'General case' 0 N--CA 1.448 -0.546 0 C-N-CA 120.513 -0.475 . . . . 0.0 110.419 -179.638 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.483 ' HA ' ' CZ ' ' A' ' 54' ' ' ARG . 3.2 mmp_? -57.79 -43.45 85.62 Favored 'General case' 0 C--N 1.341 0.236 0 CA-C-O 121.233 0.54 . . . . 0.0 111.117 177.319 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.404 ' NE2' ' HA ' ' A' ' 52' ' ' CYS . 2.9 mt-30 -75.33 -20.24 59.16 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 121.222 0.534 . . . . 0.0 110.814 179.299 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 79.94 29.39 47.02 Favored Glycine 0 N--CA 1.446 -0.698 0 C-N-CA 121.056 -0.592 . . . . 0.0 112.044 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 34.7 m -129.47 148.99 71.57 Favored Pre-proline 0 C--N 1.322 -0.607 0 O-C-N 122.48 -0.423 . . . . 0.0 110.981 -178.527 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . 0.518 ' HG2' ' OG ' ' A' ' 61' ' ' SER . 33.5 Cg_endo -66.99 150.87 82.82 Favored 'Trans proline' 0 N--CA 1.456 -0.728 0 C-N-CA 122.459 2.106 . . . . 0.0 112.296 178.713 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.506 ' HG2' ' SG ' ' A' ' 52' ' ' CYS . 75.8 mtp -70.61 -8.83 54.57 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.589 -177.086 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . 0.42 ' OD1' ' HB2' ' A' ' 58' ' ' PRO . 1.8 p-10 -92.37 -9.74 40.68 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.662 -179.466 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.518 ' OG ' ' HG2' ' A' ' 58' ' ' PRO . 70.0 m -89.64 -22.78 22.13 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-O 121.016 0.436 . . . . 0.0 111.703 -179.182 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 1.2 pp -126.05 171.15 11.05 Favored 'General case' 0 C--N 1.314 -0.978 0 O-C-N 121.965 -0.46 . . . . 0.0 111.996 -178.69 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.507 ' CG ' ' HB3' ' A' ' 93' ' ' GLU . 57.1 mtp180 -122.38 122.8 39.88 Favored 'General case' 0 CA--C 1.506 -0.744 0 CA-C-O 120.967 0.413 . . . . 0.0 110.663 -177.698 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -100.83 115.01 29.33 Favored 'General case' 0 C--N 1.304 -1.384 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.614 177.671 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.458 ' C ' HD22 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -143.87 162.01 37.21 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-O 121.46 0.648 . . . . 0.0 111.396 179.728 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 87.1 t80 -143.18 135.56 27.28 Favored 'General case' 0 C--N 1.306 -1.304 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 179.002 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.445 ' HG2' HE21 ' A' ' 69' ' ' GLN . 9.9 pt-20 49.62 31.12 3.98 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.057 0.943 . . . . 0.0 112.166 -179.564 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 84.94 14.24 70.13 Favored Glycine 0 N--CA 1.447 -0.612 0 CA-C-N 116.019 -0.537 . . . . 0.0 113.447 179.025 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . 0.445 HE21 ' HG2' ' A' ' 67' ' ' GLU . 2.7 pt20 -122.25 135.16 54.71 Favored 'General case' 0 C--N 1.317 -0.807 0 O-C-N 122.139 -0.624 . . . . 0.0 109.505 -178.737 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.46 140.57 48.35 Favored 'General case' 0 C--N 1.313 -1.005 0 CA-C-O 121.44 0.638 . . . . 0.0 109.961 178.843 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.451 HG21 HD12 ' A' ' 44' ' ' LEU . 22.8 mm -86.74 121.76 38.04 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.517 0 CA-C-O 121.075 0.464 . . . . 0.0 110.344 -178.338 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.416 ' O ' ' HB2' ' A' ' 75' ' ' HIS . . . -95.75 161.15 14.14 Favored 'General case' 0 N--CA 1.434 -1.246 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 179.667 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 48.5 m-20 -66.01 -27.89 68.46 Favored 'General case' 0 C--N 1.311 -1.108 0 CA-C-O 121.352 0.596 . . . . 0.0 110.925 -178.689 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 8.0 m-80 -91.92 1.64 57.05 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-O 121.107 0.48 . . . . 0.0 109.97 -178.793 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . 0.626 ' O ' ' HB2' ' A' ' 44' ' ' LEU . 7.6 m170 -81.02 146.75 30.5 Favored 'General case' 0 CA--C 1.498 -1.033 0 N-CA-C 109.778 -0.453 . . . . 0.0 109.778 -179.381 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.431 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 80.5 p -122.13 155.69 60.98 Favored Pre-proline 0 C--N 1.303 -1.44 0 C-N-CA 121.086 -0.245 . . . . 0.0 111.072 178.897 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_exo -60.79 -36.91 82.02 Favored 'Trans proline' 0 N--CA 1.46 -0.46 0 C-N-CA 122.385 2.056 . . . . 0.0 111.086 178.962 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . 0.47 ' HG2' ' O ' ' A' ' 40' ' ' MET . 16.4 ptmt -67.47 -38.92 85.13 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.848 -0.614 . . . . 0.0 111.376 -179.306 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -77.96 -32.71 51.58 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.602 -178.317 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.438 HD21 ' CG ' ' A' ' 75' ' ' HIS . 5.5 mt -83.16 0.92 43.05 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.137 0.494 . . . . 0.0 110.733 179.27 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 72.86 44.45 37.66 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 121.158 -0.544 . . . . 0.0 112.975 176.746 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 62.9 mtt -102.52 166.33 10.59 Favored 'General case' 0 C--N 1.313 -0.998 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 179.285 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.435 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 11.3 pt-20 -140.8 -171.28 3.21 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-O 120.717 0.294 . . . . 0.0 110.65 178.829 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -69.15 126.91 31.27 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-O 121.687 0.756 . . . . 0.0 111.698 -177.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . 0.422 ' HG3' ' HE3' ' A' ' 23' ' ' LYS . 44.0 mt-10 76.2 13.34 2.61 Favored 'General case' 0 C--N 1.316 -0.859 0 C-N-CA 124.745 1.218 . . . . 0.0 111.498 178.03 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . 0.435 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 4.3 t0 -59.43 162.05 5.19 Favored 'General case' 0 C--O 1.239 0.549 0 CA-C-N 115.456 -0.793 . . . . 0.0 109.842 173.965 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 12.1 p -125.78 143.76 38.22 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.467 0 CA-C-O 121.342 0.591 . . . . 0.0 111.086 -176.415 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 3.8 mp -113.4 153.26 14.98 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.994 0 N-CA-C 109.087 -0.708 . . . . 0.0 109.087 179.207 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -105.72 138.7 41.47 Favored 'General case' 0 C--N 1.314 -0.946 0 CA-C-O 120.992 0.425 . . . . 0.0 109.932 -176.652 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . 0.565 ' HB ' ' HA2' ' A' ' 28' ' ' GLY . 91.4 t -131.04 134.73 61.14 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.066 0 CA-C-O 121.382 0.611 . . . . 0.0 110.733 179.394 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 92.0 m-85 -121.87 -178.92 3.97 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-N 115.913 -0.585 . . . . 0.0 109.511 179.543 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 8.1 tp60 -103.32 144.94 30.7 Favored 'General case' 0 C--N 1.307 -1.275 0 N-CA-C 109.747 -0.464 . . . . 0.0 109.747 179.135 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . 0.507 ' HB3' ' CG ' ' A' ' 63' ' ' ARG . 10.1 pt-20 -135.31 21.14 3.41 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.322 0.582 . . . . 0.0 110.684 176.12 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 80.8 mt-30 -60.77 -169.29 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.449 0 CA-C-N 115.595 -0.73 . . . . 0.0 111.209 176.048 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 13.4 t -158.19 166.76 31.62 Favored 'General case' 0 C--N 1.313 -1.004 0 O-C-N 121.685 -0.634 . . . . 0.0 109.86 -176.297 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -146.46 130.47 3.68 Favored Glycine 0 N--CA 1.438 -1.167 0 N-CA-C 111.409 -0.676 . . . . 0.0 111.409 179.774 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.44 -1.096 0 CA-C-O 118.507 -1.163 . . . . 0.0 111.425 179.667 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 67.5 mtt . . . . . 0 N--CA 1.479 0.992 0 CA-C-O 120.952 0.406 . . . . 0.0 111.117 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 39.6 m -134.43 -11.29 2.46 Favored 'General case' 0 CA--C 1.543 0.675 0 CA-C-O 120.916 0.388 . . . . 0.0 111.682 -178.529 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 28.3 m-20 -98.43 17.05 19.82 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-O 121.415 0.626 . . . . 0.0 110.424 -179.417 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 9.3 pt20 -73.47 4.43 4.83 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.768 -0.651 . . . . 0.0 112.198 -179.664 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 23.3 tt0 -64.16 160.71 17.78 Favored 'General case' 0 N--CA 1.437 -1.11 0 CA-C-O 121.448 0.642 . . . . 0.0 110.522 178.764 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -141.05 169.28 17.91 Favored 'General case' 0 C--N 1.303 -1.456 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 179.717 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.425 ' HD2' ' N ' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -135.37 150.55 72.78 Favored Pre-proline 0 C--N 1.299 -1.616 0 CA-C-N 116.693 -0.23 . . . . 0.0 110.476 -178.652 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -68.76 -162.75 0.08 OUTLIER 'Trans proline' 0 CA--C 1.532 0.398 0 C-N-CA 122.808 2.339 . . . . 0.0 112.12 179.95 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 44.1 m -128.08 86.17 2.44 Favored 'General case' 0 C--N 1.31 -1.137 0 O-C-N 121.723 -0.611 . . . . 0.0 110.449 -179.116 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 38.4 m -131.41 -42.15 1.07 Allowed 'General case' 0 C--N 1.314 -0.947 0 N-CA-C 109.386 -0.598 . . . . 0.0 109.386 178.258 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -63.32 154.86 30.41 Favored 'General case' 0 C--O 1.238 0.496 0 N-CA-C 108.632 -0.877 . . . . 0.0 108.632 175.753 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -75.58 77.42 2.59 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.781 0.8 . . . . 0.0 111.757 -177.352 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 81.3 mt -63.5 -62.61 1.56 Allowed 'General case' 0 C--N 1.307 -1.247 0 CA-C-N 114.68 -1.146 . . . . 0.0 109.803 177.116 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 155.89 -46.14 0.52 Allowed Glycine 0 CA--C 1.498 -1.006 0 N-CA-C 110.723 -0.951 . . . . 0.0 110.723 177.823 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -71.24 121.33 18.22 Favored 'General case' 0 C--N 1.312 -1.023 0 N-CA-C 109.398 -0.593 . . . . 0.0 109.398 177.812 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 57.8 mttp -129.04 161.51 29.81 Favored 'General case' 0 C--N 1.313 -1.02 0 CA-C-O 120.979 0.418 . . . . 0.0 110.901 -176.83 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 24.4 mtpp -132.05 173.83 10.82 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.593 178.674 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -156.66 163.38 39.38 Favored 'General case' 0 N--CA 1.439 -0.99 0 CA-C-O 121.133 0.492 . . . . 0.0 111.097 179.273 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 102.37 130.98 7.18 Favored Glycine 0 N--CA 1.442 -0.953 0 CA-C-N 116.033 -0.53 . . . . 0.0 112.436 179.973 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.487 ' O ' ' HG3' ' A' ' 39' ' ' LYS . 25.4 tt0 67.35 22.37 9.53 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 123.701 0.8 . . . . 0.0 112.108 177.271 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 43.7 p90 -113.36 162.97 15.45 Favored 'General case' 0 C--N 1.321 -0.663 0 O-C-N 121.669 -0.645 . . . . 0.0 110.514 178.479 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.409 ' HB ' ' HA ' ' A' ' 84' ' ' GLU . 28.2 pt -121.5 172.01 9.31 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.236 0 CA-C-O 121.325 0.583 . . . . 0.0 110.365 178.785 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 1.5 mppt? -119.12 145.41 45.98 Favored 'General case' 0 C--N 1.298 -1.638 0 N-CA-C 108.744 -0.835 . . . . 0.0 108.744 -179.356 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.4 mp -138.36 164.59 28.92 Favored 'General case' 0 C--N 1.303 -1.444 0 CA-C-O 121.332 0.587 . . . . 0.0 111.089 176.19 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.426 ' O ' ' HA ' ' A' ' 87' ' ' VAL . 5.5 tmmm? -133.26 143.02 48.82 Favored 'General case' 0 N--CA 1.434 -1.228 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.358 -178.965 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.532 ' O ' ' HA ' ' A' ' 33' ' ' GLU . 0.9 OUTLIER -114.4 142.68 26.24 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.377 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.039 -179.261 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.432 HD13 ' HG2' ' A' ' 33' ' ' GLU . 46.5 mm -105.04 115.16 46.37 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.028 0 N-CA-C 107.505 -1.295 . . . . 0.0 107.505 175.042 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . 0.433 ' HA2' ' HB ' ' A' ' 90' ' ' VAL . . . -82.77 166.9 45.54 Favored Glycine 0 N--CA 1.42 -2.37 0 C-N-CA 120.202 -0.999 . . . . 0.0 111.748 -176.58 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.38 -23.07 65.53 Favored 'General case' 0 C--N 1.305 -1.343 0 CA-C-O 121.527 0.68 . . . . 0.0 111.023 178.395 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -103.4 15.36 29.26 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.429 0.633 . . . . 0.0 109.493 178.704 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 29.2 t 73.12 16.85 4.2 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 123.771 0.828 . . . . 0.0 111.139 179.526 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 12.5 t -73.45 111.57 8.71 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 116.154 -0.476 . . . . 0.0 109.822 179.477 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.532 ' HA ' ' O ' ' A' ' 26' ' ' VAL . 43.9 mt-10 -88.37 108.64 19.45 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 121.376 0.607 . . . . 0.0 110.701 179.768 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 27.0 mm -98.37 137.22 26.51 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.269 0 N-CA-C 109.233 -0.654 . . . . 0.0 109.233 179.741 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 12.8 m170 -115.75 133.1 56.37 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 -179.846 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.513 ' HZ ' HG23 ' A' ' 26' ' ' VAL . 1.2 p90 -147.79 165.13 31.48 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-O 121.147 0.499 . . . . 0.0 111.552 -178.428 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 9.4 ptpp? -119.91 125.23 47.94 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.173 0.511 . . . . 0.0 110.94 179.713 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 33.9 m -140.56 154.94 22.45 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 178.773 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.487 ' HG3' ' O ' ' A' ' 20' ' ' GLU . 83.9 tttt -87.87 162.81 16.73 Favored 'General case' 0 C--N 1.306 -1.29 0 O-C-N 121.796 -0.565 . . . . 0.0 111.442 -178.02 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -78.45 15.26 1.02 Allowed 'General case' 0 N--CA 1.479 1.018 0 O-C-N 121.856 -0.527 . . . . 0.0 112.25 -177.03 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 14.4 t -138.66 3.34 2.28 Favored 'General case' 0 C--N 1.308 -1.236 0 CA-C-O 121.23 0.538 . . . . 0.0 110.784 -177.162 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . 0.439 HG22 ' O ' ' A' ' 39' ' ' LYS . 7.3 t -96.84 166.22 11.73 Favored 'General case' 0 N--CA 1.44 -0.97 0 CA-C-O 120.913 0.387 . . . . 0.0 110.357 -175.355 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . 0.401 ' HB3' ' O ' ' A' ' 73' ' ' ASP . 63.4 m170 -84.63 144.12 28.81 Favored 'General case' 0 C--N 1.314 -0.974 0 CA-C-O 121.498 0.666 . . . . 0.0 111.276 -178.896 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.543 ' O ' ' HG2' ' A' ' 48' ' ' LYS . 0.9 OUTLIER -65.7 -15.0 62.39 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.423 -0.808 . . . . 0.0 111.129 178.975 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.677 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -52.07 -48.37 64.71 Favored 'General case' 0 C--O 1.222 -0.391 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.803 -179.481 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 20.5 ptmt -67.03 -31.65 72.33 Favored 'General case' 0 C--O 1.208 -1.117 0 CA-C-O 120.894 0.378 . . . . 0.0 110.892 -179.943 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.408 ' HB3' HD13 ' A' ' 44' ' ' LEU . 8.6 tt -71.19 -49.97 38.02 Favored 'General case' 0 C--N 1.307 -1.241 0 CA-C-O 121.021 0.438 . . . . 0.0 110.766 -178.834 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.543 ' HG2' ' O ' ' A' ' 44' ' ' LEU . 6.1 ptmm? -62.41 -41.16 98.47 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.657 -178.207 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.677 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 8.7 pt-20 -72.04 -34.2 68.59 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-O 121.09 0.472 . . . . 0.0 110.417 178.072 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 5.4 m -65.06 -43.53 91.97 Favored 'General case' 0 C--O 1.234 0.262 0 N-CA-C 112.296 0.48 . . . . 0.0 112.296 -178.118 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.483 ' CD1' HG11 ' A' ' 26' ' ' VAL . 2.1 p90 -76.03 -33.38 59.63 Favored 'General case' 0 N--CA 1.444 -0.767 0 C-N-CA 119.326 -0.95 . . . . 0.0 110.189 -178.951 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . 0.509 ' SG ' HD11 ' A' ' 62' ' ' LEU . 91.6 m -62.42 -44.91 95.31 Favored 'General case' 0 CA--C 1.511 -0.544 0 CA-C-O 121.199 0.523 . . . . 0.0 110.611 179.556 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 13.2 pt20 -67.35 -34.79 78.04 Favored 'General case' 0 N--CA 1.443 -0.78 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.533 -179.032 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 2.3 mmp_? -56.3 -43.06 78.52 Favored 'General case' 0 C--N 1.346 0.427 0 CA-C-O 121.045 0.45 . . . . 0.0 111.232 177.331 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.409 ' NE2' ' HA ' ' A' ' 52' ' ' CYS . 2.9 mt-30 -73.86 -21.46 60.1 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.127 0.489 . . . . 0.0 110.931 179.631 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 84.68 28.12 33.19 Favored Glycine 0 N--CA 1.444 -0.769 0 C-N-CA 120.814 -0.707 . . . . 0.0 112.247 179.501 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 31.4 m -128.83 150.2 74.36 Favored Pre-proline 0 C--N 1.327 -0.405 0 O-C-N 122.418 -0.46 . . . . 0.0 110.753 -178.706 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . 0.478 ' HG2' ' OG ' ' A' ' 61' ' ' SER . 28.8 Cg_endo -65.39 153.96 75.83 Favored 'Trans proline' 0 N--CA 1.456 -0.715 0 C-N-CA 122.216 1.944 . . . . 0.0 111.5 177.115 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.459 ' HG2' ' SG ' ' A' ' 52' ' ' CYS . 77.3 mtp -74.97 -8.63 57.07 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.437 -176.201 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 24.2 p30 -90.55 -12.13 38.03 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-O 121.102 0.477 . . . . 0.0 111.596 -178.225 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.478 ' OG ' ' HG2' ' A' ' 58' ' ' PRO . 64.3 m -83.95 -21.08 31.93 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-O 121.24 0.543 . . . . 0.0 111.275 -179.234 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.509 HD11 ' SG ' ' A' ' 52' ' ' CYS . 1.2 pp -129.9 173.04 11.06 Favored 'General case' 0 C--N 1.309 -1.179 0 CA-C-O 121.479 0.657 . . . . 0.0 112.667 -176.932 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.47 ' HG3' ' HB2' ' A' ' 91' ' ' TYR . 1.1 ptp180 -129.35 132.64 47.12 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 115.53 -0.759 . . . . 0.0 111.741 -179.659 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.481 ' CZ ' ' HE2' ' A' ' 48' ' ' LYS . 0.1 OUTLIER -107.66 120.29 41.82 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-N 115.187 -0.915 . . . . 0.0 110.758 -177.662 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.465 ' C ' HD22 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -145.51 163.91 33.24 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-O 121.491 0.662 . . . . 0.0 111.173 179.72 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 80.3 t80 -146.29 135.59 22.84 Favored 'General case' 0 C--N 1.307 -1.267 0 N-CA-C 109.199 -0.667 . . . . 0.0 109.199 178.503 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.417 ' HG2' HE21 ' A' ' 69' ' ' GLN . 7.2 pt-20 49.89 28.57 2.89 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 124.126 0.971 . . . . 0.0 112.387 179.525 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 85.03 22.69 51.83 Favored Glycine 0 N--CA 1.445 -0.742 0 C-N-CA 121.146 -0.55 . . . . 0.0 112.96 179.596 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . 0.417 HE21 ' HG2' ' A' ' 67' ' ' GLU . 2.6 pt20 -130.15 134.41 47.3 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 179.085 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 1.3 ppt_? -71.98 148.39 45.98 Favored 'General case' 0 C--N 1.31 -1.142 0 CA-C-O 121.298 0.57 . . . . 0.0 110.252 178.303 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 23.4 mm -95.39 123.23 47.46 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.226 0 O-C-N 121.919 -0.488 . . . . 0.0 110.901 -177.757 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -99.46 164.56 12.05 Favored 'General case' 0 N--CA 1.447 -0.596 0 N-CA-C 110.168 -0.308 . . . . 0.0 110.168 179.704 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . 0.401 ' O ' ' HB3' ' A' ' 43' ' ' HIS . 31.7 m-20 -64.87 -28.06 69.29 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.239 0.542 . . . . 0.0 111.015 -179.298 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 3.3 m-80 -96.12 5.59 50.75 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 121.097 0.475 . . . . 0.0 110.06 -177.373 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . 0.475 ' CG ' HD21 ' A' ' 80' ' ' LEU . 3.4 m170 -83.17 140.52 32.53 Favored 'General case' 0 CA--C 1.502 -0.896 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 179.788 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.439 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 59.9 p -119.08 155.7 53.0 Favored Pre-proline 0 C--N 1.306 -1.311 0 C-N-CA 120.985 -0.286 . . . . 0.0 110.936 179.469 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_exo -61.82 -37.87 63.73 Favored 'Trans proline' 0 N--CA 1.46 -0.461 0 C-N-CA 122.465 2.11 . . . . 0.0 111.341 179.808 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . 0.476 ' HG3' ' N ' ' A' ' 79' ' ' GLU . 34.1 pttt -68.04 -36.01 79.19 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.621 -179.344 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.476 ' N ' ' HG3' ' A' ' 78' ' ' LYS . 11.2 mm-40 -74.01 -42.5 60.25 Favored 'General case' 0 CA--C 1.512 -0.511 0 CA-C-O 121.18 0.514 . . . . 0.0 111.01 -179.576 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.475 HD21 ' CG ' ' A' ' 75' ' ' HIS . 5.7 mt -76.19 -6.45 51.35 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.037 0.446 . . . . 0.0 111.237 -178.246 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 80.57 46.9 7.08 Favored Glycine 0 N--CA 1.447 -0.575 0 C-N-CA 120.862 -0.685 . . . . 0.0 112.744 177.885 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 59.3 mtt -106.64 164.32 12.18 Favored 'General case' 0 C--N 1.314 -0.942 0 O-C-N 122.51 -0.406 . . . . 0.0 109.982 178.437 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -138.18 -169.35 2.55 Favored 'General case' 0 C--N 1.313 -0.987 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 178.256 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.429 ' O ' ' HB2' ' A' ' 85' ' ' GLU . 11.5 pt-20 -78.44 134.32 37.38 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-O 121.545 0.688 . . . . 0.0 111.719 -178.893 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . 0.429 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 37.7 mt-10 78.97 8.22 1.97 Allowed 'General case' 0 C--N 1.325 -0.468 0 C-N-CA 125.104 1.361 . . . . 0.0 111.539 -179.426 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 4.6 t0 -63.26 166.52 6.15 Favored 'General case' 0 C--O 1.239 0.539 0 CA-C-N 115.734 -0.667 . . . . 0.0 110.472 175.687 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.426 ' HA ' ' O ' ' A' ' 25' ' ' LYS . 8.3 p -129.08 143.63 40.65 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.076 0 CA-C-O 121.358 0.599 . . . . 0.0 111.654 -176.754 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 3.5 mp -113.58 154.87 14.9 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 179.18 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 11.0 tp10 -107.88 138.9 43.32 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-O 121.032 0.444 . . . . 0.0 110.686 -176.262 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . 0.433 ' HB ' ' HA2' ' A' ' 28' ' ' GLY . 97.6 t -129.92 135.29 61.44 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.92 0 CA-C-O 121.362 0.601 . . . . 0.0 110.883 178.872 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . 0.47 ' HB2' ' HG3' ' A' ' 63' ' ' ARG . 81.2 m-85 -121.78 173.91 7.18 Favored 'General case' 0 C--N 1.31 -1.147 0 CA-C-N 116.115 -0.493 . . . . 0.0 109.915 178.856 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 9.5 tp60 -101.09 148.83 24.61 Favored 'General case' 0 C--N 1.306 -1.315 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 179.903 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -143.34 21.14 1.89 Allowed 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.075 0.464 . . . . 0.0 110.998 177.419 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 97.6 mt-30 -54.35 -174.1 0.0 OUTLIER 'General case' 0 CA--C 1.54 0.592 0 CA-C-O 121.511 0.672 . . . . 0.0 112.576 177.19 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 5.3 t -86.37 -33.72 20.43 Favored 'General case' 0 C--N 1.314 -0.971 0 O-C-N 121.492 -0.755 . . . . 0.0 111.423 -172.319 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 141.72 -56.69 0.58 Allowed Glycine 0 N--CA 1.445 -0.74 0 C-N-CA 120.649 -0.786 . . . . 0.0 112.265 178.622 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.441 -0.976 0 CA-C-O 118.303 -1.276 . . . . 0.0 111.406 179.715 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 71.7 mtm . . . . . 0 N--CA 1.471 0.604 0 N-CA-C 111.876 0.324 . . . . 0.0 111.876 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 49.4 m -104.98 -71.97 0.72 Allowed 'General case' 0 C--N 1.331 -0.204 0 O-C-N 121.57 -0.706 . . . . 0.0 112.557 -178.206 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -114.29 22.35 13.83 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.581 0.705 . . . . 0.0 111.201 -175.036 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -100.07 3.5 44.09 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-O 122.023 0.916 . . . . 0.0 109.759 -179.0 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -145.5 156.75 43.91 Favored 'General case' 0 C--N 1.298 -1.642 0 CA-C-N 114.781 -1.099 . . . . 0.0 110.205 -177.887 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -146.05 161.21 40.64 Favored 'General case' 0 C--N 1.314 -0.944 0 N-CA-C 110.073 -0.343 . . . . 0.0 110.073 179.245 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 20.5 ptmt -151.98 154.86 33.17 Favored Pre-proline 0 C--N 1.318 -0.778 0 N-CA-C 110.002 -0.37 . . . . 0.0 110.002 -179.57 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -58.58 122.71 12.11 Favored 'Trans proline' 0 C--O 1.241 0.656 0 C-N-CA 122.77 2.314 . . . . 0.0 111.599 179.985 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 45.3 t -148.3 159.23 44.2 Favored 'General case' 0 N--CA 1.436 -1.153 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 -178.037 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 10.7 t -86.45 -7.73 58.18 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 121.459 0.647 . . . . 0.0 109.664 178.155 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 29.4 mt-10 -139.04 138.28 37.03 Favored 'General case' 0 CA--C 1.503 -0.834 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.768 178.687 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 -79.79 134.84 36.37 Favored 'General case' 0 C--N 1.311 -1.082 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.48 -179.86 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 72.0 mt -105.6 159.42 15.97 Favored 'General case' 0 C--N 1.308 -1.198 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.1 -178.965 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 151.37 49.86 0.02 OUTLIER Glycine 0 C--N 1.312 -0.767 0 N-CA-C 110.489 -1.044 . . . . 0.0 110.489 -177.667 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -73.9 131.19 41.22 Favored 'General case' 0 C--N 1.319 -0.74 0 C-N-CA 122.852 0.461 . . . . 0.0 111.296 -177.108 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 45.7 mtmt -134.93 169.38 17.49 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.077 -178.464 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 21.7 ptmt -75.23 159.53 31.44 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.083 0.468 . . . . 0.0 110.705 179.509 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 34.2 mt-10 -113.23 -178.86 3.48 Favored 'General case' 0 C--N 1.309 -1.165 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.568 178.715 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.499 ' H ' ' HD1' ' A' ' 21' ' ' TYR . . . 143.69 119.05 1.34 Allowed Glycine 0 N--CA 1.448 -0.505 0 N-CA-C 111.864 -0.495 . . . . 0.0 111.864 179.677 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 68.23 48.08 0.94 Allowed 'General case' 0 N--CA 1.476 0.841 0 CA-C-O 121.701 0.763 . . . . 0.0 109.462 179.135 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.519 ' CE2' ' HD2' ' A' ' 37' ' ' LYS . 47.2 p90 -122.41 158.92 28.65 Favored 'General case' 0 C--N 1.313 -1.013 0 CA-C-O 121.683 0.754 . . . . 0.0 111.796 -175.255 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.475 ' HB ' ' HA ' ' A' ' 84' ' ' GLU . 23.9 pt -116.59 172.29 4.78 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.25 0 CA-C-N 115.294 -0.867 . . . . 0.0 109.206 176.442 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.494 ' HG2' ' HG2' ' A' ' 37' ' ' LYS . 34.6 mtmt -110.66 148.85 31.39 Favored 'General case' 0 C--N 1.298 -1.635 0 N-CA-C 109.75 -0.463 . . . . 0.0 109.75 179.739 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.6 mp -140.53 154.22 46.47 Favored 'General case' 0 C--N 1.3 -1.58 0 CA-C-O 121.345 0.593 . . . . 0.0 110.664 171.916 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.466 ' O ' ' HA ' ' A' ' 87' ' ' VAL . 5.4 tmmm? -128.41 143.84 51.05 Favored 'General case' 0 C--N 1.308 -1.212 0 CA-C-O 121.376 0.608 . . . . 0.0 110.334 -178.546 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.509 HG23 ' HZ ' ' A' ' 36' ' ' PHE . 0.9 OUTLIER -115.96 140.16 39.18 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.494 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.249 -179.132 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.402 HD13 ' HG2' ' A' ' 33' ' ' GLU . 46.8 mm -103.81 112.12 36.09 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.28 0 N-CA-C 107.194 -1.41 . . . . 0.0 107.194 174.496 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . 0.49 ' HA2' ' HB ' ' A' ' 90' ' ' VAL . . . -80.87 166.58 48.94 Favored Glycine 0 N--CA 1.428 -1.89 0 C-N-CA 120.181 -1.009 . . . . 0.0 111.493 -176.92 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.92 -20.07 64.83 Favored 'General case' 0 C--N 1.314 -0.978 0 CA-C-O 121.567 0.699 . . . . 0.0 110.902 177.481 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -97.16 12.97 30.87 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 121.685 0.755 . . . . 0.0 109.568 177.653 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 21.7 m 69.81 14.64 8.02 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.744 -179.055 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 7.9 t -72.79 116.93 13.87 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.533 -179.215 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.498 ' HA ' ' O ' ' A' ' 26' ' ' VAL . 41.7 mt-10 -89.44 106.33 18.38 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.214 0.531 . . . . 0.0 110.791 178.333 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 29.5 mm -96.44 136.11 28.36 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.426 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 178.574 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 12.5 m170 -115.62 131.35 56.96 Favored 'General case' 0 C--N 1.321 -0.674 0 N-CA-C 109.783 -0.451 . . . . 0.0 109.783 -178.373 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.509 ' HZ ' HG23 ' A' ' 26' ' ' VAL . 2.1 p90 -147.2 149.09 32.26 Favored 'General case' 0 C--N 1.309 -1.163 0 CA-C-O 121.33 0.586 . . . . 0.0 111.379 -179.311 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.519 ' HD2' ' CE2' ' A' ' 21' ' ' TYR . 38.1 mtmt -110.03 123.3 49.43 Favored 'General case' 0 C--N 1.313 -0.979 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.418 178.774 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.479 HG21 HD12 ' A' ' 47' ' ' LEU . 22.5 m -141.33 165.19 19.19 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.96 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 179.816 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.433 ' O ' HG22 ' A' ' 42' ' ' THR . 48.0 mtpt -84.81 176.71 8.34 Favored 'General case' 0 C--N 1.308 -1.237 0 CA-C-O 121.566 0.698 . . . . 0.0 111.517 179.854 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.38 -33.99 20.34 Favored 'General case' 0 C--N 1.307 -1.27 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.25 178.672 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 9.0 t -94.06 25.32 3.78 Favored 'General case' 0 N--CA 1.444 -0.732 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.24 -177.765 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . 0.433 HG22 ' O ' ' A' ' 39' ' ' LYS . 7.0 t -108.08 172.6 6.74 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 109.711 -0.477 . . . . 0.0 109.711 178.85 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . 0.423 ' O ' ' HG3' ' A' ' 46' ' ' LYS . 47.8 m170 -92.92 143.89 25.8 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-O 121.501 0.667 . . . . 0.0 111.479 -179.618 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.539 ' HB2' ' O ' ' A' ' 75' ' ' HIS . 0.7 OUTLIER -68.13 -17.3 64.32 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.564 178.469 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.514 ' HA ' ' HD3' ' A' ' 48' ' ' LYS . 0.0 OUTLIER -54.82 -44.94 74.3 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.883 -179.361 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.581 ' O ' ' HB2' ' A' ' 50' ' ' SER . 0.0 OUTLIER -74.0 -26.12 60.27 Favored 'General case' 0 N--CA 1.439 -1.009 0 CA-C-O 121.296 0.57 . . . . 0.0 110.493 -179.176 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.479 HD12 HG21 ' A' ' 38' ' ' VAL . 8.7 tt -72.96 -52.03 16.09 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.605 178.464 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.514 ' HD3' ' HA ' ' A' ' 45' ' ' LYS . 6.1 ptmm? -59.7 -41.04 89.88 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.98 0.419 . . . . 0.0 111.557 -178.695 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.47 -31.12 65.16 Favored 'General case' 0 C--N 1.318 -0.779 0 C-N-CA 120.437 -0.505 . . . . 0.0 110.564 178.247 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.581 ' HB2' ' O ' ' A' ' 46' ' ' LYS . 8.6 t -66.23 -42.89 88.04 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.481 -178.398 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.463 ' CD2' ' HA ' ' A' ' 48' ' ' LYS . 3.4 p90 -76.51 -32.85 58.55 Favored 'General case' 0 N--CA 1.446 -0.625 0 C-N-CA 119.672 -0.811 . . . . 0.0 110.502 -179.473 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . 0.464 ' SG ' HD11 ' A' ' 62' ' ' LEU . 90.8 m -63.77 -45.03 91.65 Favored 'General case' 0 CA--C 1.509 -0.625 0 CA-C-O 121.229 0.537 . . . . 0.0 110.291 179.07 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.44 ' HG2' ' O ' ' A' ' 50' ' ' SER . 13.8 pt20 -66.46 -33.96 76.88 Favored 'General case' 0 N--CA 1.444 -0.734 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.319 -178.987 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 2.2 mmp_? -56.05 -39.16 71.6 Favored 'General case' 0 C--N 1.349 0.571 0 CA-C-O 121.244 0.545 . . . . 0.0 111.08 176.204 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.461 ' NE2' ' HA ' ' A' ' 52' ' ' CYS . 2.7 mt-30 -82.32 -22.07 35.78 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.363 -178.482 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 83.6 29.54 32.32 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 120.43 -0.891 . . . . 0.0 111.721 179.736 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 21.0 m -129.11 149.9 73.89 Favored Pre-proline 0 C--O 1.238 0.495 0 O-C-N 122.519 -0.401 . . . . 0.0 110.692 -177.955 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . 0.512 ' HG2' ' OG ' ' A' ' 61' ' ' SER . 34.3 Cg_endo -65.78 149.71 86.6 Favored 'Trans proline' 0 C--O 1.238 0.483 0 C-N-CA 122.487 2.125 . . . . 0.0 112.383 178.445 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.446 ' HG2' ' SG ' ' A' ' 52' ' ' CYS . 73.4 mtp -74.25 -9.31 58.48 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.514 -177.28 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 2.0 p-10 -91.73 -8.32 47.26 Favored 'General case' 0 C--N 1.311 -1.068 0 CA-C-O 121.142 0.496 . . . . 0.0 111.266 -179.09 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.512 ' OG ' ' HG2' ' A' ' 58' ' ' PRO . 71.0 m -91.76 -20.32 21.65 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 121.012 0.434 . . . . 0.0 111.946 -179.785 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.464 HD11 ' SG ' ' A' ' 52' ' ' CYS . 1.9 pp -130.4 155.21 46.78 Favored 'General case' 0 C--N 1.315 -0.931 0 N-CA-C 112.629 0.603 . . . . 0.0 112.629 -179.229 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.553 ' O ' ' HA ' ' A' ' 90' ' ' VAL . 40.2 mtm-85 -105.79 130.23 53.82 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.576 -177.943 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -107.12 116.12 31.37 Favored 'General case' 0 C--N 1.309 -1.191 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.458 178.131 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.464 ' C ' HD22 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -141.89 163.2 33.54 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 121.464 0.65 . . . . 0.0 111.353 179.704 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 90.5 t80 -145.07 138.04 26.41 Favored 'General case' 0 C--N 1.308 -1.218 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 179.602 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.479 ' HG2' HE21 ' A' ' 69' ' ' GLN . 6.8 pt-20 49.86 26.76 2.06 Favored 'General case' 0 N--CA 1.485 1.314 0 C-N-CA 123.997 0.919 . . . . 0.0 112.118 -179.261 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 82.66 23.11 56.94 Favored Glycine 0 CA--C 1.522 0.512 0 C-N-CA 120.525 -0.845 . . . . 0.0 113.087 -177.618 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . 0.479 HE21 ' HG2' ' A' ' 67' ' ' GLU . 2.6 pt20 -129.57 134.36 47.69 Favored 'General case' 0 C--N 1.319 -0.735 0 O-C-N 122.177 -0.601 . . . . 0.0 109.471 179.797 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.45 ' CD ' ' H ' ' A' ' 70' ' ' ARG . 0.2 OUTLIER -68.31 143.59 55.14 Favored 'General case' 0 C--N 1.307 -1.278 0 CA-C-O 121.53 0.681 . . . . 0.0 110.612 176.662 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.422 HG21 HD12 ' A' ' 44' ' ' LEU . 25.1 mm -90.26 122.94 42.18 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.468 0 CA-C-O 121.055 0.455 . . . . 0.0 110.866 -178.148 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.414 ' O ' ' HB2' ' A' ' 75' ' ' HIS . . . -96.04 163.12 13.26 Favored 'General case' 0 N--CA 1.436 -1.153 0 N-CA-C 109.701 -0.481 . . . . 0.0 109.701 178.8 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . 0.434 ' HB3' ' HB3' ' A' ' 45' ' ' LYS . 36.5 m-20 -68.53 -24.07 64.6 Favored 'General case' 0 C--N 1.31 -1.113 0 CA-C-O 121.645 0.736 . . . . 0.0 110.547 -179.644 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 12.0 m-80 -97.4 8.45 44.56 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.725 -0.67 . . . . 0.0 109.956 -178.984 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . 0.539 ' O ' ' HB2' ' A' ' 44' ' ' LEU . 4.5 m170 -85.91 140.57 30.25 Favored 'General case' 0 CA--C 1.502 -0.887 0 CA-C-N 115.982 -0.554 . . . . 0.0 109.568 179.426 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 81.9 p -117.83 155.34 50.98 Favored Pre-proline 0 C--N 1.306 -1.317 0 C-N-CA 120.945 -0.302 . . . . 0.0 111.343 179.237 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -59.94 -40.97 57.47 Favored 'Trans proline' 0 C--N 1.347 0.453 0 C-N-CA 122.756 2.304 . . . . 0.0 111.625 179.517 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . 0.493 ' HG3' ' N ' ' A' ' 79' ' ' GLU . 35.2 pttt -67.04 -37.21 83.7 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.204 0.525 . . . . 0.0 110.813 -178.775 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.493 ' N ' ' HG3' ' A' ' 78' ' ' LYS . 23.6 mm-40 -72.3 -41.82 66.19 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-O 121.007 0.432 . . . . 0.0 111.051 -179.128 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.445 HD21 ' CG ' ' A' ' 75' ' ' HIS . 4.6 mt -77.21 -9.1 58.57 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.068 0.461 . . . . 0.0 111.123 -178.885 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 82.42 44.05 7.62 Favored Glycine 0 C--O 1.237 0.323 0 C-N-CA 120.739 -0.743 . . . . 0.0 113.004 178.121 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 55.3 mtt -103.62 162.71 12.83 Favored 'General case' 0 C--N 1.317 -0.843 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 178.414 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -143.45 -165.43 2.09 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 121.06 0.457 . . . . 0.0 111.017 178.934 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.475 ' HA ' ' HB ' ' A' ' 22' ' ' ILE . 9.0 pt-20 -68.55 117.41 10.26 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-O 121.737 0.779 . . . . 0.0 112.743 -177.454 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 11.3 tt0 82.07 14.46 0.51 Allowed 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 125.435 1.494 . . . . 0.0 110.944 175.851 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -62.44 166.57 5.01 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-N 115.54 -0.755 . . . . 0.0 110.445 176.423 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.466 ' HA ' ' O ' ' A' ' 25' ' ' LYS . 10.4 p -126.9 146.02 33.51 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.072 0 CA-C-O 121.451 0.643 . . . . 0.0 111.897 -175.925 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 3.6 mp -116.05 153.76 17.63 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.752 0 N-CA-C 108.764 -0.828 . . . . 0.0 108.764 177.507 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 13.5 tp10 -106.15 137.9 43.28 Favored 'General case' 0 C--N 1.319 -0.723 0 O-C-N 122.073 -0.392 . . . . 0.0 110.83 -176.822 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . 0.553 ' HA ' ' O ' ' A' ' 63' ' ' ARG . 95.2 t -127.31 131.8 70.13 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-O 121.251 0.548 . . . . 0.0 111.553 178.85 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 63.9 m-85 -116.13 174.95 5.77 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.101 -0.5 . . . . 0.0 109.829 179.461 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 10.2 tp60 -103.06 128.17 50.04 Favored 'General case' 0 C--N 1.312 -1.038 0 N-CA-C 110.058 -0.349 . . . . 0.0 110.058 178.047 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . 0.434 ' HB3' ' CG ' ' A' ' 63' ' ' ARG . 11.6 pt-20 -119.7 19.44 12.53 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.151 0.5 . . . . 0.0 110.9 177.904 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 97.3 mt-30 -57.94 -169.45 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.586 0 CA-C-O 121.445 0.641 . . . . 0.0 111.615 176.263 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 9.9 t -157.22 164.94 37.19 Favored 'General case' 0 N--CA 1.437 -1.112 0 O-C-N 121.521 -0.737 . . . . 0.0 110.105 -175.355 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -95.23 -168.12 35.86 Favored Glycine 0 N--CA 1.437 -1.266 0 C-N-CA 121.027 -0.606 . . . . 0.0 111.828 -179.687 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.436 -1.35 0 CA-C-O 118.123 -1.376 . . . . 0.0 110.777 -179.494 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.48 1.069 0 N-CA-C 111.752 0.278 . . . . 0.0 111.752 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 10.8 m -94.36 -33.45 13.17 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.495 0.664 . . . . 0.0 111.112 -177.89 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -121.25 106.75 11.79 Favored 'General case' 0 N--CA 1.425 -1.688 0 N-CA-C 107.47 -1.307 . . . . 0.0 107.47 179.929 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 19.2 mm-40 -90.5 175.89 6.9 Favored 'General case' 0 C--N 1.283 -2.299 0 CA-C-N 115.086 -0.961 . . . . 0.0 110.832 -175.061 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -80.76 150.51 29.23 Favored 'General case' 0 N--CA 1.439 -1.024 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 178.784 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -146.14 149.91 34.89 Favored 'General case' 0 C--N 1.305 -1.342 0 CA-C-O 120.993 0.425 . . . . 0.0 109.906 -179.047 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 6.0 ptpp? -128.6 154.6 79.61 Favored Pre-proline 0 N--CA 1.43 -1.437 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 -179.332 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -55.57 -20.98 29.13 Favored 'Trans proline' 0 CA--C 1.539 0.737 0 C-N-CA 123.103 2.535 . . . . 0.0 113.722 -178.521 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 45.2 t -77.36 -26.39 51.9 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.464 0.649 . . . . 0.0 109.811 178.349 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 58.2 m -80.74 114.12 19.41 Favored 'General case' 0 N--CA 1.44 -0.962 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.459 179.606 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 3.7 tm-20 -78.41 112.05 15.04 Favored 'General case' 0 N--CA 1.439 -0.986 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 178.51 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -138.79 -171.26 3.04 Favored 'General case' 0 N--CA 1.437 -1.084 0 N-CA-C 107.558 -1.275 . . . . 0.0 107.558 -179.429 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 68.9 mt -102.87 169.25 8.71 Favored 'General case' 0 C--N 1.304 -1.372 0 O-C-N 121.515 -0.741 . . . . 0.0 111.44 -176.411 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 92.65 19.49 37.49 Favored Glycine 0 N--CA 1.439 -1.145 0 N-CA-C 110.683 -0.967 . . . . 0.0 110.683 -176.627 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -52.0 -26.76 11.41 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 124.021 0.928 . . . . 0.0 112.857 179.701 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.537 ' HD2' ' H ' ' A' ' 16' ' ' LYS . 0.1 OUTLIER -74.34 122.38 22.83 Favored 'General case' 0 C--N 1.297 -1.68 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 179.617 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 6.1 mmmm -131.22 135.79 47.68 Favored 'General case' 0 C--N 1.305 -1.363 0 CA-C-O 122.0 0.905 . . . . 0.0 113.28 -175.315 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -61.32 157.0 17.49 Favored 'General case' 0 C--N 1.307 -1.267 0 CA-C-N 114.387 -1.279 . . . . 0.0 111.487 174.133 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 127.25 -37.24 2.41 Favored Glycine 0 N--CA 1.444 -0.809 0 N-CA-C 111.135 -0.786 . . . . 0.0 111.135 -177.6 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.433 ' HB2' ' HE3' ' A' ' 39' ' ' LYS . 49.3 mt-10 -120.17 47.54 1.74 Allowed 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 179.013 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.423 ' CD1' ' HB3' ' A' ' 37' ' ' LYS . 26.6 p90 -110.03 160.61 16.29 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-O 121.859 0.837 . . . . 0.0 113.071 -176.009 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.411 ' HB ' ' HA ' ' A' ' 84' ' ' GLU . 26.3 pt -109.15 173.21 2.0 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.098 0 CA-C-N 114.693 -1.139 . . . . 0.0 109.233 177.319 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 16.2 mtmt -113.66 142.81 45.56 Favored 'General case' 0 C--N 1.293 -1.869 0 N-CA-C 109.384 -0.599 . . . . 0.0 109.384 -178.174 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.401 HD13 ' CG2' ' A' ' 38' ' ' VAL . 5.6 mp -137.83 159.72 41.22 Favored 'General case' 0 C--N 1.302 -1.491 0 CA-C-O 121.216 0.531 . . . . 0.0 110.851 174.605 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.539 ' HG3' ' CD2' ' A' ' 35' ' ' HIS . 3.1 tmmt? -131.63 143.87 50.63 Favored 'General case' 0 N--CA 1.433 -1.299 0 CA-C-O 121.259 0.552 . . . . 0.0 110.638 -179.592 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.536 HG11 ' CD1' ' A' ' 51' ' ' TYR . 0.9 OUTLIER -112.06 141.06 28.72 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.429 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.182 178.672 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.426 HD11 ' NZ ' ' A' ' 25' ' ' LYS . 41.6 mm -106.46 115.84 48.92 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.133 0 N-CA-C 107.641 -1.244 . . . . 0.0 107.641 175.214 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . 0.441 ' HA2' ' HB ' ' A' ' 90' ' ' VAL . . . -86.14 169.47 41.99 Favored Glycine 0 N--CA 1.416 -2.651 0 C-N-CA 120.302 -0.951 . . . . 0.0 111.689 -177.008 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.25 -22.15 66.84 Favored 'General case' 0 C--N 1.299 -1.604 0 CA-C-O 121.634 0.73 . . . . 0.0 110.579 178.671 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -102.25 14.63 31.45 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.506 -0.77 . . . . 0.0 109.44 -179.338 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 46.2 m 69.99 19.71 6.8 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 115.574 -0.739 . . . . 0.0 111.005 179.812 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 11.1 t -76.71 114.55 15.58 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.172 178.86 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.45 ' HA ' ' O ' ' A' ' 26' ' ' VAL . 24.1 mt-10 -90.01 113.44 25.12 Favored 'General case' 0 CA--C 1.502 -0.896 0 CA-C-O 121.159 0.504 . . . . 0.0 110.696 177.614 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 30.1 mm -102.59 130.07 53.14 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.909 0 N-CA-C 108.152 -1.055 . . . . 0.0 108.152 176.378 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . 0.539 ' CD2' ' HG3' ' A' ' 25' ' ' LYS . 11.0 m170 -117.55 116.25 26.73 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 -177.148 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.518 ' HZ ' HG23 ' A' ' 26' ' ' VAL . 0.9 OUTLIER -129.28 170.08 14.06 Favored 'General case' 0 C--N 1.304 -1.397 0 CA-C-O 121.18 0.514 . . . . 0.0 111.452 -175.254 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.423 ' HB3' ' CD1' ' A' ' 21' ' ' TYR . 61.1 mmtt -121.44 121.64 38.0 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 -178.798 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.435 HG21 HD12 ' A' ' 47' ' ' LEU . 33.0 m -139.84 156.13 25.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-O 120.93 0.395 . . . . 0.0 110.439 179.545 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.527 ' O ' HG22 ' A' ' 42' ' ' THR . 79.2 tttt -86.55 163.13 17.65 Favored 'General case' 0 C--N 1.314 -0.94 0 O-C-N 121.964 -0.46 . . . . 0.0 110.794 -178.732 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . 0.483 ' O ' ' HG2' ' A' ' 78' ' ' LYS . 0.0 OUTLIER -71.89 -37.93 70.07 Favored 'General case' 0 CA--C 1.519 -0.238 0 N-CA-C 112.234 0.457 . . . . 0.0 112.234 -177.026 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 14.9 t -92.71 15.11 15.23 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-O 121.343 0.592 . . . . 0.0 111.608 -177.027 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . 0.527 HG22 ' O ' ' A' ' 39' ' ' LYS . 2.3 t -96.48 169.74 9.7 Favored 'General case' 0 C--N 1.32 -0.684 0 O-C-N 121.485 -0.76 . . . . 0.0 110.224 -179.267 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 29.8 m170 -85.81 142.24 29.07 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-O 121.4 0.619 . . . . 0.0 111.163 179.535 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.611 ' HB2' ' O ' ' A' ' 75' ' ' HIS . 0.2 OUTLIER -69.21 -17.16 63.75 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.559 -0.746 . . . . 0.0 109.686 -179.115 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.659 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -53.88 -45.65 71.13 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-N 115.728 -0.669 . . . . 0.0 112.602 -177.9 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.536 ' O ' ' HB2' ' A' ' 50' ' ' SER . 0.1 OUTLIER -69.89 -25.02 63.49 Favored 'General case' 0 C--O 1.219 -0.536 0 CA-C-O 121.297 0.57 . . . . 0.0 110.795 -178.266 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.558 ' HB3' HD13 ' A' ' 44' ' ' LEU . 7.8 tt -73.4 -47.29 43.14 Favored 'General case' 0 C--N 1.312 -1.062 0 CA-C-N 115.927 -0.579 . . . . 0.0 109.776 177.282 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.598 ' HG3' ' O ' ' A' ' 44' ' ' LEU . 26.7 mtpt -57.81 -47.59 82.16 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.605 -179.277 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.659 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 5.0 pt-20 -69.97 -34.52 73.5 Favored 'General case' 0 C--N 1.313 -0.981 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.446 -179.058 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.536 ' HB2' ' O ' ' A' ' 46' ' ' LYS . 7.9 t -65.63 -43.88 88.17 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.351 -177.682 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.536 ' CD1' HG11 ' A' ' 26' ' ' VAL . 1.7 p90 -76.51 -33.7 58.62 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 119.727 -0.789 . . . . 0.0 110.531 -178.593 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . 0.507 ' SG ' HD11 ' A' ' 62' ' ' LEU . 98.6 m -62.54 -44.54 96.1 Favored 'General case' 0 C--O 1.239 0.545 0 CA-C-O 121.252 0.549 . . . . 0.0 110.657 179.327 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 14.0 pt20 -69.28 -33.78 73.73 Favored 'General case' 0 N--CA 1.442 -0.832 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.508 -179.228 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 2.1 mmp_? -57.47 -40.05 77.72 Favored 'General case' 0 C--N 1.349 0.569 0 CA-C-O 121.179 0.514 . . . . 0.0 111.377 177.625 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 3.3 mt-30 -78.1 -20.96 51.17 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.236 0.541 . . . . 0.0 110.964 -179.819 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 82.86 29.1 35.83 Favored Glycine 0 N--CA 1.445 -0.72 0 C-N-CA 120.896 -0.668 . . . . 0.0 112.138 -179.542 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 34.6 m -128.39 150.85 75.44 Favored Pre-proline 0 C--N 1.325 -0.467 0 N-CA-C 110.211 -0.292 . . . . 0.0 110.211 -179.826 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . 0.582 ' HG2' ' OG ' ' A' ' 61' ' ' SER . 31.1 Cg_endo -70.61 152.84 65.18 Favored 'Trans proline' 0 N--CA 1.455 -0.755 0 C-N-CA 122.212 1.941 . . . . 0.0 112.212 179.349 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.41 ' HG2' ' SG ' ' A' ' 52' ' ' CYS . 81.2 mtp -68.65 -10.19 54.59 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 121.092 0.472 . . . . 0.0 111.729 -176.532 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . 0.512 ' OD1' ' HB2' ' A' ' 58' ' ' PRO . 2.1 p-10 -91.16 -11.99 36.78 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-O 121.137 0.494 . . . . 0.0 111.114 -179.991 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.582 ' OG ' ' HG2' ' A' ' 58' ' ' PRO . 74.9 m -83.21 -23.6 32.76 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-O 121.088 0.47 . . . . 0.0 111.87 -178.481 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.507 HD11 ' SG ' ' A' ' 52' ' ' CYS . 1.1 pp -124.65 171.79 9.77 Favored 'General case' 0 C--N 1.305 -1.369 0 N-CA-C 113.117 0.784 . . . . 0.0 113.117 -175.796 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.457 ' O ' ' HA ' ' A' ' 90' ' ' VAL . 51.3 mtm180 -121.11 113.88 20.65 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.584 -0.735 . . . . 0.0 110.851 -177.375 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -98.21 116.41 30.36 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-O 121.194 0.521 . . . . 0.0 111.513 179.943 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.495 HD11 ' HG2' ' A' ' 89' ' ' GLU . 0.0 OUTLIER -147.06 166.51 26.65 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 121.186 0.517 . . . . 0.0 110.597 178.956 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 83.0 t80 -147.38 136.13 22.02 Favored 'General case' 0 C--N 1.31 -1.141 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 177.672 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.454 ' HG2' HE21 ' A' ' 69' ' ' GLN . 7.0 pt-20 51.58 26.8 3.51 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 124.31 1.044 . . . . 0.0 112.028 -179.869 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 84.37 22.57 53.88 Favored Glycine 0 N--CA 1.448 -0.535 0 C-N-CA 120.808 -0.71 . . . . 0.0 112.611 -179.145 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . 0.454 HE21 ' HG2' ' A' ' 67' ' ' GLU . 2.5 pt20 -128.82 134.27 48.29 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 179.57 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 15.4 ptt180 -68.2 146.98 52.88 Favored 'General case' 0 C--N 1.306 -1.309 0 CA-C-O 121.368 0.604 . . . . 0.0 111.038 178.443 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.459 HG21 HD12 ' A' ' 44' ' ' LEU . 21.8 mm -94.65 117.54 38.63 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.13 0 CA-C-O 121.147 0.498 . . . . 0.0 110.041 179.11 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -95.78 160.99 14.21 Favored 'General case' 0 N--CA 1.435 -1.195 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 179.71 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . 0.432 ' CA ' ' HB3' ' A' ' 45' ' ' LYS . 55.1 m-20 -65.33 -22.99 66.89 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-O 121.665 0.745 . . . . 0.0 110.646 -179.511 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 12.4 m-80 -97.07 4.55 51.31 Favored 'General case' 0 C--N 1.311 -1.08 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.132 -178.08 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . 0.611 ' O ' ' HB2' ' A' ' 44' ' ' LEU . 4.8 m170 -83.68 146.7 28.09 Favored 'General case' 0 CA--C 1.508 -0.65 0 N-CA-C 109.43 -0.581 . . . . 0.0 109.43 178.874 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.417 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 59.7 p -120.24 155.11 56.26 Favored Pre-proline 0 C--N 1.311 -1.069 0 C-N-CA 120.867 -0.333 . . . . 0.0 111.012 178.3 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -59.22 -40.21 71.24 Favored 'Trans proline' 0 N--CA 1.461 -0.438 0 C-N-CA 122.607 2.205 . . . . 0.0 111.693 179.557 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . 0.483 ' HG2' ' O ' ' A' ' 40' ' ' MET . 0.0 OUTLIER -69.47 -36.2 76.34 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.852 0.358 . . . . 0.0 111.617 -178.042 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -74.93 -35.28 62.18 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.882 0.372 . . . . 0.0 111.246 -179.055 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.434 HD21 ' CG ' ' A' ' 75' ' ' HIS . 5.5 mt -80.55 -0.76 39.09 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.245 0.545 . . . . 0.0 110.819 179.728 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 76.36 45.76 13.85 Favored Glycine 0 CA--C 1.509 -0.317 0 CA-C-N 116.062 -0.517 . . . . 0.0 112.794 177.6 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 59.6 mtt -106.37 164.65 11.86 Favored 'General case' 0 C--N 1.311 -1.082 0 O-C-N 122.522 -0.399 . . . . 0.0 110.255 179.422 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.451 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 10.0 pt-20 -141.16 -166.24 2.13 Favored 'General case' 0 C--N 1.316 -0.885 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 177.584 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.422 ' O ' ' HB2' ' A' ' 85' ' ' GLU . 6.9 pt-20 -72.93 141.52 47.83 Favored 'General case' 0 N--CA 1.444 -0.774 0 C-N-CA 120.363 -0.535 . . . . 0.0 109.801 177.747 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . 0.422 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 66.5 mm-40 72.87 4.92 5.1 Favored 'General case' 0 C--N 1.32 -0.682 0 C-N-CA 123.722 0.809 . . . . 0.0 111.848 -179.109 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . 0.451 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 2.3 t70 -60.8 155.41 19.49 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 121.139 0.495 . . . . 0.0 110.179 176.862 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.471 ' HA ' ' O ' ' A' ' 25' ' ' LYS . 8.8 p -125.94 141.78 44.61 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.497 0 CA-C-O 121.406 0.622 . . . . 0.0 111.265 -177.011 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 3.7 mp -110.24 152.52 12.23 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.884 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 179.029 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.495 ' HG2' HD11 ' A' ' 65' ' ' LEU . 3.0 tt0 -103.32 130.9 50.71 Favored 'General case' 0 C--N 1.309 -1.153 0 CA-C-O 121.296 0.57 . . . . 0.0 111.127 -175.507 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . 0.457 ' HA ' ' O ' ' A' ' 63' ' ' ARG . 60.6 t -126.73 132.94 69.6 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.948 0 CA-C-O 121.588 0.708 . . . . 0.0 111.242 179.959 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . 0.417 ' HB2' ' HB2' ' A' ' 63' ' ' ARG . 76.3 m-85 -116.78 -178.22 3.38 Favored 'General case' 0 C--N 1.309 -1.182 0 CA-C-N 115.639 -0.71 . . . . 0.0 109.724 177.639 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . 0.429 ' HG3' ' H ' ' A' ' 94' ' ' GLN . 9.3 tp60 -109.66 145.63 36.18 Favored 'General case' 0 C--N 1.313 -0.982 0 N-CA-C 109.779 -0.452 . . . . 0.0 109.779 179.676 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -137.95 20.35 2.83 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.346 0.593 . . . . 0.0 110.296 175.57 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . 0.429 ' H ' ' HG3' ' A' ' 92' ' ' GLN . 97.6 mt-30 -61.91 -164.74 0.01 OUTLIER 'General case' 0 CA--C 1.542 0.645 0 CA-C-N 115.539 -0.755 . . . . 0.0 112.56 178.449 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 9.8 t -177.06 176.82 1.34 Allowed 'General case' 0 N--CA 1.445 -0.723 0 N-CA-C 109.836 -0.431 . . . . 0.0 109.836 -175.38 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -124.66 7.23 8.39 Favored Glycine 0 N--CA 1.44 -1.087 0 N-CA-C 110.021 -1.232 . . . . 0.0 110.021 178.288 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.432 -1.587 0 CA-C-O 118.141 -1.366 . . . . 0.0 110.888 -179.174 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 19.5 mmt . . . . . 0 N--CA 1.476 0.863 0 CA-C-O 121.243 0.544 . . . . 0.0 111.069 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 39.9 m -115.95 2.36 13.49 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.763 179.362 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 65.75 37.83 5.52 Favored 'General case' 0 N--CA 1.479 0.985 0 CA-C-O 121.406 0.622 . . . . 0.0 109.784 -179.166 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 42.0 mt-30 -58.43 -64.62 0.86 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.539 -177.619 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -162.44 158.08 23.33 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-O 120.804 0.335 . . . . 0.0 110.366 -178.664 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -134.74 130.81 36.77 Favored 'General case' 0 C--N 1.314 -0.958 0 CA-C-O 121.133 0.492 . . . . 0.0 110.053 175.655 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 51.5 mttp -120.27 152.27 54.55 Favored Pre-proline 0 N--CA 1.428 -1.55 0 CA-C-N 116.105 -0.498 . . . . 0.0 109.699 -179.423 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.488 ' HB3' ' HB2' ' A' ' 53' ' ' GLN . 17.4 Cg_exo -63.87 108.9 0.98 Allowed 'Trans proline' 0 N--CA 1.449 -1.125 0 C-N-CA 121.935 1.757 . . . . 0.0 109.523 175.32 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 15.8 m -78.3 133.58 37.62 Favored 'General case' 0 C--N 1.306 -1.3 0 CA-C-O 121.442 0.639 . . . . 0.0 111.826 -174.859 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 20.3 m -122.81 115.8 22.62 Favored 'General case' 0 N--CA 1.441 -0.916 0 N-CA-C 109.098 -0.704 . . . . 0.0 109.098 177.925 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -71.48 129.91 39.97 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-O 120.722 0.296 . . . . 0.0 110.552 -179.16 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -58.43 -52.75 64.33 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.622 179.368 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 84.4 mt -55.2 -61.82 2.07 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 121.151 0.5 . . . . 0.0 110.462 176.984 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 90.52 32.64 9.2 Favored Glycine 0 N--CA 1.442 -0.962 0 N-CA-C 111.125 -0.79 . . . . 0.0 111.125 179.52 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -123.98 101.58 7.31 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-O 121.374 0.607 . . . . 0.0 110.084 -178.333 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.422 ' N ' ' HD3' ' A' ' 16' ' ' LYS . 0.1 OUTLIER -107.42 150.0 27.26 Favored 'General case' 0 C--N 1.303 -1.417 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.109 179.692 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 21.1 ptmt -73.06 148.1 44.4 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-O 120.798 0.332 . . . . 0.0 110.195 179.843 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -162.5 -173.06 3.39 Favored 'General case' 0 N--CA 1.44 -0.941 0 CA-C-O 120.914 0.387 . . . . 0.0 110.656 -177.89 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 97.87 124.97 5.07 Favored Glycine 0 CA--C 1.503 -0.688 0 N-CA-C 111.495 -0.642 . . . . 0.0 111.495 -178.948 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 18.1 mm-40 64.21 63.2 0.8 Allowed 'General case' 0 CA--C 1.519 -0.245 0 CA-C-O 121.936 0.874 . . . . 0.0 110.019 -179.485 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.499 ' CZ ' ' HD3' ' A' ' 37' ' ' LYS . 6.3 p90 -132.74 176.25 8.62 Favored 'General case' 0 C--N 1.308 -1.212 0 CA-C-N 115.441 -0.799 . . . . 0.0 111.274 -179.332 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 24.0 pt -115.01 171.95 4.24 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.978 0 CA-C-O 121.372 0.605 . . . . 0.0 109.714 176.925 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 11.6 mtmt -114.61 144.46 43.36 Favored 'General case' 0 C--N 1.294 -1.805 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 -178.74 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.9 mp -139.05 161.3 37.72 Favored 'General case' 0 C--N 1.301 -1.52 0 CA-C-O 121.339 0.59 . . . . 0.0 110.945 175.051 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.437 ' O ' ' HA ' ' A' ' 87' ' ' VAL . 5.6 tmmm? -130.22 142.37 50.57 Favored 'General case' 0 N--CA 1.438 -1.043 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.377 -179.43 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.533 HG23 ' HZ ' ' A' ' 36' ' ' PHE . 0.9 OUTLIER -113.14 142.35 25.85 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.411 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.392 179.844 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 45.0 mm -103.82 113.36 40.49 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.251 0 N-CA-C 107.381 -1.34 . . . . 0.0 107.381 175.147 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -74.64 -177.56 38.74 Favored Glycine 0 N--CA 1.432 -1.598 0 C-N-CA 120.755 -0.736 . . . . 0.0 113.105 -175.649 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.848 ' H ' ' NE2' ' A' ' 29' ' ' GLN . 0.0 OUTLIER -70.0 -26.21 63.97 Favored 'General case' 0 C--N 1.305 -1.367 0 N-CA-C 108.532 -0.914 . . . . 0.0 108.532 -178.672 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 37.0 t70 -102.83 12.51 36.1 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 114.868 -1.06 . . . . 0.0 108.47 177.09 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 49.9 m 71.15 20.66 5.07 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 114.974 -1.012 . . . . 0.0 110.905 -179.141 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 8.2 t -67.7 120.56 14.27 Favored 'General case' 0 N--CA 1.447 -0.597 0 N-CA-C 108.779 -0.823 . . . . 0.0 108.779 177.711 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.524 ' HA ' ' O ' ' A' ' 26' ' ' VAL . 46.5 mt-10 -89.15 108.97 19.9 Favored 'General case' 0 C--N 1.313 -0.986 0 CA-C-O 121.338 0.59 . . . . 0.0 111.217 -178.138 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 38.9 mm -98.54 136.85 27.89 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.562 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 177.68 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 11.7 m170 -117.34 133.31 56.12 Favored 'General case' 0 C--N 1.316 -0.854 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 -178.388 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.533 ' HZ ' HG23 ' A' ' 26' ' ' VAL . 1.7 p90 -147.2 170.35 17.42 Favored 'General case' 0 C--N 1.309 -1.178 0 CA-C-O 121.376 0.608 . . . . 0.0 111.607 -178.35 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.499 ' HD3' ' CZ ' ' A' ' 21' ' ' TYR . 15.1 ptpt -130.7 119.91 23.08 Favored 'General case' 0 C--N 1.314 -0.975 0 CA-C-N 115.584 -0.734 . . . . 0.0 111.027 -178.543 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.426 HG21 HD12 ' A' ' 47' ' ' LEU . 24.4 m -139.84 159.57 27.0 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 116.23 -0.441 . . . . 0.0 109.968 -179.26 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 25.9 mtpp -77.11 176.17 8.96 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-O 121.342 0.592 . . . . 0.0 111.18 179.347 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.5 -35.79 19.39 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.874 178.323 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 13.8 t -93.8 10.52 32.78 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 121.292 0.567 . . . . 0.0 111.607 -176.181 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 7.2 t -94.74 173.65 7.5 Favored 'General case' 0 C--N 1.32 -0.698 0 O-C-N 121.779 -0.575 . . . . 0.0 110.201 -179.617 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 46.0 m170 -90.4 147.72 23.26 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 121.637 0.732 . . . . 0.0 111.611 -179.101 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.492 ' O ' ' HG2' ' A' ' 48' ' ' LYS . 1.3 mm? -70.23 -13.22 62.08 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.426 -0.806 . . . . 0.0 110.707 178.754 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.542 ' HB3' ' HB2' ' A' ' 73' ' ' ASP . 0.0 OUTLIER -54.26 -43.23 70.77 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.986 -178.899 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -71.19 -33.35 69.88 Favored 'General case' 0 C--O 1.2 -1.536 0 CA-C-O 121.069 0.461 . . . . 0.0 110.443 178.918 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.426 HD12 HG21 ' A' ' 38' ' ' VAL . 9.4 tt -69.14 -50.96 43.16 Favored 'General case' 0 C--N 1.309 -1.187 0 CA-C-O 121.105 0.479 . . . . 0.0 110.793 -178.855 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.492 ' HG2' ' O ' ' A' ' 44' ' ' LEU . 4.5 ptmm? -62.17 -40.62 96.61 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.542 -178.966 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.7 -32.86 68.26 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.11 0.481 . . . . 0.0 110.468 177.986 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.651 ' O ' ' HG2' ' A' ' 54' ' ' ARG . 5.3 m -68.81 -40.98 79.24 Favored 'General case' 0 N--CA 1.45 -0.445 0 N-CA-C 112.52 0.563 . . . . 0.0 112.52 -177.822 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.475 ' CD1' HG11 ' A' ' 26' ' ' VAL . 2.0 p90 -76.45 -33.06 58.76 Favored 'General case' 0 C--N 1.317 -0.809 0 C-N-CA 119.005 -1.078 . . . . 0.0 110.203 179.352 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . 0.615 ' SG ' HD11 ' A' ' 62' ' ' LEU . 92.0 m -61.37 -45.65 93.47 Favored 'General case' 0 CA--C 1.511 -0.521 0 CA-C-O 121.221 0.534 . . . . 0.0 110.19 178.597 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.488 ' HB2' ' HB3' ' A' ' 8' ' ' PRO . 13.8 pt20 -65.44 -35.67 81.61 Favored 'General case' 0 N--CA 1.442 -0.845 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.536 -179.663 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.651 ' HG2' ' O ' ' A' ' 50' ' ' SER . 41.9 mmt-85 -57.36 -39.1 75.26 Favored 'General case' 0 C--N 1.348 0.524 0 CA-C-O 121.123 0.487 . . . . 0.0 111.388 177.327 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.432 HE21 ' HB2' ' A' ' 55' ' ' GLN . 3.0 mt-30 -78.53 -21.78 48.3 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-O 120.958 0.408 . . . . 0.0 110.783 179.859 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 82.9 29.74 33.85 Favored Glycine 0 N--CA 1.442 -0.931 0 C-N-CA 120.434 -0.888 . . . . 0.0 111.727 179.348 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 35.9 m -130.43 148.26 69.2 Favored Pre-proline 0 C--N 1.323 -0.584 0 O-C-N 122.454 -0.439 . . . . 0.0 110.645 -178.969 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 29.1 Cg_endo -65.78 150.73 85.79 Favored 'Trans proline' 0 N--CA 1.458 -0.602 0 C-N-CA 122.27 1.98 . . . . 0.0 111.72 177.971 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 73.6 mtp -67.49 -7.79 28.51 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-N 116.113 -0.494 . . . . 0.0 112.236 -176.661 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 24.2 p30 -90.41 -12.19 38.22 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 121.387 0.613 . . . . 0.0 111.162 -179.194 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 68.1 m -84.94 -20.32 30.82 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.775 -179.906 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.615 HD11 ' SG ' ' A' ' 52' ' ' CYS . 1.4 pp -136.66 157.44 46.75 Favored 'General case' 0 C--N 1.31 -1.115 0 CA-C-O 121.71 0.767 . . . . 0.0 113.027 -176.545 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.439 ' HG3' ' HB2' ' A' ' 91' ' ' TYR . 1.2 ptp180 -115.68 138.1 51.43 Favored 'General case' 0 C--N 1.314 -0.953 0 CA-C-N 115.049 -0.978 . . . . 0.0 112.376 179.224 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.444 ' CZ ' ' HE2' ' A' ' 48' ' ' LYS . 0.1 OUTLIER -114.14 120.84 41.88 Favored 'General case' 0 C--N 1.313 -0.979 0 CA-C-N 114.983 -1.008 . . . . 0.0 110.541 -176.968 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.453 ' C ' HD22 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -142.94 164.76 29.21 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.33 0.586 . . . . 0.0 111.043 179.298 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 92.3 t80 -147.05 135.33 21.69 Favored 'General case' 0 C--N 1.314 -0.952 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 178.918 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.447 ' HG2' HE21 ' A' ' 69' ' ' GLN . 6.6 pt-20 49.33 26.3 1.54 Allowed 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 124.406 1.082 . . . . 0.0 112.549 -179.17 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 87.57 21.76 46.42 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.913 -0.661 . . . . 0.0 112.934 -179.082 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . 0.447 HE21 ' HG2' ' A' ' 67' ' ' GLU . 2.7 pt20 -129.93 136.78 49.87 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 109.365 -0.606 . . . . 0.0 109.365 -179.808 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 3.1 ptt180 -68.67 147.5 51.78 Favored 'General case' 0 C--N 1.308 -1.231 0 CA-C-O 121.585 0.707 . . . . 0.0 111.02 177.671 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 21.8 mm -97.52 118.55 44.19 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.227 0 N-CA-C 109.708 -0.478 . . . . 0.0 109.708 179.014 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -103.28 167.05 10.06 Favored 'General case' 0 N--CA 1.442 -0.864 0 CA-C-O 120.881 0.372 . . . . 0.0 110.211 -178.854 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . 0.542 ' HB2' ' HB3' ' A' ' 45' ' ' LYS . 8.6 p-10 -66.6 -22.06 66.13 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.779 -178.236 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 9.2 m-80 -98.93 1.78 45.91 Favored 'General case' 0 CA--C 1.51 -0.568 0 CA-C-O 121.238 0.542 . . . . 0.0 110.205 -178.553 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . 0.45 ' CG ' HD21 ' A' ' 80' ' ' LEU . 3.2 m170 -81.06 141.72 34.06 Favored 'General case' 0 C--N 1.318 -0.799 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 179.714 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.426 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 70.2 p -116.64 153.58 49.1 Favored Pre-proline 0 C--N 1.307 -1.245 0 C-N-CA 121.072 -0.251 . . . . 0.0 110.675 179.242 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_exo -61.36 -37.75 69.95 Favored 'Trans proline' 0 N--CA 1.459 -0.549 0 C-N-CA 122.463 2.109 . . . . 0.0 111.557 179.796 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . 0.515 ' HG3' ' N ' ' A' ' 79' ' ' GLU . 33.1 pttt -68.83 -38.65 79.97 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.92 -178.713 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.515 ' N ' ' HG3' ' A' ' 78' ' ' LYS . 11.8 mm-40 -72.74 -38.29 67.44 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-O 120.953 0.406 . . . . 0.0 111.098 -178.808 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.45 HD21 ' CG ' ' A' ' 75' ' ' HIS . 5.2 mt -76.46 -6.79 53.29 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-O 121.485 0.66 . . . . 0.0 110.468 179.39 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 79.44 43.08 10.74 Favored Glycine 0 N--CA 1.452 -0.258 0 CA-C-N 115.905 -0.588 . . . . 0.0 112.954 177.201 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 60.6 mtt -102.82 165.6 10.96 Favored 'General case' 0 C--N 1.314 -0.937 0 N-CA-C 109.835 -0.431 . . . . 0.0 109.835 179.126 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -142.66 -171.45 3.43 Favored 'General case' 0 C--N 1.314 -0.952 0 N-CA-C 109.37 -0.604 . . . . 0.0 109.37 177.663 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -71.24 139.01 49.91 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-O 121.435 0.636 . . . . 0.0 111.145 -178.845 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 17.7 tp10 74.51 5.72 4.53 Favored 'General case' 0 C--N 1.321 -0.659 0 C-N-CA 125.012 1.325 . . . . 0.0 111.761 179.229 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -66.22 165.91 12.95 Favored 'General case' 0 C--O 1.238 0.475 0 CA-C-O 121.05 0.452 . . . . 0.0 110.763 176.941 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.437 ' HA ' ' O ' ' A' ' 25' ' ' LYS . 14.9 p -127.55 145.18 35.37 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.876 0 CA-C-O 121.443 0.64 . . . . 0.0 112.054 -175.299 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 3.6 mp -115.56 152.86 17.17 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 177.527 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 -107.19 138.19 43.84 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.038 0.447 . . . . 0.0 110.601 -175.981 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 84.9 t -129.74 137.38 56.85 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.75 0 CA-C-O 121.299 0.571 . . . . 0.0 111.351 -179.3 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . 0.439 ' HB2' ' HG3' ' A' ' 63' ' ' ARG . 96.5 m-85 -123.77 167.09 14.49 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.09 178.802 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 7.0 tp60 -95.39 139.01 32.29 Favored 'General case' 0 C--N 1.31 -1.113 0 N-CA-C 109.841 -0.429 . . . . 0.0 109.841 -179.654 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -127.19 18.98 7.02 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.366 0.603 . . . . 0.0 110.281 176.911 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 98.6 mt-30 -63.63 -161.75 0.01 OUTLIER 'General case' 0 CA--C 1.541 0.599 0 CA-C-N 115.472 -0.785 . . . . 0.0 111.203 176.803 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 9.3 t -120.11 -25.44 5.75 Favored 'General case' 0 C--N 1.316 -0.873 0 O-C-N 121.595 -0.691 . . . . 0.0 110.911 -176.862 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 142.01 122.33 1.77 Allowed Glycine 0 N--CA 1.438 -1.187 0 N-CA-C 111.088 -0.805 . . . . 0.0 111.088 -179.826 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.342 0 CA-C-O 118.775 -1.014 . . . . 0.0 111.56 -178.68 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.4 mtt . . . . . 0 N--CA 1.475 0.825 0 CA-C-O 120.92 0.391 . . . . 0.0 110.972 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 73.0 m 67.99 13.54 9.16 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-O 121.882 0.849 . . . . 0.0 110.434 -178.989 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 11.5 p-10 -102.51 1.63 35.3 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-N 114.972 -1.013 . . . . 0.0 110.232 -177.64 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 6.4 pt20 -134.91 15.9 3.56 Favored 'General case' 0 C--N 1.313 -1.012 0 CA-C-O 121.792 0.806 . . . . 0.0 110.093 -174.177 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -137.26 151.88 49.19 Favored 'General case' 0 C--N 1.304 -1.391 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.345 -177.492 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -167.57 146.15 4.79 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 116.184 -0.462 . . . . 0.0 109.917 179.709 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 21.8 ptmt -141.21 145.94 40.76 Favored Pre-proline 0 C--N 1.316 -0.862 0 N-CA-C 110.286 -0.264 . . . . 0.0 110.286 178.76 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 69.8 Cg_endo -77.9 166.54 25.0 Favored 'Trans proline' 0 C--O 1.242 0.683 0 C-N-CA 122.314 2.01 . . . . 0.0 111.597 177.818 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 23.1 t -166.15 173.21 10.46 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 110.007 -0.368 . . . . 0.0 110.007 -178.503 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 23.8 m -145.4 -78.33 0.19 Allowed 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.112 0.482 . . . . 0.0 110.521 179.272 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -154.42 157.58 38.7 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.933 0.397 . . . . 0.0 110.098 -178.76 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -119.04 157.37 27.94 Favored 'General case' 0 C--N 1.315 -0.899 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 178.952 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 1.3 pp -161.06 160.39 30.43 Favored 'General case' 0 C--N 1.316 -0.887 0 O-C-N 121.866 -0.522 . . . . 0.0 110.597 -178.671 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -158.13 30.2 0.48 Allowed Glycine 0 CA--C 1.503 -0.697 0 C-N-CA 121.019 -0.61 . . . . 0.0 112.084 179.008 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -59.66 127.63 32.94 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-O 120.871 0.367 . . . . 0.0 110.4 178.697 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 30.5 mmmt -100.73 -165.05 1.17 Allowed 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.917 0.389 . . . . 0.0 110.499 -178.654 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.566 ' CD ' ' H ' ' A' ' 18' ' ' GLU . 3.7 tmtp? -65.67 172.12 3.69 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.425 0.631 . . . . 0.0 110.685 178.446 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.566 ' H ' ' CD ' ' A' ' 17' ' ' LYS . 1.2 pm0 -157.16 174.92 14.74 Favored 'General case' 0 N--CA 1.434 -1.264 0 CA-C-N 115.984 -0.553 . . . . 0.0 109.642 -177.019 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -120.07 21.66 8.78 Favored Glycine 0 N--CA 1.441 -1.032 0 N-CA-C 110.8 -0.92 . . . . 0.0 110.8 175.632 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 24.9 mm-40 61.11 43.6 11.03 Favored 'General case' 0 C--N 1.344 0.35 0 CA-C-O 121.818 0.818 . . . . 0.0 110.274 -178.955 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.424 ' CE1' ' HB2' ' A' ' 37' ' ' LYS . 55.4 p90 -115.24 -179.55 3.67 Favored 'General case' 0 C--N 1.309 -1.177 0 CA-C-N 115.027 -0.988 . . . . 0.0 109.987 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 26.3 pt -125.68 172.19 13.44 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.889 0 CA-C-O 121.463 0.649 . . . . 0.0 110.593 178.029 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 3.7 mtmt -120.1 141.95 49.34 Favored 'General case' 0 C--N 1.299 -1.599 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 -179.271 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.4 mp -136.02 162.51 32.68 Favored 'General case' 0 C--N 1.305 -1.361 0 CA-C-O 121.283 0.563 . . . . 0.0 111.02 177.218 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.418 ' O ' ' HA ' ' A' ' 87' ' ' VAL . 4.9 tmmm? -131.4 142.54 50.06 Favored 'General case' 0 N--CA 1.437 -1.092 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.386 -179.114 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.515 HG23 ' HZ ' ' A' ' 36' ' ' PHE . 0.9 OUTLIER -113.13 142.05 26.83 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.447 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.232 179.892 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.458 ' O ' ' HB ' ' A' ' 90' ' ' VAL . 43.7 mm -104.32 115.54 46.44 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.952 0 N-CA-C 107.373 -1.343 . . . . 0.0 107.373 175.373 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -78.85 179.09 52.97 Favored Glycine 0 N--CA 1.431 -1.669 0 C-N-CA 120.795 -0.717 . . . . 0.0 113.138 -175.683 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.836 ' H ' ' NE2' ' A' ' 29' ' ' GLN . 0.0 OUTLIER -74.7 -22.26 58.94 Favored 'General case' 0 N--CA 1.436 -1.167 0 CA-C-O 121.996 0.903 . . . . 0.0 108.73 -178.105 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -102.62 12.57 36.19 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.032 -0.985 . . . . 0.0 108.525 176.171 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 37.1 t 73.36 18.09 3.76 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 115.174 -0.921 . . . . 0.0 110.418 -179.541 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 7.9 t -70.44 116.57 10.92 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 179.058 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.493 ' HA ' ' O ' ' A' ' 26' ' ' VAL . 37.0 mt-10 -87.76 110.59 20.57 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-O 121.144 0.497 . . . . 0.0 110.484 179.979 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 32.1 mm -98.57 139.04 21.4 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.573 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 178.235 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 10.1 m170 -119.37 131.73 55.73 Favored 'General case' 0 C--N 1.315 -0.905 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 -178.962 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.515 ' HZ ' HG23 ' A' ' 26' ' ' VAL . 1.4 p90 -146.88 173.42 12.42 Favored 'General case' 0 C--N 1.309 -1.167 0 CA-C-O 121.15 0.5 . . . . 0.0 110.862 -178.463 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.424 ' HB2' ' CE1' ' A' ' 21' ' ' TYR . 17.6 ptpt -134.29 120.65 20.22 Favored 'General case' 0 C--N 1.314 -0.951 0 CA-C-O 121.191 0.519 . . . . 0.0 111.137 -179.144 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 26.3 m -137.97 162.47 31.26 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 N-CA-C 109.406 -0.59 . . . . 0.0 109.406 -179.743 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.512 ' O ' HG22 ' A' ' 42' ' ' THR . 40.6 tttp -86.79 163.26 17.36 Favored 'General case' 0 C--N 1.313 -0.988 0 O-C-N 121.519 -0.738 . . . . 0.0 110.947 -179.596 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . 0.401 ' H ' ' HG2' ' A' ' 39' ' ' LYS . 0.0 OUTLIER -65.82 -41.72 91.49 Favored 'General case' 0 CA--C 1.517 -0.298 0 N-CA-C 112.79 0.663 . . . . 0.0 112.79 -177.808 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 11.9 t -96.11 13.14 28.22 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-O 121.068 0.461 . . . . 0.0 112.113 -174.988 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . 0.512 HG22 ' O ' ' A' ' 39' ' ' LYS . 2.0 t -91.03 161.88 14.94 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 179.666 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . 0.428 ' O ' ' HG2' ' A' ' 46' ' ' LYS . 42.5 m170 -75.06 138.86 42.44 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-O 121.589 0.709 . . . . 0.0 111.572 -179.979 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.634 HD13 ' HB3' ' A' ' 47' ' ' LEU . 0.2 OUTLIER -67.94 -15.4 63.59 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.219 -0.901 . . . . 0.0 109.972 -179.02 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.679 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -53.35 -45.97 69.36 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.844 -0.616 . . . . 0.0 112.433 -177.952 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.428 ' HG2' ' O ' ' A' ' 43' ' ' HIS . 21.8 ptmt -65.82 -29.37 69.83 Favored 'General case' 0 C--O 1.218 -0.562 0 CA-C-O 121.345 0.593 . . . . 0.0 110.579 -178.528 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.634 ' HB3' HD13 ' A' ' 44' ' ' LEU . 7.7 tt -72.97 -46.47 52.16 Favored 'General case' 0 C--N 1.311 -1.076 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.925 -179.596 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.607 ' HG3' ' O ' ' A' ' 44' ' ' LEU . 26.8 mtpt -58.29 -48.79 79.37 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-O 121.512 0.672 . . . . 0.0 110.185 -179.142 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.679 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 7.0 pt-20 -71.16 -31.32 67.53 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.976 -178.793 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.45 ' O ' ' HG2' ' A' ' 54' ' ' ARG . 38.0 t -65.44 -45.69 82.84 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.979 0.419 . . . . 0.0 111.283 -179.811 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.495 ' CD1' HG11 ' A' ' 26' ' ' VAL . 2.1 p90 -76.47 -32.64 58.49 Favored 'General case' 0 N--CA 1.443 -0.786 0 C-N-CA 119.86 -0.736 . . . . 0.0 110.539 -177.378 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . 0.488 ' SG ' ' HG2' ' A' ' 59' ' ' MET . 99.7 m -64.15 -44.15 92.99 Favored 'General case' 0 CA--C 1.509 -0.634 0 CA-C-O 121.105 0.479 . . . . 0.0 110.547 179.436 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 13.5 pt20 -67.73 -33.46 74.92 Favored 'General case' 0 N--CA 1.443 -0.779 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.274 -179.668 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.45 ' HG2' ' O ' ' A' ' 50' ' ' SER . 13.7 mmt180 -57.5 -38.16 74.17 Favored 'General case' 0 C--N 1.348 0.524 0 CA-C-O 121.018 0.437 . . . . 0.0 111.042 177.055 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.428 HE21 ' HB2' ' A' ' 55' ' ' GLN . 3.7 mt-30 -82.19 -22.47 35.96 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.968 -179.746 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 82.94 29.18 35.26 Favored Glycine 0 N--CA 1.443 -0.849 0 C-N-CA 120.548 -0.834 . . . . 0.0 111.886 -179.868 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 33.9 m -125.56 150.9 69.46 Favored Pre-proline 0 C--N 1.325 -0.467 0 O-C-N 122.45 -0.441 . . . . 0.0 110.649 -178.661 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . 0.502 ' HG2' ' OG ' ' A' ' 61' ' ' SER . 43.4 Cg_endo -71.01 149.9 59.74 Favored 'Trans proline' 0 N--CA 1.453 -0.871 0 C-N-CA 122.295 1.997 . . . . 0.0 111.856 177.277 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.488 ' HG2' ' SG ' ' A' ' 52' ' ' CYS . 80.6 mtp -70.1 -7.55 42.38 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.779 -177.279 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 31.3 p30 -89.12 -11.98 42.39 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.472 0.653 . . . . 0.0 110.968 179.272 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.502 ' OG ' ' HG2' ' A' ' 58' ' ' PRO . 70.3 m -90.81 -19.05 23.87 Favored 'General case' 0 N--CA 1.439 -0.986 0 N-CA-C 112.459 0.54 . . . . 0.0 112.459 -178.122 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.471 HD11 ' SG ' ' A' ' 52' ' ' CYS . 1.4 pp -128.09 167.89 16.13 Favored 'General case' 0 C--N 1.313 -1.0 0 N-CA-C 113.139 0.792 . . . . 0.0 113.139 -177.674 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.499 ' O ' ' HA ' ' A' ' 90' ' ' VAL . 35.6 mtm180 -118.66 118.29 31.26 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.261 -0.881 . . . . 0.0 110.669 -177.566 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -101.56 112.41 24.95 Favored 'General case' 0 C--N 1.312 -1.037 0 CA-C-O 121.134 0.492 . . . . 0.0 110.723 178.704 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.462 ' C ' HD22 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -141.52 164.62 29.73 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-O 121.528 0.68 . . . . 0.0 111.461 -179.377 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 88.3 t80 -144.77 133.81 22.68 Favored 'General case' 0 C--N 1.308 -1.198 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 177.733 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 49.36 29.59 2.85 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 124.264 1.025 . . . . 0.0 112.288 -178.884 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 87.26 16.28 60.94 Favored Glycine 0 N--CA 1.446 -0.681 0 C-N-CA 120.969 -0.634 . . . . 0.0 113.599 179.593 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 2.7 pt20 -125.86 135.73 52.28 Favored 'General case' 0 C--N 1.32 -0.698 0 O-C-N 122.254 -0.556 . . . . 0.0 109.623 -178.907 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.417 ' H ' ' HD2' ' A' ' 70' ' ' ARG . 0.2 OUTLIER -70.48 148.64 48.05 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-O 121.667 0.746 . . . . 0.0 110.379 177.792 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.486 HG21 HD12 ' A' ' 44' ' ' LEU . 23.4 mm -96.47 122.42 47.95 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.917 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.049 -179.278 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -95.31 166.07 12.07 Favored 'General case' 0 N--CA 1.436 -1.158 0 N-CA-C 109.697 -0.482 . . . . 0.0 109.697 -179.786 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . 0.422 ' CA ' ' HB3' ' A' ' 45' ' ' LYS . 11.8 p-10 -71.18 -21.04 62.21 Favored 'General case' 0 C--N 1.31 -1.121 0 CA-C-O 121.4 0.619 . . . . 0.0 110.773 -179.598 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 13.2 m-80 -98.73 4.0 47.71 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-O 121.175 0.512 . . . . 0.0 110.152 179.437 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . 0.601 ' O ' ' HB2' ' A' ' 44' ' ' LEU . 3.2 m170 -83.16 146.52 28.59 Favored 'General case' 0 CA--C 1.503 -0.862 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 -179.875 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.499 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 69.0 p -122.25 155.89 61.1 Favored Pre-proline 0 C--N 1.306 -1.308 0 C-N-CA 121.041 -0.264 . . . . 0.0 110.976 178.53 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -60.79 -41.67 44.26 Favored 'Trans proline' 0 N--CA 1.459 -0.533 0 C-N-CA 122.418 2.079 . . . . 0.0 111.01 179.619 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . 0.525 ' HG3' ' N ' ' A' ' 79' ' ' GLU . 44.6 pttt -65.28 -41.56 94.04 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.106 -178.618 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.525 ' N ' ' HG3' ' A' ' 78' ' ' LYS . 60.2 mm-40 -71.2 -36.14 71.81 Favored 'General case' 0 N--CA 1.445 -0.725 0 CA-C-O 120.999 0.428 . . . . 0.0 111.176 -177.661 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.499 ' HG ' ' O ' ' A' ' 76' ' ' THR . 5.9 mt -79.22 -6.05 55.71 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.202 0.525 . . . . 0.0 110.908 179.922 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 83.14 42.37 8.07 Favored Glycine 0 N--CA 1.454 -0.16 0 C-N-CA 121.032 -0.604 . . . . 0.0 113.027 177.855 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 61.1 mtt -103.59 165.89 10.76 Favored 'General case' 0 C--N 1.315 -0.914 0 O-C-N 122.314 -0.521 . . . . 0.0 109.885 178.775 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.415 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 10.1 pt-20 -137.22 -172.12 3.12 Favored 'General case' 0 C--N 1.312 -1.046 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 178.455 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -76.93 141.88 40.3 Favored 'General case' 0 N--CA 1.444 -0.743 0 C-N-CA 119.52 -0.872 . . . . 0.0 110.56 179.6 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 77.8 3.22 2.96 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 124.779 1.232 . . . . 0.0 110.71 -178.93 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . 0.415 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 1.6 t0 -63.05 164.74 7.91 Favored 'General case' 0 C--O 1.239 0.551 0 CA-C-O 121.249 0.547 . . . . 0.0 111.035 177.874 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.418 ' HA ' ' O ' ' A' ' 25' ' ' LYS . 7.9 p -128.34 145.01 36.08 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.067 0 CA-C-O 121.288 0.566 . . . . 0.0 111.338 -176.996 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 3.7 mp -113.88 153.7 15.38 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.825 0 N-CA-C 109.095 -0.705 . . . . 0.0 109.095 177.86 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -104.0 135.95 44.55 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-O 120.918 0.39 . . . . 0.0 110.545 -175.643 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . 0.499 ' HA ' ' O ' ' A' ' 63' ' ' ARG . 57.9 t -129.84 134.0 63.8 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.854 0 CA-C-O 121.391 0.615 . . . . 0.0 110.904 178.356 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 83.3 m-85 -122.78 176.0 6.22 Favored 'General case' 0 C--N 1.313 -0.994 0 CA-C-N 115.962 -0.563 . . . . 0.0 109.492 178.819 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 6.7 tp60 -101.08 146.77 27.02 Favored 'General case' 0 C--N 1.305 -1.366 0 N-CA-C 109.705 -0.48 . . . . 0.0 109.705 178.87 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -134.25 20.57 3.71 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.452 0.644 . . . . 0.0 110.454 175.695 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . 0.403 HE21 ' HB3' ' A' ' 61' ' ' SER . 98.0 mt-30 -67.96 -154.85 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.247 175.928 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 7.4 t -152.0 129.22 11.2 Favored 'General case' 0 C--N 1.316 -0.855 0 O-C-N 121.52 -0.738 . . . . 0.0 111.073 -179.661 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -132.05 -86.41 0.34 Allowed Glycine 0 N--CA 1.436 -1.33 0 CA-C-N 115.762 -0.653 . . . . 0.0 111.485 178.521 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.441 -1.029 0 CA-C-O 118.884 -0.953 . . . . 0.0 111.651 -179.598 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.5 ppp? . . . . . 0 N--CA 1.479 0.996 0 N-CA-C 111.837 0.31 . . . . 0.0 111.837 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 12.3 p -39.27 -66.23 0.31 Allowed 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.902 0.881 . . . . 0.0 111.624 179.508 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -130.22 -4.06 4.41 Favored 'General case' 0 C--N 1.304 -1.405 0 CA-C-O 122.154 0.978 . . . . 0.0 109.117 176.716 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 33.0 mt-30 -100.2 25.93 7.03 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.157 -0.928 . . . . 0.0 111.187 -176.166 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 14.1 pt-20 -70.63 149.5 46.98 Favored 'General case' 0 C--N 1.312 -1.034 0 C-N-CA 120.614 -0.434 . . . . 0.0 109.841 178.963 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -84.48 132.22 34.57 Favored 'General case' 0 C--N 1.31 -1.118 0 CA-C-O 120.925 0.393 . . . . 0.0 110.461 -178.77 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -155.23 146.09 16.36 Favored Pre-proline 0 C--N 1.319 -0.721 0 CA-C-O 120.653 0.263 . . . . 0.0 111.155 -178.504 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.49 ' HA ' ' SD ' ' A' ' 59' ' ' MET . 72.6 Cg_endo -79.14 137.97 13.96 Favored 'Trans proline' 0 C--O 1.241 0.66 0 C-N-CA 122.651 2.234 . . . . 0.0 112.758 179.818 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 30.9 p -77.55 174.11 11.25 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.21 0.529 . . . . 0.0 111.08 176.495 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 14.6 t -120.79 20.41 11.67 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 122.29 1.043 . . . . 0.0 109.405 178.799 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -100.12 166.33 11.07 Favored 'General case' 0 C--N 1.311 -1.073 0 CA-C-N 115.242 -0.89 . . . . 0.0 111.928 -177.852 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.406 ' HA ' ' OE1' ' A' ' 53' ' ' GLN . 22.6 t70 -119.77 8.27 11.14 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-O 121.974 0.892 . . . . 0.0 109.445 177.491 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -145.77 60.35 1.26 Allowed 'General case' 0 CA--C 1.484 -1.593 0 CA-C-O 122.953 1.358 . . . . 0.0 111.151 -177.834 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -77.44 31.52 1.63 Allowed Glycine 1 C--N 1.244 -4.546 0 CA-C-N 113.401 -1.727 . . . . 0.0 113.079 179.797 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -113.9 128.6 56.47 Favored 'General case' 0 C--N 1.319 -0.748 0 O-C-N 122.236 -0.567 . . . . 0.0 111.059 178.952 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 26.4 mmmt -107.66 172.72 6.67 Favored 'General case' 0 C--N 1.315 -0.91 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 -179.988 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.539 ' HD2' ' N ' ' A' ' 18' ' ' GLU . 3.9 tmmm? -61.64 150.15 37.25 Favored 'General case' 0 C--O 1.238 0.498 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 176.882 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.539 ' N ' ' HD2' ' A' ' 17' ' ' LYS . 35.3 mt-10 -136.78 -119.56 0.15 Allowed 'General case' 0 C--N 1.317 -0.812 0 CA-C-O 120.932 0.396 . . . . 0.0 111.738 -176.008 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.411 ' H ' ' HD1' ' A' ' 21' ' ' TYR . . . 100.23 117.73 4.11 Favored Glycine 0 N--CA 1.447 -0.589 0 N-CA-C 109.673 -1.371 . . . . 0.0 109.673 -176.186 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 22.0 mm-40 76.05 54.8 0.05 Allowed 'General case' 0 C--N 1.346 0.452 0 N-CA-C 108.083 -1.08 . . . . 0.0 108.083 -175.802 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.446 ' HB3' ' HG2' ' A' ' 39' ' ' LYS . 37.7 p90 -119.85 176.88 5.19 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.009 -0.996 . . . . 0.0 112.507 -175.187 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.554 ' HB ' ' HA ' ' A' ' 84' ' ' GLU . 19.9 pt -120.01 172.06 7.59 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.024 0 CA-C-N 114.851 -1.068 . . . . 0.0 110.566 178.833 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.476 ' HD3' ' N ' ' A' ' 23' ' ' LYS . 0.0 OUTLIER -121.51 143.44 49.27 Favored 'General case' 0 C--N 1.308 -1.201 0 N-CA-C 108.706 -0.85 . . . . 0.0 108.706 -179.489 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.4 mp -138.0 166.62 23.64 Favored 'General case' 0 C--N 1.306 -1.294 0 CA-C-O 121.256 0.551 . . . . 0.0 111.195 177.606 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 4.8 tmmm? -134.0 144.08 48.52 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.518 -179.917 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.609 ' O ' ' HA ' ' A' ' 33' ' ' GLU . 0.9 OUTLIER -115.41 141.54 32.01 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.159 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.707 -179.932 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.47 HD13 ' HG2' ' A' ' 33' ' ' GLU . 35.4 mm -111.26 99.57 8.97 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.728 0 N-CA-C 108.234 -1.024 . . . . 0.0 108.234 175.827 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . 0.671 ' HA3' ' OG ' ' A' ' 32' ' ' SER . . . -71.63 172.46 45.63 Favored Glycine 0 N--CA 1.426 -2.014 0 C-N-CA 119.626 -1.274 . . . . 0.0 114.007 179.722 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.416 ' HG3' ' H ' ' A' ' 29' ' ' GLN . 0.0 OUTLIER -66.04 -18.26 65.23 Favored 'General case' 0 C--N 1.307 -1.245 0 CA-C-N 114.607 -0.797 . . . . 0.0 110.99 179.539 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -100.19 10.5 41.16 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.465 -0.788 . . . . 0.0 109.375 178.589 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 50.2 m 71.61 23.31 3.81 Favored 'General case' 0 C--N 1.342 0.275 0 CA-C-O 121.913 0.864 . . . . 0.0 109.113 -175.244 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.671 ' OG ' ' HA3' ' A' ' 28' ' ' GLY . 2.2 p -70.77 92.52 0.89 Allowed 'General case' 0 N--CA 1.42 -1.933 0 CA-C-N 114.983 -1.008 . . . . 0.0 111.403 -179.339 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.609 ' HA ' ' O ' ' A' ' 26' ' ' VAL . 31.4 mt-10 -81.52 102.08 10.35 Favored 'General case' 0 CA--C 1.505 -0.759 0 CA-C-O 121.211 0.529 . . . . 0.0 110.579 178.71 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.426 HG21 ' HA ' ' A' ' 51' ' ' TYR . 29.5 mm -99.73 138.97 22.45 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.718 0 N-CA-C 109.283 -0.636 . . . . 0.0 109.283 179.317 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 12.0 m170 -116.43 132.9 56.55 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 178.991 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.537 ' HZ ' HG23 ' A' ' 26' ' ' VAL . 1.0 OUTLIER -147.26 167.89 23.12 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-O 121.179 0.514 . . . . 0.0 111.555 -177.456 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 91.7 mttt -124.11 125.12 43.94 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.902 -0.59 . . . . 0.0 109.805 -178.963 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.518 ' HA ' ' OE2' ' A' ' 18' ' ' GLU . 24.1 m -144.72 152.77 14.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 121.048 0.451 . . . . 0.0 110.443 -179.852 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.446 ' HG2' ' HB3' ' A' ' 21' ' ' TYR . 36.5 mtpt -77.65 174.93 10.39 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-O 121.665 0.745 . . . . 0.0 111.401 177.436 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -87.02 -32.67 19.89 Favored 'General case' 0 C--N 1.31 -1.122 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.371 179.24 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 9.8 t -94.68 14.63 20.52 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.324 -177.293 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 6.4 t -105.42 167.36 9.8 Favored 'General case' 0 C--N 1.316 -0.865 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 179.903 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . 0.444 ' O ' ' HG2' ' A' ' 46' ' ' LYS . 46.4 m170 -81.9 142.41 32.51 Favored 'General case' 0 C--N 1.312 -1.022 0 CA-C-O 121.675 0.75 . . . . 0.0 111.84 -179.309 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.652 ' O ' ' HG3' ' A' ' 48' ' ' LYS . 0.2 OUTLIER -64.88 -17.68 64.52 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 114.998 -1.001 . . . . 0.0 109.893 179.296 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.739 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -51.9 -47.81 64.44 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.967 -179.043 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.444 ' HG2' ' O ' ' A' ' 43' ' ' HIS . 22.5 ptmt -58.97 -34.29 71.63 Favored 'General case' 0 C--O 1.207 -1.147 0 CA-C-O 121.077 0.465 . . . . 0.0 110.385 -179.274 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.554 ' HB3' HD13 ' A' ' 44' ' ' LEU . 8.2 tt -70.6 -47.98 57.44 Favored 'General case' 0 C--N 1.301 -1.531 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.124 -179.997 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.652 ' HG3' ' O ' ' A' ' 44' ' ' LEU . 20.8 mtpt -59.98 -49.93 75.73 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.509 -178.041 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.739 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 10.4 pt-20 -67.67 -33.89 75.83 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.441 -179.25 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.613 ' O ' ' HG2' ' A' ' 54' ' ' ARG . 7.5 m -66.39 -45.66 79.27 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.845 -179.659 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.462 ' CE2' ' HA ' ' A' ' 48' ' ' LYS . 2.1 p90 -76.35 -32.69 58.79 Favored 'General case' 0 N--CA 1.445 -0.677 0 C-N-CA 119.667 -0.813 . . . . 0.0 110.672 -177.775 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . 0.529 ' SG ' ' HG2' ' A' ' 59' ' ' MET . 69.2 m -61.98 -44.75 96.09 Favored 'General case' 0 C--O 1.238 0.466 0 CA-C-O 121.0 0.428 . . . . 0.0 110.793 179.083 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.406 ' OE1' ' HA ' ' A' ' 12' ' ' ASP . 11.6 pt20 -67.99 -33.39 74.53 Favored 'General case' 0 N--CA 1.447 -0.601 0 C-N-CA 120.66 -0.416 . . . . 0.0 110.533 -179.922 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.613 ' HG2' ' O ' ' A' ' 50' ' ' SER . 17.8 mmt85 -57.67 -38.04 74.44 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-O 121.313 0.578 . . . . 0.0 110.832 177.531 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.417 HE21 ' HB2' ' A' ' 55' ' ' GLN . 3.4 mt-30 -81.29 -21.31 39.4 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.954 179.914 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 82.86 29.99 33.31 Favored Glycine 0 N--CA 1.446 -0.688 0 C-N-CA 120.834 -0.698 . . . . 0.0 112.325 179.224 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 35.0 m -132.17 147.63 66.55 Favored Pre-proline 0 C--N 1.324 -0.504 0 O-C-N 122.508 -0.407 . . . . 0.0 110.786 -179.042 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . 0.597 ' HG2' ' OG ' ' A' ' 61' ' ' SER . 18.8 Cg_endo -63.35 150.35 88.79 Favored 'Trans proline' 0 N--CA 1.456 -0.683 0 C-N-CA 122.33 2.02 . . . . 0.0 111.955 177.601 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.529 ' HG2' ' SG ' ' A' ' 52' ' ' CYS . 69.8 mtp -70.01 -9.16 54.33 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.77 -176.338 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . 0.403 ' OD1' ' HB2' ' A' ' 58' ' ' PRO . 1.9 p-10 -92.19 -8.52 45.26 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 121.23 0.538 . . . . 0.0 110.886 -179.607 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.597 ' OG ' ' HG2' ' A' ' 58' ' ' PRO . 67.3 m -84.66 -23.36 29.49 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 121.002 0.429 . . . . 0.0 111.836 179.516 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.457 HD11 ' SG ' ' A' ' 52' ' ' CYS . 1.2 pp -125.57 169.14 12.76 Favored 'General case' 0 C--N 1.307 -1.247 0 N-CA-C 113.313 0.856 . . . . 0.0 113.313 -175.091 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.466 ' O ' ' HA ' ' A' ' 90' ' ' VAL . 52.5 mtm180 -116.16 112.42 21.65 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.176 -0.92 . . . . 0.0 110.722 -178.156 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.41 ' HB3' ' OH ' ' A' ' 51' ' ' TYR . 0.1 OUTLIER -96.91 115.12 26.88 Favored 'General case' 0 C--N 1.31 -1.131 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.522 178.466 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.459 ' C ' HD22 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -143.54 162.12 36.68 Favored 'General case' 0 N--CA 1.443 -0.792 0 CA-C-O 121.745 0.783 . . . . 0.0 111.834 -179.65 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 92.5 t80 -145.79 136.95 24.75 Favored 'General case' 0 C--N 1.309 -1.168 0 N-CA-C 108.785 -0.82 . . . . 0.0 108.785 178.564 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.453 ' HG2' HE21 ' A' ' 69' ' ' GLN . 7.1 pt-20 48.54 29.04 1.94 Allowed 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 124.391 1.076 . . . . 0.0 112.231 -178.417 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 83.57 23.17 54.49 Favored Glycine 0 N--CA 1.447 -0.589 0 C-N-CA 120.935 -0.65 . . . . 0.0 113.26 -179.646 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . 0.453 HE21 ' HG2' ' A' ' 67' ' ' GLU . 3.0 pt20 -130.47 137.41 49.77 Favored 'General case' 0 C--N 1.32 -0.711 0 O-C-N 122.212 -0.581 . . . . 0.0 109.462 179.826 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.422 ' H ' ' HD2' ' A' ' 70' ' ' ARG . 0.5 OUTLIER -73.07 146.62 45.69 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-O 121.704 0.764 . . . . 0.0 110.172 178.154 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.454 HG21 HD12 ' A' ' 44' ' ' LEU . 22.6 mm -92.63 119.56 40.45 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.855 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.308 -178.391 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -94.88 161.03 14.32 Favored 'General case' 0 N--CA 1.434 -1.232 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 178.841 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . 0.413 ' HB3' ' HB3' ' A' ' 45' ' ' LYS . 66.3 m-20 -67.87 -21.18 65.18 Favored 'General case' 0 C--N 1.314 -0.964 0 CA-C-O 121.303 0.573 . . . . 0.0 111.506 -177.918 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 6.1 m-80 -100.44 6.78 44.44 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-O 121.268 0.556 . . . . 0.0 110.1 -179.437 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . 0.582 ' O ' ' HB2' ' A' ' 44' ' ' LEU . 2.2 m170 -83.27 145.84 28.88 Favored 'General case' 0 CA--C 1.5 -0.955 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 178.342 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.417 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 68.8 p -118.24 152.91 51.29 Favored Pre-proline 0 C--N 1.301 -1.53 0 C-N-CA 120.824 -0.351 . . . . 0.0 111.476 179.647 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_exo -57.3 -41.03 77.52 Favored 'Trans proline' 0 C--N 1.349 0.584 0 C-N-CA 122.597 2.198 . . . . 0.0 111.431 178.508 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . 0.54 ' HG3' ' N ' ' A' ' 79' ' ' GLU . 48.1 pttt -64.58 -40.92 96.41 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.877 -178.918 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.54 ' N ' ' HG3' ' A' ' 78' ' ' LYS . 55.6 mm-40 -73.55 -35.73 65.55 Favored 'General case' 0 N--CA 1.439 -0.99 0 CA-C-O 120.951 0.405 . . . . 0.0 111.463 -177.592 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.455 HD21 ' CG ' ' A' ' 75' ' ' HIS . 5.5 mt -80.69 -0.93 40.44 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.119 0.485 . . . . 0.0 111.253 -179.35 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 78.26 37.78 27.35 Favored Glycine 0 CA--C 1.51 -0.256 0 C-N-CA 120.872 -0.68 . . . . 0.0 112.963 177.174 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 61.0 mtt -100.18 165.26 11.58 Favored 'General case' 0 C--N 1.311 -1.082 0 N-CA-C 109.844 -0.428 . . . . 0.0 109.844 179.35 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -148.2 -171.32 3.81 Favored 'General case' 0 C--N 1.311 -1.084 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 178.151 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.554 ' HA ' ' HB ' ' A' ' 22' ' ' ILE . 15.8 pt-20 -71.19 138.39 49.5 Favored 'General case' 0 N--CA 1.443 -0.778 0 C-N-CA 120.223 -0.591 . . . . 0.0 110.928 -179.89 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 79.7 -2.29 2.1 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 124.801 1.24 . . . . 0.0 111.433 178.861 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -59.33 162.5 4.65 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-O 121.395 0.617 . . . . 0.0 111.284 179.109 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 7.1 p -129.48 143.38 41.32 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.948 0 CA-C-O 121.285 0.564 . . . . 0.0 111.33 -177.001 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 3.7 mp -114.47 153.9 15.91 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 179.642 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 11.0 tp10 -107.41 138.56 43.39 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 120.802 0.334 . . . . 0.0 110.102 -177.226 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . 0.596 ' HB ' ' HA2' ' A' ' 28' ' ' GLY . 97.1 t -130.62 134.05 62.62 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.974 0 CA-C-O 121.47 0.653 . . . . 0.0 110.922 178.863 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 89.0 m-85 -119.27 -177.36 3.33 Favored 'General case' 0 C--N 1.306 -1.284 0 CA-C-N 115.886 -0.597 . . . . 0.0 109.465 179.799 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . 0.474 ' HG3' ' H ' ' A' ' 94' ' ' GLN . 8.1 tp60 -108.31 148.26 30.3 Favored 'General case' 0 C--N 1.307 -1.263 0 O-C-N 121.934 -0.478 . . . . 0.0 110.38 -179.281 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . 0.419 ' OE2' ' HG2' ' A' ' 63' ' ' ARG . 10.5 pt-20 -137.35 20.07 2.94 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.702 0.763 . . . . 0.0 110.322 174.658 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . 0.474 ' H ' ' HG3' ' A' ' 92' ' ' GLN . 98.8 mt-30 -70.39 -149.07 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.745 0 CA-C-N 115.406 -0.816 . . . . 0.0 110.663 176.825 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 11.1 t -155.21 157.02 36.68 Favored 'General case' 0 C--N 1.316 -0.864 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 -179.115 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -169.14 -152.2 7.67 Favored Glycine 0 N--CA 1.445 -0.718 0 C-N-CA 120.773 -0.727 . . . . 0.0 111.973 -179.08 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.944 0 CA-C-O 118.944 -0.92 . . . . 0.0 111.697 -179.359 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.9 tpt . . . . . 0 N--CA 1.486 1.34 0 CA-C-O 121.476 0.655 . . . . 0.0 110.762 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 15.9 m -131.99 10.34 4.59 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-O 122.356 1.074 . . . . 0.0 108.433 179.499 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -99.03 10.98 40.34 Favored 'General case' 0 C--N 1.308 -1.213 0 CA-C-N 114.507 -1.224 . . . . 0.0 109.906 -174.258 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -78.25 -25.12 46.69 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 115.539 -0.755 . . . . 0.0 111.092 -177.726 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -97.64 150.26 21.36 Favored 'General case' 0 N--CA 1.444 -0.732 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 179.517 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -85.35 121.13 27.64 Favored 'General case' 0 C--N 1.312 -1.059 0 CA-C-O 121.05 0.452 . . . . 0.0 110.325 178.138 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 15.4 ptmt -158.7 131.3 4.41 Favored Pre-proline 0 C--N 1.313 -1.011 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.579 179.891 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -85.31 -28.49 0.83 Allowed 'Trans proline' 0 N--CA 1.453 -0.877 0 C-N-CA 122.465 2.11 . . . . 0.0 112.319 179.1 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 2.3 p -99.36 115.66 29.72 Favored 'General case' 0 N--CA 1.44 -0.969 0 CA-C-O 121.058 0.456 . . . . 0.0 111.833 -177.884 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 61.0 p -46.56 155.24 0.25 Allowed 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 115.681 -0.69 . . . . 0.0 111.659 174.726 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -60.74 107.88 0.76 Allowed 'General case' 0 C--O 1.238 0.476 0 CA-C-O 121.794 0.807 . . . . 0.0 111.498 -178.639 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -147.02 153.95 40.63 Favored 'General case' 0 C--N 1.307 -1.257 0 CA-C-N 115.049 -0.978 . . . . 0.0 109.578 -178.256 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.3 pp -166.85 -178.13 4.14 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.805 0.336 . . . . 0.0 111.266 -176.962 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 158.44 72.11 0.02 OUTLIER Glycine 0 N--CA 1.449 -0.477 0 C-N-CA 120.859 -0.686 . . . . 0.0 112.678 179.884 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -118.57 29.01 7.98 Favored 'General case' 0 C--N 1.312 -1.053 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 178.23 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 28.3 mmtp -99.87 169.26 9.35 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.939 -177.011 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 4.2 mtpp -83.2 -162.73 0.64 Allowed 'General case' 0 C--O 1.237 0.404 0 CA-C-O 120.97 0.414 . . . . 0.0 111.41 179.027 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -163.73 -179.33 6.3 Favored 'General case' 0 N--CA 1.432 -1.333 0 N-CA-C 108.895 -0.78 . . . . 0.0 108.895 -174.401 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 64.5 114.6 0.01 OUTLIER Glycine 0 CA--C 1.528 0.863 0 N-CA-C 115.482 0.953 . . . . 0.0 115.482 175.481 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 4.4 mp0 66.33 37.37 4.87 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 121.361 0.6 . . . . 0.0 111.181 175.193 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 40.0 p90 -107.31 173.97 6.09 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-O 121.385 0.612 . . . . 0.0 110.857 179.777 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.518 ' HB ' ' HA ' ' A' ' 84' ' ' GLU . 27.7 pt -123.45 172.18 11.26 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.205 0 CA-C-O 121.471 0.653 . . . . 0.0 110.131 179.038 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 41.1 mtmt -120.95 142.5 49.69 Favored 'General case' 0 C--N 1.296 -1.745 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 179.899 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.6 mp -135.76 160.83 37.32 Favored 'General case' 0 C--N 1.301 -1.539 0 CA-C-O 121.278 0.561 . . . . 0.0 110.755 176.708 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.429 ' O ' ' HA ' ' A' ' 87' ' ' VAL . 5.1 tmmm? -130.17 142.09 50.61 Favored 'General case' 0 C--N 1.309 -1.156 0 CA-C-O 121.37 0.605 . . . . 0.0 110.315 -178.728 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.519 HG23 ' HZ ' ' A' ' 36' ' ' PHE . 0.9 OUTLIER -112.87 142.82 24.03 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.544 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.353 -179.142 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 44.4 mm -106.97 115.61 48.86 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.138 0 N-CA-C 107.463 -1.31 . . . . 0.0 107.463 174.737 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -78.13 178.31 52.66 Favored Glycine 0 N--CA 1.423 -2.202 0 C-N-CA 120.796 -0.716 . . . . 0.0 113.257 -175.054 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.837 ' H ' ' NE2' ' A' ' 29' ' ' GLN . 0.0 OUTLIER -72.72 -27.63 62.17 Favored 'General case' 0 C--N 1.3 -1.581 0 CA-C-O 122.141 0.972 . . . . 0.0 108.442 -179.02 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -102.73 16.28 26.95 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 114.705 -1.134 . . . . 0.0 108.343 178.375 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 21.3 m 73.46 15.86 4.13 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 115.267 -0.879 . . . . 0.0 111.402 179.003 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 21.6 t -68.04 110.41 3.92 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.05 179.304 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.512 ' HA ' ' O ' ' A' ' 26' ' ' VAL . 4.3 mp0 -86.65 108.48 18.65 Favored 'General case' 0 N--CA 1.445 -0.714 0 CA-C-O 121.3 0.571 . . . . 0.0 110.828 179.9 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 28.7 mm -98.59 141.28 16.61 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.212 0 N-CA-C 109.365 -0.606 . . . . 0.0 109.365 179.582 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 11.4 m170 -120.02 129.31 54.2 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 -179.898 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.519 ' HZ ' HG23 ' A' ' 26' ' ' VAL . 1.7 p90 -147.17 162.56 38.62 Favored 'General case' 0 C--N 1.313 -0.984 0 CA-C-O 121.351 0.596 . . . . 0.0 111.625 -177.676 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 19.2 ptpt -118.69 127.61 53.73 Favored 'General case' 0 N--CA 1.445 -0.704 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.853 179.41 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.423 HG21 HD12 ' A' ' 47' ' ' LEU . 34.6 m -142.17 162.34 19.46 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 178.098 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.583 ' O ' HG22 ' A' ' 42' ' ' THR . 70.9 tttt -94.46 166.56 12.0 Favored 'General case' 0 C--N 1.305 -1.33 0 O-C-N 121.587 -0.695 . . . . 0.0 110.649 -179.426 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -76.1 -35.06 59.48 Favored 'General case' 0 C--N 1.328 -0.362 0 O-C-N 121.914 -0.491 . . . . 0.0 111.923 -177.436 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 15.1 t -90.05 16.91 7.52 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 120.996 0.426 . . . . 0.0 111.606 -177.961 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . 0.583 HG22 ' O ' ' A' ' 39' ' ' LYS . 2.0 t -106.86 170.63 7.83 Favored 'General case' 0 C--N 1.321 -0.67 0 O-C-N 121.938 -0.476 . . . . 0.0 110.174 -178.624 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 44.3 m170 -85.41 147.35 26.54 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.557 0.694 . . . . 0.0 111.522 -179.75 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.58 HD13 ' HB3' ' A' ' 47' ' ' LEU . 0.2 OUTLIER -73.77 -13.26 60.92 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.309 -179.345 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.734 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -55.75 -43.37 76.6 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.986 -178.966 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 12.0 ptmt -68.34 -29.15 67.81 Favored 'General case' 0 C--O 1.213 -0.861 0 CA-C-O 121.127 0.489 . . . . 0.0 110.596 -178.929 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.58 ' HB3' HD13 ' A' ' 44' ' ' LEU . 9.1 tt -73.23 -49.03 30.1 Favored 'General case' 0 C--N 1.305 -1.357 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.153 -179.866 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.535 ' HA ' ' CD2' ' A' ' 51' ' ' TYR . 7.7 ptmm? -63.65 -41.63 98.2 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.726 -177.563 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.734 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 8.4 pt-20 -69.71 -33.76 72.95 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 121.0 0.428 . . . . 0.0 110.426 176.992 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 4.7 m -67.83 -41.76 82.49 Favored 'General case' 0 C--O 1.236 0.354 0 N-CA-C 112.512 0.56 . . . . 0.0 112.512 -178.312 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.535 ' CD2' ' HA ' ' A' ' 48' ' ' LYS . 2.7 p90 -76.78 -32.38 57.65 Favored 'General case' 0 N--CA 1.444 -0.734 0 C-N-CA 119.436 -0.905 . . . . 0.0 110.229 -179.096 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . 0.567 ' SG ' HD11 ' A' ' 62' ' ' LEU . 98.6 m -62.34 -45.08 94.8 Favored 'General case' 0 CA--C 1.51 -0.559 0 CA-C-O 120.967 0.413 . . . . 0.0 110.646 178.857 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 10.6 pt20 -66.36 -34.67 78.48 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.159 -179.727 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.433 ' HA ' ' NE ' ' A' ' 54' ' ' ARG . 3.9 mmp_? -59.23 -39.56 83.11 Favored 'General case' 0 CA--C 1.514 -0.432 0 CA-C-O 121.023 0.44 . . . . 0.0 111.329 177.707 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.414 HE21 ' HB2' ' A' ' 55' ' ' GLN . 3.3 mt-30 -77.46 -21.28 53.17 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-O 121.137 0.494 . . . . 0.0 110.715 179.371 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 82.75 30.85 31.22 Favored Glycine 0 N--CA 1.444 -0.813 0 C-N-CA 120.937 -0.649 . . . . 0.0 112.217 179.25 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 35.6 m -133.65 148.31 68.06 Favored Pre-proline 0 C--N 1.326 -0.439 0 O-C-N 122.42 -0.459 . . . . 0.0 110.803 -179.045 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . 0.57 ' HG2' ' OG ' ' A' ' 61' ' ' SER . 18.0 Cg_endo -62.45 153.43 71.05 Favored 'Trans proline' 0 N--CA 1.461 -0.422 0 C-N-CA 122.585 2.19 . . . . 0.0 111.866 177.205 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.469 ' HG2' ' SG ' ' A' ' 52' ' ' CYS . 74.1 mtp -72.69 -8.72 56.76 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.134 0.493 . . . . 0.0 111.529 -176.356 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.9 p-10 -91.63 -8.75 46.32 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-O 121.268 0.556 . . . . 0.0 110.561 179.551 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.57 ' OG ' ' HG2' ' A' ' 58' ' ' PRO . 75.6 m -87.25 -18.03 31.2 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-O 121.095 0.474 . . . . 0.0 111.862 -179.742 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.567 HD11 ' SG ' ' A' ' 52' ' ' CYS . 1.3 pp -131.19 169.69 15.59 Favored 'General case' 0 C--N 1.31 -1.114 0 N-CA-C 113.067 0.765 . . . . 0.0 113.067 -176.999 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.435 ' O ' ' HA ' ' A' ' 90' ' ' VAL . 35.8 mtm180 -119.72 121.15 38.56 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.416 -177.748 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.415 ' HB3' ' OH ' ' A' ' 51' ' ' TYR . 0.2 OUTLIER -105.1 117.96 35.33 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-O 121.206 0.527 . . . . 0.0 111.462 179.475 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.445 ' C ' HD22 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -147.85 164.42 33.74 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 121.208 0.528 . . . . 0.0 110.471 179.606 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 77.9 t80 -144.69 135.84 25.14 Favored 'General case' 0 C--N 1.313 -0.994 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 178.134 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.477 ' HG2' HE21 ' A' ' 69' ' ' GLN . 7.3 pt-20 50.88 26.37 2.61 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 124.117 0.967 . . . . 0.0 112.327 -179.899 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 85.04 23.27 49.73 Favored Glycine 0 N--CA 1.445 -0.726 0 C-N-CA 120.871 -0.68 . . . . 0.0 112.902 -179.38 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . 0.477 HE21 ' HG2' ' A' ' 67' ' ' GLU . 2.8 pt20 -129.92 134.39 47.45 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 178.953 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 10.8 ptt180 -65.56 148.68 51.34 Favored 'General case' 0 C--N 1.31 -1.136 0 CA-C-O 121.586 0.708 . . . . 0.0 111.113 177.824 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.474 HG21 HD12 ' A' ' 44' ' ' LEU . 21.0 mm -98.92 115.56 39.73 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.301 0 N-CA-C 109.629 -0.508 . . . . 0.0 109.629 177.724 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -96.34 165.99 11.93 Favored 'General case' 0 N--CA 1.437 -1.091 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 -179.237 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . 0.428 ' CA ' ' HB3' ' A' ' 45' ' ' LYS . 37.1 m-20 -69.32 -25.44 64.22 Favored 'General case' 0 C--N 1.31 -1.124 0 CA-C-O 121.518 0.675 . . . . 0.0 110.982 -178.268 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 8.5 m-80 -96.5 4.66 51.93 Favored 'General case' 0 C--N 1.311 -1.076 0 CA-C-O 121.491 0.662 . . . . 0.0 109.708 -178.026 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . 0.546 ' O ' ' HB2' ' A' ' 44' ' ' LEU . 4.5 m170 -83.77 144.75 29.11 Favored 'General case' 0 CA--C 1.503 -0.855 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 178.849 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.523 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 77.6 p -117.85 155.29 51.06 Favored Pre-proline 0 C--N 1.302 -1.499 0 N-CA-C 110.276 -0.268 . . . . 0.0 110.276 178.516 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -67.49 -30.57 35.63 Favored 'Trans proline' 0 N--CA 1.454 -0.822 0 C-N-CA 121.95 1.767 . . . . 0.0 111.043 -179.896 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . 0.466 ' HG3' ' N ' ' A' ' 79' ' ' GLU . 33.2 pttt -70.73 -38.47 73.57 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.952 0.406 . . . . 0.0 110.551 179.59 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.466 ' N ' ' HG3' ' A' ' 78' ' ' LYS . 5.0 mm-40 -74.14 -37.64 64.0 Favored 'General case' 0 N--CA 1.447 -0.623 0 CA-C-O 121.015 0.436 . . . . 0.0 111.269 -179.572 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.523 ' HG ' ' O ' ' A' ' 76' ' ' THR . 5.9 mt -77.29 -5.04 47.96 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.278 0.561 . . . . 0.0 110.872 -179.862 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 78.34 42.96 13.7 Favored Glycine 0 C--O 1.227 -0.34 0 C-N-CA 121.129 -0.558 . . . . 0.0 113.217 176.733 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 61.4 mtt -101.65 165.68 11.1 Favored 'General case' 0 C--N 1.315 -0.932 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 179.51 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -142.6 -170.72 3.27 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 110.073 -0.343 . . . . 0.0 110.073 177.104 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.518 ' HA ' ' HB ' ' A' ' 22' ' ' ILE . 14.4 pt-20 -68.7 135.94 52.11 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.97 0.414 . . . . 0.0 111.003 -179.421 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 79.07 4.41 2.33 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 124.361 1.064 . . . . 0.0 111.158 177.574 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 17.6 t0 -60.64 159.26 11.02 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-O 121.422 0.629 . . . . 0.0 110.982 178.515 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.429 ' HA ' ' O ' ' A' ' 25' ' ' LYS . 7.4 p -127.05 141.48 46.14 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.243 0 CA-C-O 121.386 0.612 . . . . 0.0 111.417 -177.387 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 3.6 mp -111.33 155.91 12.61 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.743 0 CA-C-N 116.203 -0.453 . . . . 0.0 109.82 -179.379 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 6.3 tp10 -105.34 135.3 46.97 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.929 0.395 . . . . 0.0 110.227 -177.25 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . 0.435 ' HA ' ' O ' ' A' ' 63' ' ' ARG . 60.4 t -128.87 134.75 63.72 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.912 0 CA-C-O 121.119 0.485 . . . . 0.0 110.809 178.148 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 87.9 m-85 -119.05 173.9 6.63 Favored 'General case' 0 C--N 1.32 -0.713 0 N-CA-C 108.947 -0.761 . . . . 0.0 108.947 178.115 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 7.1 tp60 -102.44 146.85 27.5 Favored 'General case' 0 C--N 1.314 -0.947 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 178.633 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 23.0 pt-20 -139.12 19.91 2.61 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.165 0.507 . . . . 0.0 111.191 176.267 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -57.68 -166.12 0.0 OUTLIER 'General case' 0 CA--C 1.543 0.683 0 CA-C-O 121.645 0.736 . . . . 0.0 112.57 177.231 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 9.0 t -138.0 137.6 38.05 Favored 'General case' 0 N--CA 1.44 -0.954 0 O-C-N 121.554 -0.716 . . . . 0.0 110.377 -175.253 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -107.41 46.93 1.1 Allowed Glycine 0 N--CA 1.445 -0.767 0 N-CA-C 111.46 -0.656 . . . . 0.0 111.46 178.516 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.435 -1.375 0 CA-C-O 119.024 -0.875 . . . . 0.0 110.982 -179.149 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.475 0.788 0 CA-C-O 120.978 0.418 . . . . 0.0 111.833 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 6.6 m -82.4 -79.92 0.17 Allowed 'General case' 0 N--CA 1.444 -0.746 0 CA-C-O 120.872 0.368 . . . . 0.0 111.675 -178.575 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 26.9 t70 175.26 129.2 0.03 OUTLIER 'General case' 0 CA--C 1.497 -1.078 0 N-CA-C 106.447 -1.686 . . . . 0.0 106.447 -178.032 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 6.8 pt20 -147.59 -37.24 0.2 Allowed 'General case' 0 C--N 1.286 -2.189 0 CA-C-O 121.286 0.565 . . . . 0.0 111.225 -174.589 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -118.75 -164.15 1.01 Allowed 'General case' 0 C--N 1.316 -0.866 0 N-CA-C 109.584 -0.524 . . . . 0.0 109.584 179.145 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -147.08 130.07 16.32 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-O 121.171 0.51 . . . . 0.0 111.266 -179.133 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 46.1 mmtm -131.03 138.05 32.11 Favored Pre-proline 0 C--N 1.311 -1.09 0 CA-C-N 115.848 -0.615 . . . . 0.0 109.493 176.944 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -80.07 102.04 1.41 Allowed 'Trans proline' 0 N--CA 1.444 -1.4 0 C-N-CA 122.564 2.176 . . . . 0.0 112.692 -177.362 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 38.3 m -87.45 143.02 27.43 Favored 'General case' 0 C--N 1.312 -1.044 0 N-CA-C 108.659 -0.867 . . . . 0.0 108.659 177.818 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 12.2 t -97.23 162.81 13.18 Favored 'General case' 0 C--N 1.314 -0.974 0 O-C-N 121.849 -0.532 . . . . 0.0 110.88 -177.197 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -151.78 151.2 31.05 Favored 'General case' 0 C--N 1.315 -0.897 0 N-CA-C 109.122 -0.695 . . . . 0.0 109.122 -179.782 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -69.61 91.99 0.62 Allowed 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.275 0.559 . . . . 0.0 110.63 178.982 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 88.2 mt -98.07 158.48 15.52 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-O 121.199 0.524 . . . . 0.0 110.246 -179.98 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 105.14 23.14 7.84 Favored Glycine 0 N--CA 1.438 -1.189 0 C-N-CA 120.61 -0.805 . . . . 0.0 111.308 -179.543 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -102.97 34.46 2.86 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 122.445 1.117 . . . . 0.0 108.925 -179.01 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 6.9 ptmm? -159.62 179.98 8.4 Favored 'General case' 0 C--N 1.31 -1.113 0 CA-C-N 114.624 -1.171 . . . . 0.0 109.106 -175.872 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.418 ' HE2' ' HB2' ' A' ' 17' ' ' LYS . 0.0 OUTLIER -134.9 150.44 50.43 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 121.459 0.647 . . . . 0.0 111.015 179.607 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.406 ' HB3' ' CE2' ' A' ' 21' ' ' TYR . 40.0 mt-10 -120.67 -174.96 2.92 Favored 'General case' 0 C--N 1.307 -1.247 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.92 177.395 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.469 ' H ' ' HD2' ' A' ' 21' ' ' TYR . . . 120.52 124.95 3.2 Favored Glycine 0 N--CA 1.447 -0.631 0 C-N-CA 120.908 -0.663 . . . . 0.0 112.192 -177.893 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 42.8 mm-40 62.37 53.77 2.7 Favored 'General case' 0 CA--C 1.515 -0.382 0 CA-C-O 121.782 0.801 . . . . 0.0 111.56 178.851 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.519 ' CE1' ' HD3' ' A' ' 37' ' ' LYS . 44.5 p90 -127.5 171.49 11.54 Favored 'General case' 0 C--N 1.301 -1.541 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.232 179.904 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 24.5 pt -119.98 171.04 8.85 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.212 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 176.291 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 1.8 mppt? -118.44 142.84 47.16 Favored 'General case' 0 C--N 1.296 -1.74 0 N-CA-C 109.017 -0.735 . . . . 0.0 109.017 -179.508 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.5 mp -135.3 162.83 31.46 Favored 'General case' 0 C--N 1.301 -1.508 0 CA-C-O 121.197 0.523 . . . . 0.0 110.572 176.67 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.428 ' O ' ' HA ' ' A' ' 87' ' ' VAL . 5.3 tmmm? -132.5 142.55 49.26 Favored 'General case' 0 N--CA 1.434 -1.274 0 CA-C-O 121.436 0.636 . . . . 0.0 110.775 -178.775 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.515 HG11 ' CD1' ' A' ' 51' ' ' TYR . 0.9 OUTLIER -115.98 141.89 31.57 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.324 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.036 -179.954 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.43 ' O ' ' HB ' ' A' ' 90' ' ' VAL . 48.3 mm -104.6 118.27 51.62 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.109 0 N-CA-C 107.425 -1.324 . . . . 0.0 107.425 174.626 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . 0.472 ' HA2' ' HB ' ' A' ' 90' ' ' VAL . . . -91.53 162.22 27.86 Favored Glycine 0 N--CA 1.423 -2.215 0 C-N-CA 120.145 -1.026 . . . . 0.0 111.32 -177.064 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.83 -24.45 62.01 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-O 121.531 0.681 . . . . 0.0 111.351 177.701 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 36.4 t70 -89.1 9.1 26.65 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-O 121.401 0.62 . . . . 0.0 110.177 178.598 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 8.6 t 70.06 16.7 7.48 Favored 'General case' 0 C--N 1.342 0.279 0 CA-C-O 122.177 0.989 . . . . 0.0 109.301 -177.458 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 5.0 t -77.13 111.56 12.86 Favored 'General case' 0 N--CA 1.444 -0.754 0 CA-C-N 114.997 -1.001 . . . . 0.0 110.195 -179.821 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.419 ' HA ' ' O ' ' A' ' 26' ' ' VAL . 41.3 mt-10 -87.15 112.08 21.59 Favored 'General case' 0 CA--C 1.507 -0.705 0 N-CA-C 109.803 -0.443 . . . . 0.0 109.803 177.861 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.416 HG21 ' HA ' ' A' ' 51' ' ' TYR . 32.1 mm -101.6 136.86 31.54 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.659 0 N-CA-C 109.489 -0.56 . . . . 0.0 109.489 179.681 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . 0.407 ' NE2' ' HG3' ' A' ' 25' ' ' LYS . 11.7 m170 -117.28 134.71 54.49 Favored 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 179.397 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.485 ' HZ ' HG23 ' A' ' 26' ' ' VAL . 1.0 OUTLIER -147.13 159.47 43.58 Favored 'General case' 0 C--N 1.309 -1.184 0 CA-C-O 121.22 0.533 . . . . 0.0 111.332 -177.765 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.519 ' HD3' ' CE1' ' A' ' 21' ' ' TYR . 93.1 mttt -116.41 117.21 29.32 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.743 -178.712 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 32.6 m -137.74 158.39 33.83 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 N-CA-C 109.884 -0.413 . . . . 0.0 109.884 179.787 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 24.2 mtpp -81.85 175.92 10.02 Favored 'General case' 0 CA--C 1.503 -0.837 0 CA-C-O 121.497 0.665 . . . . 0.0 111.205 178.382 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -83.05 -32.39 26.86 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-N 115.712 -0.676 . . . . 0.0 111.118 178.843 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 14.8 t -97.13 15.21 23.25 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.03 0.443 . . . . 0.0 112.002 -177.351 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 4.2 t -98.71 163.99 12.41 Favored 'General case' 0 C--N 1.316 -0.852 0 O-C-N 121.87 -0.518 . . . . 0.0 110.052 -178.908 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 27.6 m170 -77.34 142.68 39.24 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.458 0.647 . . . . 0.0 111.421 179.114 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.605 ' O ' ' HG3' ' A' ' 48' ' ' LYS . 0.2 OUTLIER -70.81 -15.96 62.7 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 115.391 -0.822 . . . . 0.0 109.41 -179.878 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.659 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -55.22 -45.43 75.96 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.868 -0.605 . . . . 0.0 112.576 -177.506 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 21.9 ptmt -66.46 -28.99 69.02 Favored 'General case' 0 C--O 1.22 -0.494 0 CA-C-O 121.283 0.563 . . . . 0.0 110.407 -178.699 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.576 ' HB3' HD13 ' A' ' 44' ' ' LEU . 8.1 tt -70.16 -47.72 60.41 Favored 'General case' 0 C--N 1.312 -1.052 0 CA-C-N 115.721 -0.672 . . . . 0.0 109.668 178.726 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.605 ' HG3' ' O ' ' A' ' 44' ' ' LEU . 20.9 mtpt -57.31 -48.12 79.77 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-O 121.512 0.673 . . . . 0.0 110.434 -179.329 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.659 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 6.3 pt-20 -71.61 -32.63 68.21 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.859 -178.386 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.443 ' O ' ' HG2' ' A' ' 53' ' ' GLN . 28.5 t -63.87 -46.44 84.92 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-O 121.173 0.511 . . . . 0.0 110.944 -179.687 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.515 ' CD1' HG11 ' A' ' 26' ' ' VAL . 1.9 p90 -76.46 -32.55 58.46 Favored 'General case' 0 N--CA 1.44 -0.931 0 C-N-CA 119.976 -0.689 . . . . 0.0 110.564 -177.783 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . 0.537 ' SG ' HD11 ' A' ' 62' ' ' LEU . 74.7 m -63.63 -43.37 97.03 Favored 'General case' 0 CA--C 1.511 -0.537 0 CA-C-O 121.159 0.504 . . . . 0.0 110.704 179.226 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.443 ' HG2' ' O ' ' A' ' 50' ' ' SER . 13.7 pt20 -67.5 -34.77 77.82 Favored 'General case' 0 N--CA 1.443 -0.786 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.271 -179.875 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.512 ' HA ' ' NE ' ' A' ' 54' ' ' ARG . 4.0 mmp_? -58.08 -38.53 76.55 Favored 'General case' 0 C--N 1.347 0.47 0 CA-C-O 121.075 0.464 . . . . 0.0 111.444 177.496 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.43 HE21 ' HB2' ' A' ' 55' ' ' GLN . 3.0 mt-30 -79.91 -21.13 44.3 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 121.218 0.533 . . . . 0.0 110.956 179.519 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 83.64 29.31 32.81 Favored Glycine 0 N--CA 1.448 -0.553 0 C-N-CA 121.005 -0.617 . . . . 0.0 112.24 178.313 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 28.8 m -130.62 151.59 78.98 Favored Pre-proline 0 C--N 1.323 -0.56 0 O-C-N 122.238 -0.566 . . . . 0.0 111.074 -177.824 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . 0.556 ' HG2' ' OG ' ' A' ' 61' ' ' SER . 19.2 Cg_endo -64.5 155.11 68.16 Favored 'Trans proline' 0 N--CA 1.455 -0.773 0 C-N-CA 122.301 2.001 . . . . 0.0 111.481 176.405 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.404 ' HG2' ' SG ' ' A' ' 52' ' ' CYS . 82.4 mtp -74.69 -8.77 57.41 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-O 121.146 0.498 . . . . 0.0 111.458 -176.101 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 29.9 p30 -91.58 -10.43 40.56 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 121.328 0.585 . . . . 0.0 110.749 -179.445 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.556 ' OG ' ' HG2' ' A' ' 58' ' ' PRO . 71.4 m -83.47 -24.8 31.64 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 121.175 0.512 . . . . 0.0 111.649 -179.106 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.537 HD11 ' SG ' ' A' ' 52' ' ' CYS . 1.4 pp -124.99 170.14 11.43 Favored 'General case' 0 C--N 1.302 -1.473 0 N-CA-C 112.685 0.624 . . . . 0.0 112.685 -175.629 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.532 ' O ' ' HA ' ' A' ' 90' ' ' VAL . 42.2 mtm180 -119.14 120.02 35.89 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.811 -0.632 . . . . 0.0 110.66 -178.223 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -102.61 114.76 29.25 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-O 121.124 0.488 . . . . 0.0 110.993 178.264 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.446 ' C ' HD22 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -143.72 162.91 34.77 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-O 121.39 0.614 . . . . 0.0 111.059 -179.854 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 85.9 t80 -144.61 134.15 23.35 Favored 'General case' 0 C--N 1.31 -1.137 0 CA-C-N 116.01 -0.541 . . . . 0.0 109.614 179.168 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.465 ' HG2' HE21 ' A' ' 69' ' ' GLN . 7.0 pt-20 49.31 26.85 1.69 Allowed 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 124.282 1.033 . . . . 0.0 112.562 179.964 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 87.25 22.81 42.99 Favored Glycine 0 N--CA 1.446 -0.653 0 C-N-CA 121.049 -0.596 . . . . 0.0 113.471 -179.683 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . 0.465 HE21 ' HG2' ' A' ' 67' ' ' GLU . 3.4 pt20 -130.06 138.2 50.62 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 179.198 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -72.34 146.75 46.89 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-O 121.28 0.562 . . . . 0.0 110.031 178.065 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.482 HG21 HD12 ' A' ' 44' ' ' LEU . 23.6 mm -94.94 122.27 46.24 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.255 0 CA-C-O 121.174 0.511 . . . . 0.0 110.546 -179.016 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -96.67 160.75 14.21 Favored 'General case' 0 N--CA 1.44 -0.949 0 N-CA-C 109.468 -0.567 . . . . 0.0 109.468 179.561 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . 0.452 ' CA ' ' HB3' ' A' ' 45' ' ' LYS . 11.6 p-10 -68.94 -21.9 64.17 Favored 'General case' 0 C--N 1.311 -1.08 0 CA-C-O 121.377 0.608 . . . . 0.0 111.04 -179.323 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 4.9 m-80 -96.8 1.86 51.23 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-O 121.209 0.528 . . . . 0.0 109.63 -179.721 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . 0.568 ' O ' ' HB2' ' A' ' 44' ' ' LEU . 2.8 m170 -81.29 146.32 30.46 Favored 'General case' 0 CA--C 1.501 -0.915 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 -179.234 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.48 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 72.7 p -118.48 153.83 52.08 Favored Pre-proline 0 C--N 1.302 -1.465 0 C-N-CA 121.038 -0.265 . . . . 0.0 110.699 178.383 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 22.1 Cg_endo -62.1 -37.92 60.21 Favored 'Trans proline' 0 N--CA 1.455 -0.783 0 C-N-CA 122.197 1.931 . . . . 0.0 111.395 -179.387 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . 0.536 ' HG3' ' N ' ' A' ' 79' ' ' GLU . 36.2 pttt -66.11 -41.52 90.46 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.917 0.389 . . . . 0.0 110.797 -179.652 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.536 ' N ' ' HG3' ' A' ' 78' ' ' LYS . 49.7 mm-40 -70.33 -35.9 73.92 Favored 'General case' 0 CA--C 1.515 -0.398 0 CA-C-O 121.023 0.44 . . . . 0.0 111.305 -178.63 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.51 HD21 ' CG ' ' A' ' 75' ' ' HIS . 5.2 mt -78.15 -8.02 57.77 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 120.514 -0.474 . . . . 0.0 110.712 179.843 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 84.07 38.98 9.61 Favored Glycine 0 C--N 1.321 -0.265 0 C-N-CA 120.965 -0.636 . . . . 0.0 112.777 177.905 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 61.6 mtt -100.87 162.34 12.97 Favored 'General case' 0 C--N 1.314 -0.946 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 179.193 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.452 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 4.9 pt-20 -143.4 -171.83 3.58 Favored 'General case' 0 C--N 1.306 -1.303 0 N-CA-C 109.914 -0.402 . . . . 0.0 109.914 179.953 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -69.85 136.59 50.89 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.103 0.478 . . . . 0.0 111.235 -178.777 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 75.55 5.21 4.04 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.712 1.205 . . . . 0.0 111.285 179.306 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . 0.452 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 1.9 t0 -62.78 162.48 10.85 Favored 'General case' 0 C--O 1.238 0.495 0 CA-C-O 121.347 0.594 . . . . 0.0 111.065 177.719 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.428 ' HA ' ' O ' ' A' ' 25' ' ' LYS . 11.4 p -128.51 144.07 39.09 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.911 0 CA-C-O 121.383 0.611 . . . . 0.0 111.734 -176.82 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 3.6 mp -115.5 153.66 17.02 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.758 0 N-CA-C 108.728 -0.842 . . . . 0.0 108.728 178.518 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -107.85 139.44 42.44 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 121.195 0.521 . . . . 0.0 110.915 -176.836 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . 0.532 ' HA ' ' O ' ' A' ' 63' ' ' ARG . 63.3 t -128.77 133.47 66.25 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.023 0 CA-C-O 121.412 0.625 . . . . 0.0 110.949 179.844 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 86.7 m-85 -118.63 179.67 4.06 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-N 115.972 -0.558 . . . . 0.0 109.79 179.183 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 7.5 tp60 -109.47 131.84 54.69 Favored 'General case' 0 C--N 1.316 -0.871 0 O-C-N 122.267 -0.271 . . . . 0.0 110.763 179.207 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . 0.418 ' OE1' ' HG2' ' A' ' 63' ' ' ARG . 7.4 pt-20 -126.06 19.27 7.71 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-O 120.753 0.311 . . . . 0.0 110.691 177.899 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 97.7 mt-30 -54.31 -169.18 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.131 0 N-CA-C 113.128 0.788 . . . . 0.0 113.128 178.422 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 8.3 t -149.16 151.42 34.31 Favored 'General case' 0 C--N 1.315 -0.902 0 O-C-N 121.501 -0.749 . . . . 0.0 110.968 -174.928 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -146.88 44.84 0.8 Allowed Glycine 0 N--CA 1.441 -0.99 0 N-CA-C 111.389 -0.685 . . . . 0.0 111.389 -179.646 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.444 -0.814 0 CA-C-O 119.14 -0.811 . . . . 0.0 111.265 -179.763 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.63 ' HA ' ' OD2' ' A' ' 73' ' ' ASP . 79.1 mtp . . . . . 0 N--CA 1.478 0.952 0 CA-C-O 121.34 0.59 . . . . 0.0 111.13 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 43.1 m -103.63 3.52 34.55 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-O 121.837 0.827 . . . . 0.0 110.199 -177.966 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -86.81 41.21 0.95 Allowed 'General case' 0 C--N 1.305 -1.341 0 CA-C-N 115.291 -0.868 . . . . 0.0 109.719 -178.259 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 5.7 pt20 -164.9 152.16 11.15 Favored 'General case' 0 N--CA 1.445 -0.712 0 CA-C-N 115.77 -0.65 . . . . 0.0 109.737 -176.426 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -170.29 -178.75 2.85 Favored 'General case' 0 C--N 1.317 -0.841 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 179.387 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -84.63 124.92 32.0 Favored 'General case' 0 N--CA 1.438 -1.045 0 N-CA-C 108.683 -0.858 . . . . 0.0 108.683 175.525 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 21.3 ptmt -114.96 150.04 43.49 Favored Pre-proline 0 C--N 1.301 -1.531 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.234 -176.178 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -60.3 144.97 99.5 Favored 'Trans proline' 0 N--CA 1.453 -0.897 0 C-N-CA 122.304 2.003 . . . . 0.0 111.351 -179.982 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 23.8 m 65.02 54.88 1.2 Allowed 'General case' 0 C--O 1.236 0.372 0 CA-C-O 121.608 0.718 . . . . 0.0 109.626 -177.723 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 4.7 m -71.58 136.16 47.3 Favored 'General case' 0 N--CA 1.443 -0.806 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.146 -178.76 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -137.61 96.93 3.33 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 121.201 0.524 . . . . 0.0 110.495 179.51 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -126.18 126.97 44.97 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.133 179.228 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 44.5 mt -96.75 142.5 28.69 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-O 121.549 0.69 . . . . 0.0 111.273 -176.916 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -116.81 60.59 0.43 Allowed Glycine 0 N--CA 1.439 -1.158 0 N-CA-C 111.349 -0.7 . . . . 0.0 111.349 179.242 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 42.9 m-20 -93.59 5.82 50.34 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-O 122.002 0.906 . . . . 0.0 110.588 -178.762 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.551 ' HD2' ' N ' ' A' ' 16' ' ' LYS . 0.2 OUTLIER -106.63 136.47 46.36 Favored 'General case' 0 C--N 1.303 -1.447 0 CA-C-N 115.154 -0.93 . . . . 0.0 108.892 178.619 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 22.3 mmtm -96.05 -168.57 1.78 Allowed 'General case' 0 C--N 1.31 -1.15 0 CA-C-O 121.499 0.666 . . . . 0.0 112.615 -175.984 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.559 ' HB2' ' CE1' ' A' ' 21' ' ' TYR . 10.0 pt-20 -90.16 -166.84 1.68 Allowed 'General case' 0 N--CA 1.445 -0.721 0 CA-C-N 115.481 -0.782 . . . . 0.0 111.151 -176.988 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.492 ' H ' ' HD1' ' A' ' 21' ' ' TYR . . . 117.17 130.06 4.34 Favored Glycine 0 N--CA 1.438 -1.189 0 N-CA-C 111.543 -0.623 . . . . 0.0 111.543 -177.375 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.411 ' HB2' ' O ' ' A' ' 19' ' ' GLY . 1.6 mp0 70.56 34.11 2.22 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 122.819 0.448 . . . . 0.0 110.981 178.934 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.559 ' CE1' ' HB2' ' A' ' 18' ' ' GLU . 44.4 p90 -121.62 164.03 17.98 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 121.561 0.696 . . . . 0.0 111.719 -177.818 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.499 ' HB ' ' HA ' ' A' ' 84' ' ' GLU . 25.9 pt -119.99 172.37 7.16 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.214 0 CA-C-N 115.114 -0.948 . . . . 0.0 109.79 176.697 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.507 ' HE3' ' HG3' ' A' ' 85' ' ' GLU . 0.0 OUTLIER -117.43 149.03 41.24 Favored 'General case' 0 C--N 1.293 -1.872 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 -179.156 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -142.04 158.41 43.79 Favored 'General case' 0 C--N 1.3 -1.581 0 CA-C-O 121.406 0.622 . . . . 0.0 111.477 175.201 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 5.3 tmmm? -128.73 141.97 51.15 Favored 'General case' 0 N--CA 1.436 -1.158 0 CA-C-N 115.604 -0.725 . . . . 0.0 110.225 179.945 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.542 ' O ' ' HA ' ' A' ' 33' ' ' GLU . 0.9 OUTLIER -112.92 142.35 25.59 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.442 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.293 -179.372 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.464 ' O ' ' HB ' ' A' ' 90' ' ' VAL . 44.6 mm -103.92 115.22 45.45 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.359 0 N-CA-C 106.83 -1.544 . . . . 0.0 106.83 173.562 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . 0.439 ' HA2' ' HB ' ' A' ' 90' ' ' VAL . . . -86.26 161.64 34.41 Favored Glycine 0 N--CA 1.422 -2.256 0 C-N-CA 120.022 -1.085 . . . . 0.0 111.185 -175.971 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.17 -24.08 62.77 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-O 121.417 0.627 . . . . 0.0 111.081 176.556 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -96.9 20.1 11.63 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 121.504 0.669 . . . . 0.0 109.658 178.774 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 43.2 m 64.28 17.61 10.83 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-O 121.84 0.829 . . . . 0.0 110.53 -179.101 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 10.6 t -76.8 108.78 10.06 Favored 'General case' 0 N--CA 1.444 -0.734 0 CA-C-N 115.152 -0.931 . . . . 0.0 110.222 -179.372 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.542 ' HA ' ' O ' ' A' ' 26' ' ' VAL . 41.9 mt-10 -87.15 109.79 19.69 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 121.363 0.602 . . . . 0.0 109.943 178.38 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 33.5 mm -100.9 139.11 23.02 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.431 0 CA-C-N 116.037 -0.529 . . . . 0.0 109.596 -178.756 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 12.2 m170 -117.34 132.4 56.6 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 109.395 -0.595 . . . . 0.0 109.395 179.851 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.518 ' HZ ' HG23 ' A' ' 26' ' ' VAL . 1.3 p90 -147.61 163.9 35.16 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-O 121.216 0.532 . . . . 0.0 111.603 -178.668 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.473 ' HD3' ' CE2' ' A' ' 21' ' ' TYR . 88.1 mttt -119.66 119.47 33.8 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.66 -179.123 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.444 HG21 HD12 ' A' ' 47' ' ' LEU . 35.7 m -138.81 157.93 29.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-O 120.911 0.386 . . . . 0.0 110.276 178.904 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.434 ' HA ' ' HA ' ' A' ' 21' ' ' TYR . 47.5 mtpt -83.12 178.14 8.25 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-O 121.45 0.643 . . . . 0.0 111.426 179.073 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -87.26 -31.17 20.4 Favored 'General case' 0 C--N 1.313 -1.01 0 CA-C-O 121.371 0.605 . . . . 0.0 110.144 178.04 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 9.0 t -98.78 19.71 14.36 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.312 -177.268 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 10.0 t -105.54 176.01 5.31 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 178.678 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 53.0 m170 -91.76 147.34 23.06 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-O 121.432 0.634 . . . . 0.0 111.387 -179.426 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.613 ' HB2' ' O ' ' A' ' 75' ' ' HIS . 0.2 OUTLIER -74.58 -12.61 60.5 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 115.53 -0.759 . . . . 0.0 109.226 179.113 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.76 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -57.15 -45.11 83.88 Favored 'General case' 0 N--CA 1.442 -0.825 0 CA-C-N 115.563 -0.744 . . . . 0.0 111.899 -178.55 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.425 ' HG3' ' N ' ' A' ' 47' ' ' LEU . 19.4 ptpt -65.85 -32.1 73.43 Favored 'General case' 0 CA--C 1.508 -0.651 0 CA-C-O 121.695 0.759 . . . . 0.0 109.883 -178.888 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.536 ' HB3' HD13 ' A' ' 44' ' ' LEU . 8.2 tt -71.05 -51.55 24.65 Favored 'General case' 0 N--CA 1.428 -1.553 0 CA-C-N 115.197 -0.911 . . . . 0.0 110.738 -176.724 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.463 ' HA ' ' CD2' ' A' ' 51' ' ' TYR . 6.4 ptmm? -61.19 -41.01 96.04 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.721 -178.017 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.76 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 8.8 pt-20 -72.46 -30.92 65.0 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-O 121.029 0.443 . . . . 0.0 110.703 178.012 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.579 ' O ' ' HG2' ' A' ' 54' ' ' ARG . 32.7 t -68.71 -44.73 73.31 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.945 0.402 . . . . 0.0 111.677 -178.632 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.468 ' CD1' HG11 ' A' ' 26' ' ' VAL . 2.3 p90 -75.06 -32.82 61.61 Favored 'General case' 0 N--CA 1.446 -0.657 0 C-N-CA 119.512 -0.875 . . . . 0.0 110.176 -178.09 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . 0.524 ' SG ' HD11 ' A' ' 62' ' ' LEU . 83.5 m -59.8 -43.94 94.2 Favored 'General case' 0 C--O 1.238 0.454 0 CA-C-O 120.938 0.399 . . . . 0.0 110.703 177.985 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 11.9 pt20 -69.94 -33.69 72.47 Favored 'General case' 0 N--CA 1.447 -0.622 0 C-N-CA 120.769 -0.373 . . . . 0.0 110.617 -179.213 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.579 ' HG2' ' O ' ' A' ' 50' ' ' SER . 9.3 mmp_? -54.78 -40.99 69.99 Favored 'General case' 0 C--N 1.351 0.634 0 CA-C-O 121.403 0.62 . . . . 0.0 110.607 176.192 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.417 HE21 ' HB2' ' A' ' 55' ' ' GLN . 2.9 mt-30 -78.45 -21.48 49.05 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.747 179.6 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 81.74 27.48 46.4 Favored Glycine 0 N--CA 1.443 -0.887 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.223 179.276 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 33.9 m -127.18 148.1 64.62 Favored Pre-proline 0 C--N 1.321 -0.666 0 O-C-N 122.505 -0.409 . . . . 0.0 110.283 -179.145 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . 0.471 ' HG2' ' OG ' ' A' ' 61' ' ' SER . 26.0 Cg_endo -64.87 150.52 88.01 Favored 'Trans proline' 0 N--CA 1.457 -0.647 0 C-N-CA 122.278 1.985 . . . . 0.0 111.999 178.632 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.415 ' HG2' ' SG ' ' A' ' 52' ' ' CYS . 66.2 mtp -69.06 -9.11 50.97 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.231 0.538 . . . . 0.0 111.721 -176.905 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 28.8 p30 -88.82 -12.88 40.72 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-O 121.214 0.53 . . . . 0.0 111.33 -178.751 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.471 ' OG ' ' HG2' ' A' ' 58' ' ' PRO . 55.6 m -88.06 -19.08 27.59 Favored 'General case' 0 C--N 1.316 -0.878 0 N-CA-C 112.654 0.613 . . . . 0.0 112.654 -177.738 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.524 HD11 ' SG ' ' A' ' 52' ' ' CYS . 1.5 pp -132.4 159.96 37.74 Favored 'General case' 0 C--N 1.315 -0.934 0 N-CA-C 113.413 0.894 . . . . 0.0 113.413 -177.386 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.484 ' O ' ' HA ' ' A' ' 90' ' ' VAL . 50.0 mtm-85 -107.86 124.87 50.73 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 114.903 -1.044 . . . . 0.0 111.741 -177.997 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -106.09 117.26 33.56 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.545 178.329 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.472 ' C ' HD22 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -143.01 160.85 39.57 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-O 121.362 0.601 . . . . 0.0 111.161 179.951 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 90.7 t80 -141.35 134.26 28.96 Favored 'General case' 0 C--N 1.31 -1.118 0 N-CA-C 109.033 -0.729 . . . . 0.0 109.033 178.775 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.478 ' HG2' HE21 ' A' ' 69' ' ' GLN . 6.4 pt-20 50.04 26.75 2.19 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 124.124 0.97 . . . . 0.0 112.33 -179.16 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 85.02 25.03 42.22 Favored Glycine 0 N--CA 1.447 -0.627 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.948 -178.833 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . 0.478 HE21 ' HG2' ' A' ' 67' ' ' GLU . 3.3 pt20 -130.86 136.71 48.9 Favored 'General case' 0 C--N 1.322 -0.619 0 O-C-N 122.074 -0.663 . . . . 0.0 109.888 179.279 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.435 ' HD3' ' N ' ' A' ' 70' ' ' ARG . 0.0 OUTLIER -66.72 146.88 53.98 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-O 121.336 0.588 . . . . 0.0 110.557 178.067 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.483 HG21 HD12 ' A' ' 44' ' ' LEU . 20.9 mm -101.45 118.05 47.64 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.133 0 CA-C-O 120.89 0.376 . . . . 0.0 110.264 -179.535 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -99.65 167.34 10.63 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-O 120.882 0.373 . . . . 0.0 110.365 -179.517 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . 0.63 ' OD2' ' HA ' ' A' ' 1' ' ' MET . 7.8 p-10 -67.92 -22.1 65.09 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-O 121.194 0.521 . . . . 0.0 111.391 -179.618 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 8.0 m-80 -98.56 1.09 46.15 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-O 121.338 0.589 . . . . 0.0 110.076 -178.324 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . 0.613 ' O ' ' HB2' ' A' ' 44' ' ' LEU . 2.1 m170 -80.8 142.71 33.46 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 -179.512 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.47 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 81.0 p -116.96 153.25 49.44 Favored Pre-proline 0 C--N 1.306 -1.302 0 CA-C-N 116.79 -0.186 . . . . 0.0 111.29 -179.949 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_exo -58.2 -39.68 82.89 Favored 'Trans proline' 0 C--N 1.347 0.484 0 C-N-CA 122.492 2.128 . . . . 0.0 111.586 178.809 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . 0.518 ' HG3' ' N ' ' A' ' 79' ' ' GLU . 32.7 pttt -67.39 -39.61 85.62 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.082 -178.379 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.518 ' N ' ' HG3' ' A' ' 78' ' ' LYS . 45.9 mm-40 -73.31 -35.66 66.11 Favored 'General case' 0 CA--C 1.511 -0.553 0 CA-C-O 121.166 0.508 . . . . 0.0 110.936 -179.206 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.486 HD21 ' CG ' ' A' ' 75' ' ' HIS . 5.4 mt -81.1 -3.93 53.6 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.074 0.464 . . . . 0.0 110.96 -179.456 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 75.45 48.1 11.32 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.972 -0.632 . . . . 0.0 112.813 177.738 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 63.5 mtt -105.64 161.13 14.65 Favored 'General case' 0 C--N 1.315 -0.929 0 N-CA-C 110.023 -0.362 . . . . 0.0 110.023 178.83 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 14.2 pt-20 -143.04 -173.03 3.8 Favored 'General case' 0 C--N 1.317 -0.841 0 N-CA-C 109.917 -0.401 . . . . 0.0 109.917 179.134 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.499 ' HA ' ' HB ' ' A' ' 22' ' ' ILE . 11.6 pt-20 -68.33 126.46 29.66 Favored 'General case' 0 N--CA 1.447 -0.584 0 CA-C-O 121.466 0.65 . . . . 0.0 111.68 -179.188 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . 0.507 ' HG3' ' HE3' ' A' ' 23' ' ' LYS . 33.5 mt-10 77.54 8.39 2.66 Favored 'General case' 0 C--N 1.322 -0.625 0 C-N-CA 124.723 1.209 . . . . 0.0 112.738 177.19 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -63.42 167.15 5.69 Favored 'General case' 0 C--O 1.239 0.539 0 CA-C-O 121.082 0.468 . . . . 0.0 110.302 174.754 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 15.0 p -125.9 143.93 37.73 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.036 0 CA-C-O 121.516 0.674 . . . . 0.0 111.752 -176.153 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . 0.425 ' HB ' HG22 ' A' ' 26' ' ' VAL . 2.3 mt -111.86 152.96 13.63 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 N-CA-C 108.836 -0.801 . . . . 0.0 108.836 177.646 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.404 ' O ' HD13 ' A' ' 65' ' ' LEU . 9.5 tp10 -106.64 137.44 44.65 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-O 120.924 0.392 . . . . 0.0 110.58 -177.38 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . 0.484 ' HA ' ' O ' ' A' ' 63' ' ' ARG . 90.2 t -129.02 133.4 66.08 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-O 121.317 0.58 . . . . 0.0 111.454 178.667 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 82.1 m-85 -118.92 178.41 4.5 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.375 179.429 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 9.5 tp60 -105.15 135.95 45.54 Favored 'General case' 0 C--N 1.31 -1.124 0 O-C-N 122.241 -0.287 . . . . 0.0 110.623 -179.281 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -127.84 21.68 6.38 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.262 0.553 . . . . 0.0 110.403 176.358 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 98.1 mt-30 -55.33 -178.35 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.554 0 CA-C-N 115.745 -0.661 . . . . 0.0 111.816 176.778 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 7.1 t -85.7 133.18 34.03 Favored 'General case' 0 C--N 1.305 -1.346 0 CA-C-O 121.477 0.656 . . . . 0.0 111.27 -173.674 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -104.35 51.3 0.81 Allowed Glycine 0 N--CA 1.44 -1.043 0 C-N-CA 120.983 -0.627 . . . . 0.0 111.64 179.181 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.003 0 CA-C-O 118.645 -1.086 . . . . 0.0 111.768 -179.787 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.2 mpt? . . . . . 0 N--CA 1.48 1.071 0 CA-C-O 121.311 0.577 . . . . 0.0 110.601 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 16.9 p -95.12 7.33 46.48 Favored 'General case' 0 C--N 1.312 -1.024 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.819 -177.969 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 35.7 t70 66.0 80.43 0.22 Allowed 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 121.982 0.896 . . . . 0.0 109.544 -177.153 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.436 ' H ' ' HG2' ' A' ' 4' ' ' GLN . 7.3 pt20 -93.99 145.52 24.59 Favored 'General case' 0 C--N 1.303 -1.443 0 CA-C-N 115.32 -0.854 . . . . 0.0 111.035 -177.113 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -82.52 -176.28 6.16 Favored 'General case' 0 C--N 1.309 -1.173 0 CA-C-O 121.368 0.604 . . . . 0.0 111.646 -177.803 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -115.57 143.83 44.76 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.837 -0.619 . . . . 0.0 109.91 -179.353 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -137.94 157.97 72.19 Favored Pre-proline 0 N--CA 1.437 -1.085 0 N-CA-C 109.919 -0.4 . . . . 0.0 109.919 -178.051 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -57.98 149.65 69.26 Favored 'Trans proline' 0 C--O 1.234 0.322 0 C-N-CA 122.718 2.279 . . . . 0.0 112.048 179.534 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 10.4 p -97.31 4.42 50.84 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-O 121.529 0.68 . . . . 0.0 111.118 -178.63 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 12.7 t -169.15 179.14 4.11 Favored 'General case' 0 C--N 1.317 -0.848 0 CA-C-N 115.886 -0.597 . . . . 0.0 109.554 178.296 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.6 tm-20 -137.79 109.38 7.01 Favored 'General case' 0 C--N 1.315 -0.902 0 N-CA-C 109.602 -0.518 . . . . 0.0 109.602 -179.464 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -145.92 164.83 30.77 Favored 'General case' 0 C--N 1.317 -0.843 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 -178.342 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 1.9 pp -158.84 158.94 34.44 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.185 0.516 . . . . 0.0 111.608 -179.767 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -142.3 49.22 0.75 Allowed Glycine 0 N--CA 1.446 -0.655 0 C-N-CA 121.094 -0.574 . . . . 0.0 112.046 178.644 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -60.06 145.14 47.6 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.213 0.53 . . . . 0.0 111.225 179.863 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 73.7 mmtt -99.27 151.52 20.94 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-O 120.933 0.397 . . . . 0.0 110.45 -178.875 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 21.1 ptmt -81.18 151.72 28.07 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 121.243 0.544 . . . . 0.0 110.823 -178.756 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -90.77 -175.24 4.32 Favored 'General case' 0 C--N 1.31 -1.127 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.726 177.644 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -150.85 -109.6 0.46 Allowed Glycine 0 N--CA 1.44 -1.045 0 C-N-CA 120.46 -0.876 . . . . 0.0 112.538 -179.861 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 22.6 mt-10 -114.44 6.79 16.08 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 121.201 0.524 . . . . 0.0 110.242 -178.354 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.459 ' CE1' ' HD3' ' A' ' 37' ' ' LYS . 35.0 p90 -89.39 166.11 13.93 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-O 121.591 0.71 . . . . 0.0 112.539 -174.458 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.4 ' HB ' ' HA ' ' A' ' 84' ' ' GLU . 24.0 pt -118.92 172.27 6.25 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.917 0 CA-C-N 115.128 -0.942 . . . . 0.0 109.395 177.284 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 45.3 mtmt -115.75 142.54 46.61 Favored 'General case' 0 C--N 1.294 -1.827 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 -179.509 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.4 mp -136.21 162.59 32.55 Favored 'General case' 0 C--N 1.302 -1.473 0 CA-C-O 121.098 0.475 . . . . 0.0 110.445 175.257 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.45 ' HE2' ' HB3' ' A' ' 25' ' ' LYS . 5.3 tmmm? -133.62 143.59 48.72 Favored 'General case' 0 C--N 1.308 -1.211 0 CA-C-O 121.403 0.621 . . . . 0.0 110.592 -178.786 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.511 HG23 ' HZ ' ' A' ' 36' ' ' PHE . 0.9 OUTLIER -115.0 143.33 24.98 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.454 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.046 -179.896 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.421 ' O ' ' HB ' ' A' ' 90' ' ' VAL . 45.4 mm -107.61 116.57 51.42 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.022 0 N-CA-C 107.683 -1.228 . . . . 0.0 107.683 175.392 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . 0.453 ' HA2' ' HB ' ' A' ' 90' ' ' VAL . . . -84.65 175.44 50.68 Favored Glycine 0 N--CA 1.419 -2.488 0 C-N-CA 120.158 -1.02 . . . . 0.0 111.834 -177.312 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.57 -22.18 63.55 Favored 'General case' 0 C--N 1.302 -1.476 0 CA-C-O 121.626 0.727 . . . . 0.0 110.324 179.906 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -100.57 13.73 33.71 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.693 -0.685 . . . . 0.0 109.219 178.523 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 19.3 m 71.49 15.59 6.11 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 115.376 -0.829 . . . . 0.0 111.319 179.265 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 10.9 t -72.35 114.59 10.63 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 109.697 -0.482 . . . . 0.0 109.697 179.199 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.445 ' HA ' ' O ' ' A' ' 26' ' ' VAL . 34.5 mt-10 -87.55 108.62 19.14 Favored 'General case' 0 CA--C 1.509 -0.61 0 CA-C-O 121.164 0.507 . . . . 0.0 110.42 179.187 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.437 HG21 ' HA ' ' A' ' 51' ' ' TYR . 38.9 mm -97.88 137.69 24.76 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.589 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 179.206 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 12.4 m170 -115.97 136.56 52.92 Favored 'General case' 0 C--N 1.315 -0.918 0 N-CA-C 109.3 -0.63 . . . . 0.0 109.3 -179.045 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.511 ' HZ ' HG23 ' A' ' 26' ' ' VAL . 0.5 OUTLIER -147.28 155.66 42.24 Favored 'General case' 0 C--N 1.308 -1.196 0 CA-C-O 121.309 0.576 . . . . 0.0 111.275 -178.501 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.459 ' HD3' ' CE1' ' A' ' 21' ' ' TYR . 93.4 mttt -113.67 113.37 24.92 Favored 'General case' 0 C--N 1.31 -1.13 0 CA-C-N 115.723 -0.672 . . . . 0.0 109.999 -179.177 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.416 HG21 HD12 ' A' ' 47' ' ' LEU . 28.2 m -134.91 158.18 41.28 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.768 0 CA-C-O 120.87 0.367 . . . . 0.0 110.069 -179.792 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.533 ' O ' HG22 ' A' ' 42' ' ' THR . 80.8 tttt -90.33 165.13 14.05 Favored 'General case' 0 C--N 1.311 -1.066 0 O-C-N 121.822 -0.549 . . . . 0.0 110.683 -179.021 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -70.14 -37.02 75.16 Favored 'General case' 0 N--CA 1.463 0.224 0 O-C-N 121.969 -0.457 . . . . 0.0 111.854 -177.771 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 14.5 t -97.13 19.09 13.51 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-O 120.939 0.4 . . . . 0.0 111.93 -176.471 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . 0.533 HG22 ' O ' ' A' ' 39' ' ' LYS . 3.4 t -100.24 167.64 10.3 Favored 'General case' 0 C--N 1.323 -0.561 0 O-C-N 121.797 -0.564 . . . . 0.0 109.72 178.855 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 37.3 m170 -82.16 141.77 32.78 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 121.576 0.703 . . . . 0.0 111.459 179.903 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.645 HD13 ' HB3' ' A' ' 47' ' ' LEU . 0.2 OUTLIER -70.84 -13.88 62.2 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.459 -0.791 . . . . 0.0 109.731 -179.741 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.728 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -54.59 -43.65 72.34 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 115.787 -0.642 . . . . 0.0 112.009 -179.31 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.434 ' N ' ' HD3' ' A' ' 45' ' ' LYS . 21.9 ptmt -69.23 -28.4 66.31 Favored 'General case' 0 C--O 1.201 -1.451 0 CA-C-O 120.911 0.386 . . . . 0.0 110.462 -179.158 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.645 ' HB3' HD13 ' A' ' 44' ' ' LEU . 8.4 tt -74.36 -49.34 23.14 Favored 'General case' 0 C--N 1.302 -1.459 0 CA-C-O 120.994 0.426 . . . . 0.0 110.631 -178.855 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.453 ' HA ' ' CD2' ' A' ' 51' ' ' TYR . 6.8 ptmm? -62.6 -43.17 99.47 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.328 -0.397 . . . . 0.0 111.404 -177.555 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.728 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 8.1 pt-20 -70.8 -33.47 70.76 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-O 121.021 0.439 . . . . 0.0 110.626 178.139 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.673 ' O ' ' HG2' ' A' ' 54' ' ' ARG . 10.5 m -67.81 -41.87 82.42 Favored 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 -178.122 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.505 ' CD1' HG11 ' A' ' 26' ' ' VAL . 3.4 p90 -76.68 -33.09 58.27 Favored 'General case' 0 C--N 1.32 -0.707 0 C-N-CA 119.129 -1.029 . . . . 0.0 110.392 -178.532 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . 0.593 ' SG ' HD11 ' A' ' 62' ' ' LEU . 90.6 m -62.42 -44.89 95.34 Favored 'General case' 0 CA--C 1.509 -0.625 0 CA-C-O 121.296 0.57 . . . . 0.0 110.465 179.419 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.438 ' HG2' ' O ' ' A' ' 50' ' ' SER . 13.8 pt20 -67.23 -33.83 76.19 Favored 'General case' 0 N--CA 1.44 -0.953 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.743 -179.392 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.673 ' HG2' ' O ' ' A' ' 50' ' ' SER . 40.4 mmt180 -56.59 -44.4 81.04 Favored 'General case' 0 C--N 1.351 0.638 0 CA-C-O 121.368 0.604 . . . . 0.0 110.434 177.002 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.415 HE21 ' HB2' ' A' ' 55' ' ' GLN . 4.0 mt-30 -73.38 -20.82 60.66 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.736 -0.666 . . . . 0.0 111.462 -179.555 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 79.66 33.37 34.5 Favored Glycine 0 N--CA 1.448 -0.547 0 C-N-CA 120.675 -0.774 . . . . 0.0 111.765 -179.758 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 29.1 m -132.93 151.28 77.72 Favored Pre-proline 0 C--O 1.24 0.565 0 O-C-N 122.532 -0.393 . . . . 0.0 110.518 -179.298 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . 0.463 ' HG2' ' OG ' ' A' ' 61' ' ' SER . 40.9 Cg_endo -69.62 148.93 67.08 Favored 'Trans proline' 0 N--CA 1.459 -0.555 0 C-N-CA 122.506 2.138 . . . . 0.0 112.307 179.065 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.526 ' HG2' ' SG ' ' A' ' 52' ' ' CYS . 72.8 mtp -71.22 -11.28 60.84 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.602 -0.726 . . . . 0.0 111.637 -177.382 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 24.7 p30 -88.02 -12.2 45.09 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-O 121.311 0.577 . . . . 0.0 111.461 -179.191 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.463 ' OG ' ' HG2' ' A' ' 58' ' ' PRO . 66.4 m -90.49 -20.85 22.23 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-O 120.928 0.394 . . . . 0.0 111.951 -179.585 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.593 HD11 ' SG ' ' A' ' 52' ' ' CYS . 2.0 pp -123.32 164.99 17.75 Favored 'General case' 0 C--N 1.313 -0.986 0 N-CA-C 113.031 0.752 . . . . 0.0 113.031 -177.796 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.532 ' O ' ' HA ' ' A' ' 90' ' ' VAL . 5.8 mtp180 -114.47 123.13 48.64 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.538 -0.755 . . . . 0.0 110.585 -178.691 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.461 ' HB3' ' OH ' ' A' ' 51' ' ' TYR . 0.2 OUTLIER -104.27 113.48 27.06 Favored 'General case' 0 C--N 1.307 -1.278 0 CA-C-O 120.986 0.422 . . . . 0.0 110.145 176.53 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.446 ' C ' HD22 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -142.79 165.13 28.21 Favored 'General case' 0 N--CA 1.438 -1.068 0 CA-C-O 121.634 0.73 . . . . 0.0 111.88 -179.144 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 92.3 t80 -145.44 134.76 23.0 Favored 'General case' 0 C--N 1.305 -1.361 0 N-CA-C 108.542 -0.91 . . . . 0.0 108.542 178.537 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.448 ' HG2' HE21 ' A' ' 69' ' ' GLN . 5.3 pt-20 50.24 26.7 2.3 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 124.359 1.064 . . . . 0.0 112.204 -177.927 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 86.79 17.5 59.72 Favored Glycine 0 CA--C 1.519 0.287 0 C-N-CA 120.781 -0.723 . . . . 0.0 113.314 -178.803 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . 0.448 HE21 ' HG2' ' A' ' 67' ' ' GLU . 2.9 pt20 -124.39 134.65 53.06 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 -179.74 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -70.25 146.7 50.47 Favored 'General case' 0 C--N 1.312 -1.032 0 CA-C-O 121.376 0.608 . . . . 0.0 110.301 178.017 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.501 HG21 HD12 ' A' ' 44' ' ' LEU . 22.7 mm -94.36 122.76 46.11 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.55 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.283 -178.557 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -98.79 166.75 11.16 Favored 'General case' 0 N--CA 1.439 -0.978 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 -179.499 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -67.55 -26.0 66.09 Favored 'General case' 0 C--N 1.313 -1.001 0 CA-C-O 121.265 0.555 . . . . 0.0 111.259 -178.421 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 8.1 m-80 -97.23 4.99 50.79 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-O 121.327 0.584 . . . . 0.0 110.097 -177.799 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . 0.603 ' O ' ' HB2' ' A' ' 44' ' ' LEU . 2.5 m170 -83.68 145.94 28.51 Favored 'General case' 0 CA--C 1.507 -0.71 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 179.232 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.42 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 43.7 p -122.81 158.76 56.12 Favored Pre-proline 0 C--N 1.31 -1.119 0 C-N-CA 121.012 -0.275 . . . . 0.0 110.742 179.003 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_exo -60.81 -40.54 53.09 Favored 'Trans proline' 0 N--CA 1.457 -0.627 0 C-N-CA 122.538 2.159 . . . . 0.0 111.604 179.054 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . 0.521 ' HG3' ' N ' ' A' ' 79' ' ' GLU . 20.7 pttt -68.99 -36.75 78.18 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.947 0.404 . . . . 0.0 110.992 -177.935 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.521 ' N ' ' HG3' ' A' ' 78' ' ' LYS . 52.5 mm-40 -69.84 -40.56 75.74 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-O 120.921 0.391 . . . . 0.0 110.636 -179.243 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.42 ' HG ' ' O ' ' A' ' 76' ' ' THR . 5.4 mt -79.74 -6.71 57.78 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.25 0.548 . . . . 0.0 110.864 -178.985 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 80.45 45.14 8.17 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.967 -0.635 . . . . 0.0 113.01 177.794 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 59.5 mtt -102.7 163.33 12.28 Favored 'General case' 0 C--N 1.317 -0.806 0 N-CA-C 109.755 -0.461 . . . . 0.0 109.755 178.388 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -136.93 -172.45 3.19 Favored 'General case' 0 C--N 1.312 -1.045 0 CA-C-O 120.884 0.373 . . . . 0.0 110.01 179.113 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.4 ' HA ' ' HB ' ' A' ' 22' ' ' ILE . 12.6 pt-20 -70.43 141.47 52.1 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 177.738 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 73.78 1.93 4.07 Favored 'General case' 0 CA--C 1.552 1.05 0 C-N-CA 123.826 0.851 . . . . 0.0 111.283 179.868 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -63.91 161.77 15.03 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-O 121.269 0.557 . . . . 0.0 110.97 179.123 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.421 ' HA ' ' O ' ' A' ' 25' ' ' LYS . 8.6 p -127.64 142.88 42.43 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.079 0 CA-C-O 121.418 0.627 . . . . 0.0 111.505 -176.302 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 3.7 mp -112.57 152.93 14.27 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.855 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 178.667 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.407 ' O ' HD13 ' A' ' 65' ' ' LEU . 7.2 tp10 -105.43 137.49 43.17 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-O 120.969 0.414 . . . . 0.0 110.484 -175.785 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . 0.532 ' HA ' ' O ' ' A' ' 63' ' ' ARG . 78.4 t -128.75 135.7 61.64 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.887 0 CA-C-O 121.259 0.552 . . . . 0.0 110.793 179.16 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 91.8 m-85 -122.71 177.84 5.28 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.201 179.155 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 9.6 tp60 -108.44 121.32 44.7 Favored 'General case' 0 C--N 1.312 -1.051 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 179.553 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . 0.466 ' HB3' ' CG ' ' A' ' 63' ' ' ARG . 9.3 pt-20 -110.26 19.74 18.56 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-O 121.022 0.439 . . . . 0.0 111.068 179.991 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . 0.43 HE21 ' HB3' ' A' ' 61' ' ' SER . 97.3 mt-30 -61.92 -166.52 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.742 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.332 175.812 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 10.1 t -149.66 133.09 16.59 Favored 'General case' 0 C--N 1.313 -1.009 0 O-C-N 120.963 -1.086 . . . . 0.0 111.615 -177.291 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -89.96 -17.32 54.21 Favored Glycine 0 N--CA 1.439 -1.142 0 N-CA-C 110.843 -0.903 . . . . 0.0 110.843 176.899 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.434 -1.436 0 CA-C-O 118.499 -1.167 . . . . 0.0 111.319 179.084 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 58.3 ttp . . . . . 0 N--CA 1.477 0.911 0 CA-C-O 120.474 0.178 . . . . 0.0 110.755 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 33.4 t 75.82 -18.26 0.47 Allowed 'General case' 0 CA--C 1.548 0.899 0 N-CA-C 113.802 1.038 . . . . 0.0 113.802 175.926 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -114.14 -6.57 13.06 Favored 'General case' 0 C--N 1.323 -0.57 0 O-C-N 121.468 -0.77 . . . . 0.0 111.742 -177.968 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 41.8 mt-30 -81.18 111.96 18.08 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.313 0.578 . . . . 0.0 111.563 -178.318 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -143.64 -170.04 3.21 Favored 'General case' 0 C--N 1.31 -1.145 0 CA-C-N 116.092 -0.504 . . . . 0.0 109.76 178.018 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -138.05 175.11 9.87 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-O 120.974 0.416 . . . . 0.0 111.045 -177.925 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -159.01 151.26 17.55 Favored Pre-proline 0 C--N 1.318 -0.773 0 CA-C-N 116.07 -0.514 . . . . 0.0 109.81 178.069 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 29.9 Cg_endo -63.97 144.95 89.28 Favored 'Trans proline' 0 N--CA 1.461 -0.412 0 C-N-CA 122.387 2.058 . . . . 0.0 111.849 179.806 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 19.8 p -126.96 -11.25 5.97 Favored 'General case' 0 C--N 1.31 -1.129 0 CA-C-O 121.358 0.599 . . . . 0.0 110.566 -179.886 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 17.0 m -154.32 130.97 10.7 Favored 'General case' 0 N--CA 1.445 -0.675 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 179.254 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -69.9 126.9 31.08 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 121.13 0.491 . . . . 0.0 109.685 177.922 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -144.05 86.67 1.86 Allowed 'General case' 0 C--N 1.313 -1.007 0 CA-C-O 121.414 0.626 . . . . 0.0 109.859 -179.501 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.407 ' HG ' ' H ' ' A' ' 13' ' ' LEU . 0.9 OUTLIER -71.67 156.0 39.86 Favored 'General case' 0 N--CA 1.429 -1.48 0 CA-C-N 115.56 -0.746 . . . . 0.0 110.931 179.736 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -161.76 68.31 0.24 Allowed Glycine 0 N--CA 1.431 -1.643 0 C-N-CA 120.452 -0.88 . . . . 0.0 112.344 -178.877 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 24.1 m-20 -136.12 33.58 2.85 Favored 'General case' 0 CA--C 1.506 -0.745 0 CA-C-O 121.876 0.846 . . . . 0.0 109.666 179.914 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 5.5 mtpm? -130.83 -172.38 2.8 Favored 'General case' 0 C--N 1.311 -1.096 0 CA-C-N 115.298 -0.865 . . . . 0.0 109.699 -178.248 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 20.6 ptmt -81.23 -177.85 6.65 Favored 'General case' 0 C--N 1.315 -0.923 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 174.851 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.482 ' OE2' ' HD3' ' A' ' 37' ' ' LYS . 7.4 pt-20 -169.11 162.47 10.85 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.198 0.523 . . . . 0.0 111.996 -175.593 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -173.13 170.6 43.75 Favored Glycine 0 N--CA 1.439 -1.107 0 N-CA-C 111.038 -0.825 . . . . 0.0 111.038 179.352 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 64.5 24.39 13.09 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-O 121.164 0.507 . . . . 0.0 111.547 178.603 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 54.9 p90 -109.37 175.69 5.36 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-O 120.932 0.396 . . . . 0.0 110.494 -179.387 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.418 HD13 ' HG2' ' A' ' 40' ' ' MET . 23.0 pt -125.85 171.18 14.88 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.903 0 CA-C-O 121.39 0.614 . . . . 0.0 110.446 177.905 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.414 ' HE3' ' HB2' ' A' ' 23' ' ' LYS . 40.8 mtmt -119.11 142.07 48.23 Favored 'General case' 0 C--N 1.304 -1.406 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 -179.367 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.5 mp -136.04 164.11 28.77 Favored 'General case' 0 C--N 1.304 -1.411 0 CA-C-O 121.268 0.556 . . . . 0.0 110.811 176.097 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.42 ' HE2' ' HB3' ' A' ' 25' ' ' LYS . 5.6 tmmm? -136.45 145.06 44.79 Favored 'General case' 0 C--N 1.311 -1.107 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.448 -179.271 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.55 ' O ' ' HA ' ' A' ' 33' ' ' GLU . 0.9 OUTLIER -115.73 142.44 28.93 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.291 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.968 -179.768 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.434 ' CD1' ' HG2' ' A' ' 33' ' ' GLU . 45.4 mm -109.17 98.15 6.66 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.874 0 N-CA-C 108.498 -0.927 . . . . 0.0 108.498 175.884 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . 0.545 ' HA2' ' HB ' ' A' ' 90' ' ' VAL . . . -67.12 166.04 41.66 Favored Glycine 0 N--CA 1.436 -1.339 0 C-N-CA 120.45 -0.881 . . . . 0.0 112.764 178.321 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.43 -16.9 40.47 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 121.129 0.49 . . . . 0.0 112.311 179.209 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -102.76 18.1 22.25 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 121.487 0.66 . . . . 0.0 109.69 178.754 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 7.3 m 69.72 17.21 7.79 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.376 -179.134 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 12.8 t -73.46 108.48 6.35 Favored 'General case' 0 N--CA 1.444 -0.766 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.698 -178.458 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.55 ' HA ' ' O ' ' A' ' 26' ' ' VAL . 40.6 mt-10 -87.09 104.29 16.19 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-O 121.111 0.481 . . . . 0.0 110.479 178.287 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 40.2 mm -97.21 136.86 26.55 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.426 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 178.103 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 12.8 m170 -114.78 134.48 55.08 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 -178.148 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.524 ' HZ ' HG23 ' A' ' 26' ' ' VAL . 1.1 p90 -147.15 158.37 43.92 Favored 'General case' 0 C--N 1.309 -1.193 0 CA-C-O 121.397 0.618 . . . . 0.0 111.061 -178.919 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.482 ' HD3' ' OE2' ' A' ' 18' ' ' GLU . 7.3 ptpt -120.1 120.74 37.13 Favored 'General case' 0 C--N 1.307 -1.26 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.289 -178.913 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 33.4 m -139.87 162.0 25.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-O 121.352 0.596 . . . . 0.0 110.962 -178.514 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.58 ' O ' HG22 ' A' ' 42' ' ' THR . 19.1 mmmt -80.8 156.03 26.35 Favored 'General case' 0 C--N 1.312 -1.025 0 CA-C-O 121.027 0.442 . . . . 0.0 110.851 177.488 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . 0.443 ' O ' ' HG2' ' A' ' 78' ' ' LYS . 0.0 OUTLIER -70.55 -35.51 73.15 Favored 'General case' 0 CA--C 1.506 -0.746 0 CA-C-O 121.404 0.621 . . . . 0.0 109.903 177.521 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 12.9 t -91.98 18.48 7.85 Favored 'General case' 0 N--CA 1.438 -1.035 0 CA-C-N 115.724 -0.671 . . . . 0.0 112.284 -176.396 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . 0.58 HG22 ' O ' ' A' ' 39' ' ' LYS . 3.7 t -105.51 169.93 8.18 Favored 'General case' 0 C--N 1.323 -0.579 0 O-C-N 121.876 -0.515 . . . . 0.0 110.157 -179.705 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 40.2 m170 -81.65 141.65 33.46 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 121.561 0.696 . . . . 0.0 111.487 179.79 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.6 HD13 ' HB3' ' A' ' 47' ' ' LEU . 0.2 OUTLIER -70.96 -12.14 61.37 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 115.303 -0.862 . . . . 0.0 109.596 179.702 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.813 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -55.65 -50.24 70.75 Favored 'General case' 0 N--CA 1.441 -0.884 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.802 -179.186 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.521 ' O ' ' HB2' ' A' ' 50' ' ' SER . 20.7 ptmt -63.31 -29.14 70.51 Favored 'General case' 0 C--O 1.218 -0.576 0 CA-C-O 121.318 0.58 . . . . 0.0 110.688 -177.928 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.6 ' HB3' HD13 ' A' ' 44' ' ' LEU . 8.4 tt -72.63 -50.86 22.36 Favored 'General case' 0 C--N 1.307 -1.265 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.766 -179.072 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.482 ' HA ' ' CD2' ' A' ' 51' ' ' TYR . 7.2 ptmm? -62.97 -41.28 99.49 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.923 0.392 . . . . 0.0 111.764 -177.537 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.813 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 7.0 pt-20 -72.25 -30.06 64.51 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-O 121.104 0.478 . . . . 0.0 110.528 177.828 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.684 ' O ' ' HG2' ' A' ' 54' ' ' ARG . 15.7 t -68.58 -45.69 71.37 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.414 -179.151 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.482 ' CD2' ' HA ' ' A' ' 48' ' ' LYS . 2.7 p90 -74.74 -32.93 62.25 Favored 'General case' 0 N--CA 1.448 -0.538 0 C-N-CA 119.772 -0.771 . . . . 0.0 110.48 -177.266 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . 0.497 ' SG ' HD11 ' A' ' 62' ' ' LEU . 98.6 m -60.93 -44.27 97.47 Favored 'General case' 0 C--O 1.239 0.541 0 CA-C-O 120.879 0.371 . . . . 0.0 110.822 179.048 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 10.6 pt20 -70.52 -31.57 68.7 Favored 'General case' 0 N--CA 1.444 -0.742 0 C-N-CA 120.368 -0.533 . . . . 0.0 110.966 -179.274 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.684 ' HG2' ' O ' ' A' ' 50' ' ' SER . 34.0 mmt180 -57.41 -36.3 71.15 Favored 'General case' 0 C--N 1.351 0.64 0 CA-C-O 121.237 0.541 . . . . 0.0 110.496 176.616 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.416 HE21 ' HB2' ' A' ' 55' ' ' GLN . 2.9 mt-30 -83.61 -20.82 33.01 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.844 179.797 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 80.88 33.09 30.92 Favored Glycine 0 N--CA 1.446 -0.666 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.47 178.933 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 35.1 m -132.33 148.65 70.53 Favored Pre-proline 0 C--N 1.322 -0.594 0 O-C-N 122.481 -0.423 . . . . 0.0 110.46 -179.8 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . 0.474 ' HG2' ' OG ' ' A' ' 61' ' ' SER . 28.8 Cg_endo -65.18 149.29 88.99 Favored 'Trans proline' 0 N--CA 1.458 -0.582 0 C-N-CA 122.31 2.007 . . . . 0.0 111.705 178.136 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.485 ' HG2' ' SG ' ' A' ' 52' ' ' CYS . 66.8 mtp -71.55 -9.32 58.04 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.524 -176.312 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 33.2 p30 -87.75 -10.25 51.61 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-O 121.404 0.621 . . . . 0.0 111.029 -178.959 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.474 ' OG ' ' HG2' ' A' ' 58' ' ' PRO . 74.3 m -90.11 -24.66 21.04 Favored 'General case' 0 N--CA 1.434 -1.245 0 CA-C-N 115.936 -0.575 . . . . 0.0 112.1 -177.579 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.497 HD11 ' SG ' ' A' ' 52' ' ' CYS . 1.5 pp -123.53 167.41 13.94 Favored 'General case' 0 C--N 1.307 -1.276 0 N-CA-C 112.538 0.57 . . . . 0.0 112.538 -177.483 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.483 ' O ' ' HA ' ' A' ' 90' ' ' VAL . 74.2 mtm180 -119.18 119.27 33.65 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.095 -176.949 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -100.9 116.08 31.92 Favored 'General case' 0 C--N 1.31 -1.113 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.847 178.587 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.449 ' C ' HD22 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -144.29 164.2 31.45 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.342 0.591 . . . . 0.0 110.918 -179.925 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 87.7 t80 -145.92 134.09 21.63 Favored 'General case' 0 C--N 1.309 -1.187 0 N-CA-C 109.219 -0.66 . . . . 0.0 109.219 178.388 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.425 ' HG2' HE21 ' A' ' 69' ' ' GLN . 7.9 pt-20 49.69 27.13 2.07 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 124.291 1.036 . . . . 0.0 112.563 -179.825 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 90.15 16.91 55.01 Favored Glycine 0 CA--C 1.521 0.411 0 C-N-CA 121.033 -0.603 . . . . 0.0 113.391 179.255 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . 0.425 HE21 ' HG2' ' A' ' 67' ' ' GLU . 2.7 pt20 -127.97 133.92 49.24 Favored 'General case' 0 C--N 1.317 -0.842 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 -179.986 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -72.36 146.85 46.79 Favored 'General case' 0 C--N 1.309 -1.193 0 CA-C-O 121.588 0.709 . . . . 0.0 110.705 178.807 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.472 HG21 HD12 ' A' ' 44' ' ' LEU . 20.7 mm -93.81 117.28 37.02 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.482 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.3 -178.611 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.409 ' O ' ' HB2' ' A' ' 75' ' ' HIS . . . -97.73 162.78 13.11 Favored 'General case' 0 N--CA 1.436 -1.141 0 N-CA-C 109.872 -0.418 . . . . 0.0 109.872 -179.761 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . 0.485 ' O ' ' HB3' ' A' ' 45' ' ' LYS . 7.4 p-10 -65.82 -22.46 66.56 Favored 'General case' 0 C--N 1.312 -1.039 0 CA-C-O 121.168 0.509 . . . . 0.0 111.7 -179.347 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 10.7 m-80 -96.03 2.86 53.65 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-O 121.382 0.61 . . . . 0.0 110.135 179.53 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . 0.595 ' O ' ' HB2' ' A' ' 44' ' ' LEU . 3.4 m170 -83.83 146.56 28.04 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 109.597 -0.519 . . . . 0.0 109.597 178.565 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.52 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 72.4 p -122.54 156.18 61.56 Favored Pre-proline 0 C--N 1.31 -1.147 0 O-C-N 122.307 -0.246 . . . . 0.0 111.062 178.555 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 25.0 Cg_exo -62.07 -37.45 64.01 Favored 'Trans proline' 0 C--N 1.351 0.676 0 C-N-CA 122.319 2.013 . . . . 0.0 110.999 179.243 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . 0.443 ' HG2' ' O ' ' A' ' 40' ' ' MET . 14.6 ptmt -67.26 -40.84 86.28 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.577 -179.165 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 47.4 mm-40 -75.33 -35.45 61.19 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 120.936 0.398 . . . . 0.0 111.355 -178.356 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.52 ' HG ' ' O ' ' A' ' 76' ' ' THR . 5.9 mt -79.27 -4.0 48.63 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-O 121.074 0.464 . . . . 0.0 110.688 179.762 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 74.04 47.85 17.51 Favored Glycine 0 N--CA 1.445 -0.759 0 C-N-CA 120.815 -0.707 . . . . 0.0 112.622 178.229 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 64.4 mtt -103.6 165.5 10.99 Favored 'General case' 0 C--N 1.313 -0.982 0 N-CA-C 109.516 -0.55 . . . . 0.0 109.516 178.204 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.475 ' O ' ' HB2' ' A' ' 86' ' ' ASP . 12.9 pt-20 -139.62 -172.88 3.47 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-O 120.842 0.354 . . . . 0.0 110.465 178.838 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -72.7 137.84 46.23 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-O 121.234 0.54 . . . . 0.0 111.152 -179.216 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 26.0 tt0 77.34 3.43 3.16 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.791 1.237 . . . . 0.0 111.052 179.495 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . 0.475 ' HB2' ' O ' ' A' ' 83' ' ' GLU . 0.5 OUTLIER -60.62 162.45 6.5 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 121.366 0.603 . . . . 0.0 111.212 178.135 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 13.5 p -128.18 146.63 33.4 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.176 0 CA-C-O 121.207 0.527 . . . . 0.0 110.675 -177.677 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 3.8 mp -114.75 152.16 16.41 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.99 0 N-CA-C 108.844 -0.799 . . . . 0.0 108.844 178.536 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -104.9 138.77 40.63 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 109.931 -0.396 . . . . 0.0 109.931 -176.52 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . 0.545 ' HB ' ' HA2' ' A' ' 28' ' ' GLY . 85.5 t -128.91 134.72 63.75 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.834 0 CA-C-O 121.439 0.638 . . . . 0.0 111.302 179.312 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 75.1 m-85 -118.22 -179.73 3.86 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.93 -0.577 . . . . 0.0 109.578 179.08 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 8.5 tp60 -107.13 142.4 36.88 Favored 'General case' 0 C--N 1.313 -0.992 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 177.364 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' GLU . . . . . 0.466 ' OE2' ' HG2' ' A' ' 63' ' ' ARG . 11.1 pt-20 -131.29 18.61 4.89 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.325 0.583 . . . . 0.0 111.117 176.497 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . 0.404 HE21 ' HB3' ' A' ' 61' ' ' SER . 99.2 mt-30 -66.77 -153.85 0.01 OUTLIER 'General case' 0 CA--C 1.542 0.653 0 CA-C-N 115.703 -0.681 . . . . 0.0 111.316 177.031 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 3.5 t -97.66 131.98 43.72 Favored 'General case' 0 C--N 1.31 -1.128 0 CA-C-O 121.463 0.649 . . . . 0.0 110.237 -177.614 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -90.89 48.53 3.02 Favored Glycine 0 N--CA 1.441 -1.016 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.301 -179.039 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.435 -1.429 0 CA-C-O 118.406 -1.219 . . . . 0.0 111.173 -179.779 . . . . . . . . 0 0 . 1 stop_ save_